data_16349_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16349
_Entry.PDB_ID 2KK1
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 1 A 2 2 GLY HA2 H 2 3.890 3.999 -0.109 1
1 2 . 1 1 1 A 2 2 GLY HA3 H 2 3.890 4.137 -0.247 1
1 3 . 1 1 1 A 2 2 GLY C C 2 174.200 173.257 0.943 1
1 4 . 1 1 1 A 2 2 GLY CA C 2 44.700 45.219 -0.519 1
1 5 . 1 1 1 A 3 3 HIS H H 3 8.380 8.552 -0.172 1
1 6 . 1 1 1 A 3 3 HIS HA H 3 4.610 4.741 -0.131 1
1 9 . 1 1 1 A 3 3 HIS C C 3 174.500 175.707 -1.207 1
1 10 . 1 1 1 A 3 3 HIS CA C 3 55.200 56.152 -0.952 1
1 11 . 1 1 1 A 3 3 HIS CB C 3 28.800 29.718 -0.918 1
1 12 . 1 1 1 A 3 3 HIS N N 3 117.600 123.060 -5.460 1
1 13 . 1 1 1 A 4 4 HIS H H 4 8.520 7.914 0.606 1
1 14 . 1 1 1 A 4 4 HIS HA H 4 4.640 4.332 0.308 1
1 17 . 1 1 1 A 4 4 HIS C C 4 174.200 175.547 -1.347 1
1 18 . 1 1 1 A 4 4 HIS CA C 4 55.100 58.640 -3.540 1
1 19 . 1 1 1 A 4 4 HIS CB C 4 28.900 30.487 -1.587 1
1 20 . 1 1 1 A 4 4 HIS N N 4 119.000 117.132 1.868 1
1 21 . 1 1 1 A 5 5 HIS H H 5 8.530 8.133 0.397 1
1 22 . 1 1 1 A 5 5 HIS HA H 5 4.410 4.776 -0.366 1
1 25 . 1 1 1 A 5 5 HIS CA C 5 54.900 54.407 0.493 1
1 26 . 1 1 1 A 5 5 HIS CB C 5 27.300 27.569 -0.269 1
1 27 . 1 1 1 A 5 5 HIS N N 5 121.600 114.536 7.064 1
1 28 . 1 1 1 A 6 6 HIS HA H 6 4.640 4.616 0.024 1
1 31 . 1 1 1 A 6 6 HIS C C 6 174.100 174.110 -0.010 1
1 32 . 1 1 1 A 6 6 HIS CA C 6 55.100 54.933 0.167 1
1 33 . 1 1 1 A 6 6 HIS CB C 6 29.100 28.982 0.118 1
1 34 . 1 1 1 A 7 7 HIS H H 7 8.690 8.382 0.308 1
1 35 . 1 1 1 A 7 7 HIS HA H 7 4.650 4.655 -0.005 1
1 38 . 1 1 1 A 7 7 HIS C C 7 174.200 173.608 0.592 1
1 39 . 1 1 1 A 7 7 HIS CA C 7 55.200 54.567 0.633 1
1 40 . 1 1 1 A 7 7 HIS CB C 7 29.300 32.548 -3.248 1
1 41 . 1 1 1 A 7 7 HIS N N 7 121.400 126.193 -4.793 1
1 42 . 1 1 1 A 8 8 HIS H H 8 8.660 8.736 -0.076 1
1 43 . 1 1 1 A 8 8 HIS HA H 8 4.700 4.657 0.043 1
1 46 . 1 1 1 A 8 8 HIS C C 8 174.200 175.232 -1.032 1
1 47 . 1 1 1 A 8 8 HIS CA C 8 55.000 56.811 -1.811 1
1 48 . 1 1 1 A 8 8 HIS CB C 8 29.300 30.209 -0.909 1
1 49 . 1 1 1 A 8 8 HIS N N 8 120.400 126.505 -6.105 1
1 50 . 1 1 1 A 9 9 SER H H 9 8.490 8.445 0.045 1
1 51 . 1 1 1 A 9 9 SER HA H 9 4.390 3.713 0.677 1
1 54 . 1 1 1 A 9 9 SER C C 9 174.100 173.576 0.524 1
1 55 . 1 1 1 A 9 9 SER CA C 9 58.300 58.792 -0.492 1
1 56 . 1 1 1 A 9 9 SER CB C 9 63.700 61.488 2.212 1
1 57 . 1 1 1 A 9 9 SER N N 9 118.100 117.098 1.002 1
1 58 . 1 1 1 A 10 10 HIS H H 10 8.710 7.885 0.825 1
1 59 . 1 1 1 A 10 10 HIS HA H 10 4.690 4.599 0.091 1
1 63 . 1 1 1 A 10 10 HIS C C 10 174.200 174.519 -0.319 1
1 64 . 1 1 1 A 10 10 HIS CA C 10 55.200 54.919 0.281 1
1 65 . 1 1 1 A 10 10 HIS CB C 10 28.800 29.028 -0.228 1
1 66 . 1 1 1 A 10 10 HIS N N 10 120.700 116.011 4.689 1
1 67 . 1 1 1 A 11 11 MET H H 11 8.410 7.848 0.562 1
1 68 . 1 1 1 A 11 11 MET HA H 11 4.420 4.345 0.075 1
1 76 . 1 1 1 A 11 11 MET C C 11 175.800 175.890 -0.090 1
1 77 . 1 1 1 A 11 11 MET CA C 11 55.100 54.912 0.188 1
1 78 . 1 1 1 A 11 11 MET CB C 11 32.800 31.924 0.876 1
1 81 . 1 1 1 A 11 11 MET N N 11 122.300 125.406 -3.106 1
1 82 . 1 1 1 A 12 12 ALA H H 12 8.440 8.363 0.077 1
1 83 . 1 1 1 A 12 12 ALA HA H 12 4.280 4.223 0.057 1
1 87 . 1 1 1 A 12 12 ALA C C 12 177.400 176.848 0.552 1
1 88 . 1 1 1 A 12 12 ALA CA C 12 52.400 51.884 0.516 1
1 89 . 1 1 1 A 12 12 ALA CB C 12 18.800 17.764 1.036 1
1 90 . 1 1 1 A 12 12 ALA N N 12 125.900 125.807 0.093 1
1 91 . 1 1 1 A 13 13 ASN H H 13 8.440 8.541 -0.101 1
1 92 . 1 1 1 A 13 13 ASN HA H 13 4.660 5.015 -0.355 1
1 97 . 1 1 1 A 13 13 ASN C C 13 175.900 175.090 0.810 1
1 98 . 1 1 1 A 13 13 ASN CA C 13 53.200 52.926 0.274 1
1 99 . 1 1 1 A 13 13 ASN CB C 13 38.800 38.882 -0.082 1
1 100 . 1 1 1 A 13 13 ASN N N 13 118.300 119.502 -1.202 1
1 102 . 1 1 1 A 14 14 GLY H H 14 8.370 8.663 -0.293 1
1 103 . 1 1 1 A 14 14 GLY HA2 H 14 3.920 4.193 -0.273 1
1 104 . 1 1 1 A 14 14 GLY HA3 H 14 3.920 4.193 -0.273 1
1 105 . 1 1 1 A 14 14 GLY C C 14 174.000 171.981 2.019 1
1 106 . 1 1 1 A 14 14 GLY CA C 14 45.200 45.524 -0.324 1
1 107 . 1 1 1 A 14 14 GLY N N 14 109.600 110.312 -0.712 1
1 108 . 1 1 1 A 15 15 ALA H H 15 8.140 8.836 -0.696 1
1 109 . 1 1 1 A 15 15 ALA HA H 15 4.280 4.800 -0.520 1
1 113 . 1 1 1 A 15 15 ALA C C 15 177.300 175.715 1.585 1
1 114 . 1 1 1 A 15 15 ALA CA C 15 52.500 51.207 1.293 1
1 115 . 1 1 1 A 15 15 ALA CB C 15 19.100 19.416 -0.316 1
1 116 . 1 1 1 A 15 15 ALA N N 15 123.800 127.717 -3.917 1
1 117 . 1 1 1 A 16 16 ALA H H 16 8.030 8.351 -0.321 1
1 118 . 1 1 1 A 16 16 ALA HA H 16 4.280 4.271 0.009 1
1 122 . 1 1 1 A 16 16 ALA C C 16 178.400 178.214 0.186 1
1 123 . 1 1 1 A 16 16 ALA CA C 16 52.600 52.568 0.032 1
1 124 . 1 1 1 A 16 16 ALA CB C 16 19.100 18.494 0.606 1
1 125 . 1 1 1 A 16 16 ALA N N 16 122.300 126.135 -3.835 1
1 126 . 1 1 1 A 17 17 GLY H H 17 8.320 8.726 -0.406 1
1 127 . 1 1 1 A 17 17 GLY HA2 H 17 3.960 3.995 -0.035 1
1 128 . 1 1 1 A 17 17 GLY HA3 H 17 3.960 3.996 -0.036 1
1 129 . 1 1 1 A 17 17 GLY C C 17 174.500 175.714 -1.214 1
1 130 . 1 1 1 A 17 17 GLY CA C 17 45.200 45.586 -0.386 1
1 131 . 1 1 1 A 17 17 GLY N N 17 107.800 112.897 -5.097 1
1 132 . 1 1 1 A 18 18 THR H H 18 7.970 8.203 -0.233 1
1 133 . 1 1 1 A 18 18 THR HA H 18 4.290 4.030 0.260 1
1 138 . 1 1 1 A 18 18 THR C C 18 174.600 176.320 -1.720 1
1 139 . 1 1 1 A 18 18 THR CA C 18 62.000 66.275 -4.275 1
1 140 . 1 1 1 A 18 18 THR CB C 18 69.700 68.740 0.960 1
1 142 . 1 1 1 A 18 18 THR N N 18 113.800 115.816 -2.016 1
1 143 . 1 1 1 A 19 19 LYS H H 19 8.350 8.305 0.045 1
1 144 . 1 1 1 A 19 19 LYS HA H 19 4.270 4.327 -0.057 1
1 153 . 1 1 1 A 19 19 LYS C C 19 176.600 175.870 0.730 1
1 154 . 1 1 1 A 19 19 LYS CA C 19 56.500 57.764 -1.264 1
1 155 . 1 1 1 A 19 19 LYS CB C 19 32.800 32.382 0.418 1
1 159 . 1 1 1 A 19 19 LYS N N 19 124.000 118.234 5.766 1
1 160 . 1 1 1 A 20 20 VAL H H 20 8.060 7.857 0.203 1
1 161 . 1 1 1 A 20 20 VAL HA H 20 3.990 4.299 -0.309 1
1 169 . 1 1 1 A 20 20 VAL C C 20 175.900 175.005 0.895 1
1 170 . 1 1 1 A 20 20 VAL CA C 20 62.400 61.675 0.725 1
1 171 . 1 1 1 A 20 20 VAL CB C 20 32.600 32.600 0.000 1
1 174 . 1 1 1 A 20 20 VAL N N 20 121.700 120.875 0.825 1
1 175 . 1 1 1 A 21 21 ALA H H 21 8.310 8.374 -0.064 1
1 176 . 1 1 1 A 21 21 ALA HA H 21 4.290 4.518 -0.228 1
1 180 . 1 1 1 A 21 21 ALA C C 21 177.600 177.236 0.364 1
1 181 . 1 1 1 A 21 21 ALA CA C 21 52.400 52.743 -0.343 1
1 182 . 1 1 1 A 21 21 ALA CB C 21 19.000 19.608 -0.608 1
1 183 . 1 1 1 A 21 21 ALA N N 21 127.700 129.672 -1.972 1
1 184 . 1 1 1 A 22 22 LEU H H 22 8.150 8.186 -0.036 1
1 185 . 1 1 1 A 22 22 LEU HA H 22 4.280 4.375 -0.095 1
1 195 . 1 1 1 A 22 22 LEU C C 22 177.400 177.340 0.060 1
1 196 . 1 1 1 A 22 22 LEU CA C 22 55.200 54.669 0.531 1
1 197 . 1 1 1 A 22 22 LEU CB C 22 42.200 41.344 0.856 1
1 201 . 1 1 1 A 22 22 LEU N N 22 121.800 120.071 1.729 1
1 202 . 1 1 1 A 23 23 ARG H H 23 8.240 7.758 0.482 1
1 203 . 1 1 1 A 23 23 ARG HA H 23 4.290 4.078 0.212 1
1 211 . 1 1 1 A 23 23 ARG C C 23 176.300 178.400 -2.100 1
1 212 . 1 1 1 A 23 23 ARG CA C 23 56.000 58.571 -2.571 1
1 213 . 1 1 1 A 23 23 ARG CB C 23 30.600 30.006 0.594 1
1 216 . 1 1 1 A 23 23 ARG N N 23 122.000 121.518 0.482 1
1 218 . 1 1 1 A 24 24 LYS H H 24 8.370 7.890 0.480 1
1 219 . 1 1 1 A 24 24 LYS HA H 24 4.330 4.134 0.196 1
1 228 . 1 1 1 A 24 24 LYS C C 24 176.800 176.813 -0.013 1
1 229 . 1 1 1 A 24 24 LYS CA C 24 56.400 59.432 -3.032 1
1 230 . 1 1 1 A 24 24 LYS CB C 24 32.700 32.444 0.256 1
1 234 . 1 1 1 A 24 24 LYS N N 24 122.900 118.255 4.645 1
1 235 . 1 1 1 A 25 25 THR H H 25 8.100 7.447 0.653 1
1 236 . 1 1 1 A 25 25 THR HA H 25 4.290 4.853 -0.563 1
1 241 . 1 1 1 A 25 25 THR C C 25 174.600 173.808 0.792 1
1 242 . 1 1 1 A 25 25 THR CA C 25 61.500 59.802 1.698 1
1 243 . 1 1 1 A 25 25 THR CB C 25 69.800 71.686 -1.886 1
1 245 . 1 1 1 A 25 25 THR N N 25 115.500 109.921 5.579 1
1 246 . 1 1 1 A 26 26 LYS H H 26 8.370 8.320 0.050 1
1 247 . 1 1 1 A 26 26 LYS HA H 26 4.270 4.691 -0.421 1
1 256 . 1 1 1 A 26 26 LYS C C 26 176.600 175.993 0.607 1
1 257 . 1 1 1 A 26 26 LYS CA C 26 56.600 54.819 1.781 1
1 258 . 1 1 1 A 26 26 LYS CB C 26 32.700 34.625 -1.925 1
1 262 . 1 1 1 A 26 26 LYS N N 26 123.700 120.235 3.465 1
1 263 . 1 1 1 A 27 27 GLN H H 27 8.390 8.589 -0.199 1
1 264 . 1 1 1 A 27 27 GLN HA H 27 4.240 4.578 -0.338 1
1 271 . 1 1 1 A 27 27 GLN C C 27 175.900 175.583 0.317 1
1 272 . 1 1 1 A 27 27 GLN CA C 27 56.100 56.187 -0.087 1
1 273 . 1 1 1 A 27 27 GLN CB C 27 29.300 30.462 -1.162 1
1 275 . 1 1 1 A 27 27 GLN N N 27 121.700 117.179 4.521 1
1 277 . 1 1 1 A 28 28 ALA H H 28 8.330 7.670 0.660 1
1 278 . 1 1 1 A 28 28 ALA HA H 28 4.240 4.456 -0.216 1
1 282 . 1 1 1 A 28 28 ALA C C 28 177.700 177.447 0.253 1
1 283 . 1 1 1 A 28 28 ALA CA C 28 52.500 51.978 0.522 1
1 284 . 1 1 1 A 28 28 ALA CB C 28 19.100 21.649 -2.549 1
1 285 . 1 1 1 A 28 28 ALA N N 28 125.400 119.790 5.610 1
1 286 . 1 1 1 A 29 29 ALA H H 29 8.250 9.004 -0.754 1
1 287 . 1 1 1 A 29 29 ALA HA H 29 4.230 3.932 0.298 1
1 291 . 1 1 1 A 29 29 ALA C C 29 178.000 179.579 -1.579 1
1 292 . 1 1 1 A 29 29 ALA CA C 29 52.500 55.353 -2.853 1
1 293 . 1 1 1 A 29 29 ALA CB C 29 19.100 18.291 0.809 1
1 294 . 1 1 1 A 29 29 ALA N N 29 123.000 126.969 -3.969 1
1 295 . 1 1 1 A 30 30 GLU H H 30 8.260 8.363 -0.103 1
1 296 . 1 1 1 A 30 30 GLU HA H 30 4.220 4.012 0.208 1
1 301 . 1 1 1 A 30 30 GLU C C 30 176.500 178.472 -1.972 1
1 302 . 1 1 1 A 30 30 GLU CA C 30 56.400 59.510 -3.110 1
1 303 . 1 1 1 A 30 30 GLU CB C 30 29.500 29.330 0.170 1
1 305 . 1 1 1 A 30 30 GLU N N 30 119.700 117.886 1.814 1
1 306 . 1 1 1 A 31 31 LYS H H 31 8.230 7.715 0.515 1
1 307 . 1 1 1 A 31 31 LYS HA H 31 4.280 4.107 0.173 1
1 316 . 1 1 1 A 31 31 LYS C C 31 176.500 177.035 -0.535 1
1 317 . 1 1 1 A 31 31 LYS CA C 31 56.400 58.534 -2.134 1
1 318 . 1 1 1 A 31 31 LYS CB C 31 32.800 32.367 0.433 1
1 322 . 1 1 1 A 31 31 LYS N N 31 122.700 118.651 4.049 1
1 323 . 1 1 1 A 32 32 ILE H H 32 8.140 7.571 0.569 1
1 324 . 1 1 1 A 32 32 ILE HA H 32 4.110 4.082 0.028 1
1 334 . 1 1 1 A 32 32 ILE C C 32 176.400 176.153 0.247 1
1 335 . 1 1 1 A 32 32 ILE CA C 32 61.200 61.759 -0.559 1
1 336 . 1 1 1 A 32 32 ILE CB C 32 38.600 37.188 1.412 1
1 340 . 1 1 1 A 32 32 ILE N N 32 122.300 119.998 2.302 1
1 341 . 1 1 1 A 33 33 SER H H 33 8.230 8.957 -0.727 1
1 342 . 1 1 1 A 33 33 SER HA H 33 4.400 4.017 0.383 1
1 345 . 1 1 1 A 33 33 SER C C 33 174.800 176.697 -1.897 1
1 346 . 1 1 1 A 33 33 SER CA C 33 58.300 62.117 -3.817 1
1 347 . 1 1 1 A 33 33 SER CB C 33 63.700 62.850 0.850 1
1 348 . 1 1 1 A 33 33 SER N N 33 119.600 122.450 -2.850 1
1 349 . 1 1 1 A 34 34 ALA H H 34 8.430 8.544 -0.114 1
1 350 . 1 1 1 A 34 34 ALA HA H 34 4.220 3.976 0.244 1
1 354 . 1 1 1 A 34 34 ALA C C 34 179.500 180.350 -0.850 1
1 355 . 1 1 1 A 34 34 ALA CA C 34 53.500 55.209 -1.709 1
1 356 . 1 1 1 A 34 34 ALA CB C 34 18.800 18.106 0.694 1
1 357 . 1 1 1 A 34 34 ALA N N 34 126.000 123.369 2.631 1
1 358 . 1 1 1 A 35 35 ASP H H 35 8.380 7.990 0.390 1
1 359 . 1 1 1 A 35 35 ASP HA H 35 4.520 4.375 0.145 1
1 362 . 1 1 1 A 35 35 ASP C C 35 176.500 178.538 -2.038 1
1 363 . 1 1 1 A 35 35 ASP CA C 35 54.800 56.414 -1.614 1
1 364 . 1 1 1 A 35 35 ASP CB C 35 40.200 40.954 -0.754 1
1 365 . 1 1 1 A 35 35 ASP N N 35 118.200 118.431 -0.231 1
1 366 . 1 1 1 A 36 36 LYS H H 36 8.000 7.865 0.135 1
1 367 . 1 1 1 A 36 36 LYS HA H 36 4.270 4.078 0.192 1
1 376 . 1 1 1 A 36 36 LYS C C 36 177.000 177.020 -0.020 1
1 377 . 1 1 1 A 36 36 LYS CA C 36 56.800 58.446 -1.646 1
1 378 . 1 1 1 A 36 36 LYS CB C 36 32.900 32.036 0.864 1
1 382 . 1 1 1 A 36 36 LYS N N 36 120.900 118.121 2.779 1
1 383 . 1 1 1 A 37 37 ILE H H 37 7.970 7.308 0.662 1
1 384 . 1 1 1 A 37 37 ILE HA H 37 4.020 3.869 0.151 1
1 394 . 1 1 1 A 37 37 ILE C C 37 176.100 175.450 0.650 1
1 395 . 1 1 1 A 37 37 ILE CA C 37 61.300 62.243 -0.943 1
1 396 . 1 1 1 A 37 37 ILE CB C 37 38.100 37.706 0.394 1
1 400 . 1 1 1 A 37 37 ILE N N 37 121.800 121.907 -0.107 1
1 401 . 1 1 1 A 38 38 SER H H 38 7.980 8.825 -0.845 1
1 402 . 1 1 1 A 38 38 SER HA H 38 4.540 4.637 -0.097 1
1 405 . 1 1 1 A 38 38 SER C C 38 174.700 175.524 -0.824 1
1 406 . 1 1 1 A 38 38 SER CA C 38 58.200 58.345 -0.145 1
1 407 . 1 1 1 A 38 38 SER CB C 38 64.400 64.225 0.175 1
1 408 . 1 1 1 A 38 38 SER N N 38 119.000 124.670 -5.670 1
1 409 . 1 1 1 A 39 39 LYS H H 39 8.690 8.986 -0.296 1
1 410 . 1 1 1 A 39 39 LYS HA H 39 3.400 3.589 -0.189 1
1 419 . 1 1 1 A 39 39 LYS C C 39 177.400 178.080 -0.680 1
1 420 . 1 1 1 A 39 39 LYS CA C 39 59.800 60.460 -0.660 1
1 421 . 1 1 1 A 39 39 LYS CB C 39 32.400 32.278 0.122 1
1 425 . 1 1 1 A 39 39 LYS N N 39 124.200 125.501 -1.301 1
1 426 . 1 1 1 A 40 40 GLU H H 40 8.280 8.451 -0.171 1
1 427 . 1 1 1 A 40 40 GLU HA H 40 3.840 4.054 -0.214 1
1 432 . 1 1 1 A 40 40 GLU C C 40 178.400 179.057 -0.657 1
1 433 . 1 1 1 A 40 40 GLU CA C 40 59.400 59.423 -0.023 1
1 434 . 1 1 1 A 40 40 GLU CB C 40 28.300 29.346 -1.046 1
1 436 . 1 1 1 A 40 40 GLU N N 40 116.300 117.461 -1.161 1
1 437 . 1 1 1 A 41 41 ALA H H 41 7.890 8.042 -0.152 1
1 438 . 1 1 1 A 41 41 ALA HA H 41 3.910 4.115 -0.205 1
1 442 . 1 1 1 A 41 41 ALA C C 41 179.900 180.150 -0.250 1
1 443 . 1 1 1 A 41 41 ALA CA C 41 54.700 55.369 -0.669 1
1 444 . 1 1 1 A 41 41 ALA CB C 41 17.900 18.088 -0.188 1
1 445 . 1 1 1 A 41 41 ALA N N 41 122.300 122.311 -0.011 1
1 446 . 1 1 1 A 42 42 LEU H H 42 7.490 8.079 -0.589 1
1 447 . 1 1 1 A 42 42 LEU HA H 42 3.480 4.058 -0.578 1
1 457 . 1 1 1 A 42 42 LEU C C 42 178.900 178.649 0.251 1
1 458 . 1 1 1 A 42 42 LEU CA C 42 59.800 57.908 1.892 1
1 459 . 1 1 1 A 42 42 LEU CB C 42 42.300 41.427 0.873 1
1 463 . 1 1 1 A 42 42 LEU N N 42 121.000 119.368 1.632 1
1 464 . 1 1 1 A 43 43 LEU H H 43 8.290 7.984 0.306 1
1 465 . 1 1 1 A 43 43 LEU HA H 43 3.780 3.856 -0.076 1
1 475 . 1 1 1 A 43 43 LEU C C 43 179.400 179.207 0.193 1
1 476 . 1 1 1 A 43 43 LEU CA C 43 57.600 57.990 -0.390 1
1 477 . 1 1 1 A 43 43 LEU CB C 43 40.900 41.586 -0.686 1
1 481 . 1 1 1 A 43 43 LEU N N 43 119.200 118.243 0.957 1
1 482 . 1 1 1 A 44 44 GLU H H 44 8.330 8.265 0.065 1
1 483 . 1 1 1 A 44 44 GLU HA H 44 4.050 3.960 0.090 1
1 488 . 1 1 1 A 44 44 GLU C C 44 178.600 179.435 -0.835 1
1 489 . 1 1 1 A 44 44 GLU CA C 44 58.900 59.255 -0.355 1
1 490 . 1 1 1 A 44 44 GLU CB C 44 28.300 29.574 -1.274 1
1 492 . 1 1 1 A 44 44 GLU N N 44 119.600 117.684 1.916 1
1 493 . 1 1 1 A 45 45 CYS H H 45 7.690 8.177 -0.487 1
1 494 . 1 1 1 A 45 45 CYS HA H 45 4.120 4.030 0.090 1
1 497 . 1 1 1 A 45 45 CYS C C 45 176.100 176.719 -0.619 1
1 498 . 1 1 1 A 45 45 CYS CA C 45 62.500 62.855 -0.355 1
1 499 . 1 1 1 A 45 45 CYS CB C 45 26.200 25.971 0.229 1
1 500 . 1 1 1 A 45 45 CYS N N 45 120.900 118.825 2.075 1
1 501 . 1 1 1 A 46 46 ALA H H 46 8.540 7.942 0.598 1
1 502 . 1 1 1 A 46 46 ALA HA H 46 3.900 3.947 -0.047 1
1 506 . 1 1 1 A 46 46 ALA C C 46 179.200 179.081 0.119 1
1 507 . 1 1 1 A 46 46 ALA CA C 46 55.500 55.401 0.099 1
1 508 . 1 1 1 A 46 46 ALA CB C 46 16.800 17.860 -1.060 1
1 509 . 1 1 1 A 46 46 ALA N N 46 121.500 121.954 -0.454 1
1 510 . 1 1 1 A 47 47 ASP H H 47 8.460 8.114 0.346 1
1 511 . 1 1 1 A 47 47 ASP HA H 47 4.340 4.508 -0.168 1
1 514 . 1 1 1 A 47 47 ASP C C 47 178.800 178.658 0.142 1
1 515 . 1 1 1 A 47 47 ASP CA C 47 56.600 56.966 -0.366 1
1 516 . 1 1 1 A 47 47 ASP CB C 47 39.800 42.436 -2.636 1
1 517 . 1 1 1 A 47 47 ASP N N 47 119.000 118.696 0.304 1
1 518 . 1 1 1 A 48 48 LEU H H 48 8.040 7.799 0.241 1
1 519 . 1 1 1 A 48 48 LEU HA H 48 4.110 3.985 0.125 1
1 529 . 1 1 1 A 48 48 LEU C C 48 180.000 179.597 0.403 1
1 530 . 1 1 1 A 48 48 LEU CA C 48 58.000 58.218 -0.218 1
1 531 . 1 1 1 A 48 48 LEU CB C 48 41.700 41.634 0.066 1
1 535 . 1 1 1 A 48 48 LEU N N 48 123.000 119.802 3.198 1
1 536 . 1 1 1 A 49 49 LEU H H 49 8.300 7.758 0.542 1
1 537 . 1 1 1 A 49 49 LEU HA H 49 4.110 3.889 0.221 1
1 547 . 1 1 1 A 49 49 LEU C C 49 177.200 178.741 -1.541 1
1 548 . 1 1 1 A 49 49 LEU CA C 49 57.600 57.973 -0.373 1
1 549 . 1 1 1 A 49 49 LEU CB C 49 41.200 41.809 -0.609 1
1 553 . 1 1 1 A 49 49 LEU N N 49 120.900 119.543 1.357 1
1 554 . 1 1 1 A 50 50 SER H H 50 8.660 8.333 0.327 1
1 555 . 1 1 1 A 50 50 SER HA H 50 4.000 4.194 -0.194 1
1 558 . 1 1 1 A 50 50 SER C C 50 176.800 176.679 0.121 1
1 559 . 1 1 1 A 50 50 SER CA C 50 62.500 61.611 0.889 1
1 560 . 1 1 1 A 50 50 SER CB C 50 62.600 62.373 0.227 1
1 561 . 1 1 1 A 50 50 SER N N 50 113.300 113.126 0.174 1
1 562 . 1 1 1 A 51 51 SER H H 51 7.980 7.905 0.075 1
1 563 . 1 1 1 A 51 51 SER HA H 51 4.220 4.089 0.131 1
1 566 . 1 1 1 A 51 51 SER C C 51 176.300 176.956 -0.656 1
1 567 . 1 1 1 A 51 51 SER CA C 51 61.200 61.593 -0.393 1
1 568 . 1 1 1 A 51 51 SER CB C 51 62.700 62.858 -0.158 1
1 569 . 1 1 1 A 51 51 SER N N 51 115.900 117.007 -1.107 1
1 570 . 1 1 1 A 52 52 ALA H H 52 8.030 8.048 -0.018 1
1 571 . 1 1 1 A 52 52 ALA HA H 52 4.130 4.138 -0.008 1
1 575 . 1 1 1 A 52 52 ALA C C 52 178.500 178.718 -0.218 1
1 576 . 1 1 1 A 52 52 ALA CA C 52 54.500 54.481 0.019 1
1 577 . 1 1 1 A 52 52 ALA CB C 52 18.000 18.195 -0.195 1
1 578 . 1 1 1 A 52 52 ALA N N 52 125.400 122.992 2.408 1
1 579 . 1 1 1 A 53 53 LEU H H 53 7.710 7.910 -0.200 1
1 580 . 1 1 1 A 53 53 LEU HA H 53 4.180 4.282 -0.102 1
1 590 . 1 1 1 A 53 53 LEU C C 53 177.700 177.613 0.087 1
1 591 . 1 1 1 A 53 53 LEU CA C 53 56.500 55.616 0.884 1
1 592 . 1 1 1 A 53 53 LEU CB C 53 42.400 42.040 0.360 1
1 596 . 1 1 1 A 53 53 LEU N N 53 113.800 116.738 -2.938 1
1 597 . 1 1 1 A 54 54 THR H H 54 7.550 7.583 -0.033 1
1 598 . 1 1 1 A 54 54 THR HA H 54 4.420 4.595 -0.175 1
1 603 . 1 1 1 A 54 54 THR C C 54 174.100 174.516 -0.416 1
1 604 . 1 1 1 A 54 54 THR CA C 54 61.600 61.736 -0.136 1
1 605 . 1 1 1 A 54 54 THR CB C 54 69.300 70.496 -1.196 1
1 607 . 1 1 1 A 54 54 THR N N 54 107.700 107.300 0.400 1
1 608 . 1 1 1 A 55 55 GLU H H 55 7.750 7.797 -0.047 1
1 609 . 1 1 1 A 55 55 GLU HA H 55 4.760 4.666 0.094 1
1 614 . 1 1 1 A 55 55 GLU CA C 55 53.400 54.331 -0.931 1
1 615 . 1 1 1 A 55 55 GLU CB C 55 30.100 30.523 -0.423 1
1 617 . 1 1 1 A 55 55 GLU N N 55 122.800 120.916 1.884 1
1 618 . 1 1 1 A 56 56 PRO HA H 56 4.670 4.716 -0.046 1
1 625 . 1 1 1 A 56 56 PRO C C 56 176.200 176.464 -0.264 1
1 626 . 1 1 1 A 56 56 PRO CA C 56 62.900 62.928 -0.028 1
1 627 . 1 1 1 A 56 56 PRO CB C 56 29.200 31.734 -2.534 1
1 630 . 1 1 1 A 57 57 VAL H H 57 8.010 8.378 -0.368 1
1 631 . 1 1 1 A 57 57 VAL HA H 57 4.590 4.946 -0.356 1
1 639 . 1 1 1 A 57 57 VAL CA C 57 58.600 58.307 0.293 1
1 640 . 1 1 1 A 57 57 VAL CB C 57 32.800 34.964 -2.164 1
1 643 . 1 1 1 A 57 57 VAL N N 57 121.400 117.380 4.020 1
1 644 . 1 1 1 A 58 58 PRO HA H 58 4.450 4.565 -0.115 1
1 651 . 1 1 1 A 58 58 PRO C C 58 177.500 177.848 -0.348 1
1 652 . 1 1 1 A 58 58 PRO CA C 58 62.600 62.799 -0.199 1
1 653 . 1 1 1 A 58 58 PRO CB C 58 32.200 32.855 -0.655 1
1 656 . 1 1 1 A 59 59 ASN H H 59 8.890 9.224 -0.334 1
1 657 . 1 1 1 A 59 59 ASN HA H 59 4.330 4.446 -0.116 1
1 662 . 1 1 1 A 59 59 ASN C C 59 177.600 177.213 0.387 1
1 663 . 1 1 1 A 59 59 ASN CA C 59 56.300 56.104 0.196 1
1 664 . 1 1 1 A 59 59 ASN CB C 59 38.400 38.906 -0.506 1
1 665 . 1 1 1 A 59 59 ASN N N 59 122.200 122.797 -0.597 1
1 667 . 1 1 1 A 60 60 SER H H 60 8.660 8.080 0.580 1
1 668 . 1 1 1 A 60 60 SER HA H 60 4.010 4.050 -0.040 1
1 671 . 1 1 1 A 60 60 SER C C 60 176.200 177.328 -1.128 1
1 672 . 1 1 1 A 60 60 SER CA C 60 60.800 61.531 -0.731 1
1 673 . 1 1 1 A 60 60 SER CB C 60 61.500 62.955 -1.455 1
1 674 . 1 1 1 A 60 60 SER N N 60 113.200 113.936 -0.736 1
1 675 . 1 1 1 A 61 61 GLN H H 61 7.420 7.661 -0.241 1
1 676 . 1 1 1 A 61 61 GLN HA H 61 4.280 4.056 0.224 1
1 683 . 1 1 1 A 61 61 GLN C C 61 178.600 178.456 0.144 1
1 684 . 1 1 1 A 61 61 GLN CA C 61 57.900 58.850 -0.950 1
1 685 . 1 1 1 A 61 61 GLN CB C 61 28.600 28.165 0.435 1
1 687 . 1 1 1 A 61 61 GLN N N 61 122.200 120.608 1.592 1
1 689 . 1 1 1 A 62 62 LEU H H 62 7.430 8.038 -0.608 1
1 690 . 1 1 1 A 62 62 LEU HA H 62 3.850 4.001 -0.151 1
1 700 . 1 1 1 A 62 62 LEU C C 62 178.800 179.241 -0.441 1
1 701 . 1 1 1 A 62 62 LEU CA C 62 57.900 58.152 -0.252 1
1 702 . 1 1 1 A 62 62 LEU CB C 62 42.100 42.017 0.083 1
1 706 . 1 1 1 A 62 62 LEU N N 62 120.600 119.871 0.729 1
1 707 . 1 1 1 A 63 63 VAL H H 63 8.200 8.318 -0.118 1
1 708 . 1 1 1 A 63 63 VAL HA H 63 3.370 3.508 -0.138 1
1 716 . 1 1 1 A 63 63 VAL C C 63 178.000 177.890 0.110 1
1 717 . 1 1 1 A 63 63 VAL CA C 63 66.600 67.019 -0.419 1
1 718 . 1 1 1 A 63 63 VAL CB C 63 31.700 31.416 0.284 1
1 721 . 1 1 1 A 63 63 VAL N N 63 118.200 117.336 0.864 1
1 722 . 1 1 1 A 64 64 ASP H H 64 7.960 8.316 -0.356 1
1 723 . 1 1 1 A 64 64 ASP HA H 64 4.460 4.276 0.184 1
1 726 . 1 1 1 A 64 64 ASP C C 64 178.100 178.609 -0.509 1
1 727 . 1 1 1 A 64 64 ASP CA C 64 57.700 57.498 0.202 1
1 728 . 1 1 1 A 64 64 ASP CB C 64 39.800 41.199 -1.399 1
1 729 . 1 1 1 A 64 64 ASP N N 64 120.200 120.281 -0.081 1
1 730 . 1 1 1 A 65 65 THR H H 65 8.380 8.230 0.150 1
1 731 . 1 1 1 A 65 65 THR HA H 65 3.970 4.029 -0.059 1
1 736 . 1 1 1 A 65 65 THR C C 65 176.500 177.204 -0.704 1
1 737 . 1 1 1 A 65 65 THR CA C 65 66.500 66.727 -0.227 1
1 738 . 1 1 1 A 65 65 THR CB C 65 67.800 67.755 0.045 1
1 740 . 1 1 1 A 65 65 THR N N 65 118.100 116.217 1.883 1
1 741 . 1 1 1 A 66 66 GLY H H 66 8.900 8.346 0.554 1
1 742 . 1 1 1 A 66 66 GLY HA2 H 66 3.630 3.730 -0.100 1
1 743 . 1 1 1 A 66 66 GLY HA3 H 66 3.630 3.756 -0.126 1
1 744 . 1 1 1 A 66 66 GLY C C 66 174.200 175.615 -1.415 1
1 745 . 1 1 1 A 66 66 GLY CA C 66 47.500 46.975 0.525 1
1 746 . 1 1 1 A 66 66 GLY N N 66 110.500 108.010 2.490 1
1 747 . 1 1 1 A 67 67 HIS H H 67 8.650 8.393 0.257 1
1 748 . 1 1 1 A 67 67 HIS HA H 67 4.220 4.124 0.096 1
1 752 . 1 1 1 A 67 67 HIS C C 67 176.900 177.450 -0.550 1
1 753 . 1 1 1 A 67 67 HIS CA C 67 59.000 59.351 -0.351 1
1 754 . 1 1 1 A 67 67 HIS CB C 67 27.800 29.844 -2.044 1
1 756 . 1 1 1 A 67 67 HIS N N 67 120.100 122.066 -1.966 1
1 757 . 1 1 1 A 68 68 GLN H H 68 7.860 8.350 -0.490 1
1 758 . 1 1 1 A 68 68 GLN HA H 68 3.990 3.971 0.019 1
1 765 . 1 1 1 A 68 68 GLN C C 68 177.800 178.193 -0.393 1
1 766 . 1 1 1 A 68 68 GLN CA C 68 58.800 58.498 0.302 1
1 767 . 1 1 1 A 68 68 GLN CB C 68 28.200 27.678 0.522 1
1 769 . 1 1 1 A 68 68 GLN N N 68 121.400 116.918 4.482 1
1 771 . 1 1 1 A 69 69 LEU H H 69 8.300 7.894 0.406 1
1 772 . 1 1 1 A 69 69 LEU HA H 69 4.330 3.920 0.410 1
1 782 . 1 1 1 A 69 69 LEU C C 69 179.300 179.888 -0.588 1
1 783 . 1 1 1 A 69 69 LEU CA C 69 58.200 58.035 0.165 1
1 784 . 1 1 1 A 69 69 LEU CB C 69 40.500 40.910 -0.410 1
1 788 . 1 1 1 A 69 69 LEU N N 69 120.300 121.615 -1.315 1
1 789 . 1 1 1 A 70 70 LEU H H 70 8.460 8.116 0.344 1
1 790 . 1 1 1 A 70 70 LEU HA H 70 3.880 3.997 -0.117 1
1 800 . 1 1 1 A 70 70 LEU C C 70 179.100 179.160 -0.060 1
1 801 . 1 1 1 A 70 70 LEU CA C 70 58.300 58.149 0.151 1
1 802 . 1 1 1 A 70 70 LEU CB C 70 41.500 40.985 0.515 1
1 806 . 1 1 1 A 70 70 LEU N N 70 121.200 120.235 0.965 1
1 807 . 1 1 1 A 71 71 ASP H H 71 8.140 7.968 0.172 1
1 808 . 1 1 1 A 71 71 ASP HA H 71 4.420 4.333 0.087 1
1 811 . 1 1 1 A 71 71 ASP C C 71 180.000 178.334 1.666 1
1 812 . 1 1 1 A 71 71 ASP CA C 71 57.300 57.281 0.019 1
1 813 . 1 1 1 A 71 71 ASP CB C 71 39.300 41.007 -1.707 1
1 814 . 1 1 1 A 71 71 ASP N N 71 121.100 119.122 1.978 1
1 815 . 1 1 1 A 72 72 TYR H H 72 8.320 8.321 -0.001 1
1 816 . 1 1 1 A 72 72 TYR HA H 72 4.550 4.442 0.108 1
1 823 . 1 1 1 A 72 72 TYR C C 72 179.100 178.596 0.504 1
1 824 . 1 1 1 A 72 72 TYR CA C 72 60.500 60.964 -0.464 1
1 825 . 1 1 1 A 72 72 TYR CB C 72 37.600 38.124 -0.524 1
1 828 . 1 1 1 A 72 72 TYR N N 72 120.300 118.461 1.839 1
1 829 . 1 1 1 A 73 73 CYS H H 73 8.850 8.627 0.223 1
1 830 . 1 1 1 A 73 73 CYS HA H 73 4.380 4.533 -0.153 1
1 834 . 1 1 1 A 73 73 CYS C C 73 177.300 177.177 0.123 1
1 835 . 1 1 1 A 73 73 CYS CA C 73 64.400 63.541 0.859 1
1 836 . 1 1 1 A 73 73 CYS CB C 73 27.600 26.757 0.843 1
1 837 . 1 1 1 A 73 73 CYS N N 73 116.800 118.516 -1.716 1
1 838 . 1 1 1 A 74 74 SER H H 74 8.410 8.317 0.093 1
1 839 . 1 1 1 A 74 74 SER HA H 74 4.290 4.307 -0.017 1
1 842 . 1 1 1 A 74 74 SER C C 74 176.300 177.272 -0.972 1
1 843 . 1 1 1 A 74 74 SER CA C 74 61.400 62.392 -0.992 1
1 844 . 1 1 1 A 74 74 SER CB C 74 62.600 62.868 -0.268 1
1 845 . 1 1 1 A 74 74 SER N N 74 115.900 117.118 -1.218 1
1 846 . 1 1 1 A 75 75 GLY H H 75 7.790 8.104 -0.314 1
1 847 . 1 1 1 A 75 75 GLY HA2 H 75 4.320 3.769 0.551 1
1 848 . 1 1 1 A 75 75 GLY HA3 H 75 3.900 3.776 0.124 1
1 849 . 1 1 1 A 75 75 GLY C C 75 174.600 175.326 -0.726 1
1 850 . 1 1 1 A 75 75 GLY CA C 75 45.600 46.940 -1.340 1
1 851 . 1 1 1 A 75 75 GLY N N 75 107.500 108.934 -1.434 1
1 852 . 1 1 1 A 76 76 TYR H H 76 8.040 8.309 -0.269 1
1 853 . 1 1 1 A 76 76 TYR HA H 76 4.310 4.046 0.264 1
1 860 . 1 1 1 A 76 76 TYR C C 76 176.200 177.466 -1.266 1
1 861 . 1 1 1 A 76 76 TYR CA C 76 60.000 61.055 -1.055 1
1 862 . 1 1 1 A 76 76 TYR CB C 76 40.700 38.420 2.280 1
1 865 . 1 1 1 A 76 76 TYR N N 76 121.900 123.163 -1.263 1
1 866 . 1 1 1 A 77 77 VAL H H 77 7.540 8.616 -1.076 1
1 867 . 1 1 1 A 77 77 VAL HA H 77 3.450 3.292 0.158 1
1 875 . 1 1 1 A 77 77 VAL C C 77 175.500 177.481 -1.981 1
1 876 . 1 1 1 A 77 77 VAL CA C 77 65.500 65.088 0.412 1
1 877 . 1 1 1 A 77 77 VAL CB C 77 31.600 31.147 0.453 1
1 880 . 1 1 1 A 77 77 VAL N N 77 116.600 119.495 -2.895 1
1 881 . 1 1 1 A 78 78 ASP H H 78 7.580 8.172 -0.592 1
1 882 . 1 1 1 A 78 78 ASP HA H 78 4.380 4.422 -0.042 1
1 885 . 1 1 1 A 78 78 ASP C C 78 177.000 177.915 -0.915 1
1 886 . 1 1 1 A 78 78 ASP CA C 78 55.800 56.580 -0.780 1
1 887 . 1 1 1 A 78 78 ASP CB C 78 39.900 41.106 -1.206 1
1 888 . 1 1 1 A 78 78 ASP N N 78 116.400 120.574 -4.174 1
1 889 . 1 1 1 A 79 79 CYS H H 79 8.040 7.419 0.621 1
1 890 . 1 1 1 A 79 79 CYS HA H 79 4.110 4.212 -0.102 1
1 893 . 1 1 1 A 79 79 CYS C C 79 174.200 174.644 -0.444 1
1 894 . 1 1 1 A 79 79 CYS CA C 79 58.600 60.516 -1.916 1
1 895 . 1 1 1 A 79 79 CYS CB C 79 27.200 27.837 -0.637 1
1 896 . 1 1 1 A 79 79 CYS N N 79 117.000 116.745 0.255 1
1 897 . 1 1 1 A 80 80 ILE H H 80 6.960 7.246 -0.286 1
1 898 . 1 1 1 A 80 80 ILE HA H 80 4.120 4.123 -0.003 1
1 908 . 1 1 1 A 80 80 ILE CA C 80 58.700 59.770 -1.070 1
1 909 . 1 1 1 A 80 80 ILE CB C 80 38.500 38.095 0.405 1
1 913 . 1 1 1 A 80 80 ILE N N 80 123.200 122.074 1.126 1
1 914 . 1 1 1 A 81 81 PRO HA H 81 4.340 4.260 0.080 1
1 921 . 1 1 1 A 81 81 PRO C C 81 178.000 177.013 0.987 1
1 922 . 1 1 1 A 81 81 PRO CA C 81 64.700 65.502 -0.802 1
1 923 . 1 1 1 A 81 81 PRO CB C 81 32.600 31.744 0.856 1
1 926 . 1 1 1 A 82 82 GLN H H 82 7.560 7.868 -0.308 1
1 927 . 1 1 1 A 82 82 GLN HA H 82 4.600 4.312 0.288 1
1 934 . 1 1 1 A 82 82 GLN C C 82 177.400 176.259 1.141 1
1 935 . 1 1 1 A 82 82 GLN CA C 82 55.600 55.635 -0.035 1
1 936 . 1 1 1 A 82 82 GLN CB C 82 28.800 29.186 -0.386 1
1 938 . 1 1 1 A 82 82 GLN N N 82 115.900 117.660 -1.760 1
1 940 . 1 1 1 A 83 83 THR H H 83 8.880 8.477 0.403 1
1 941 . 1 1 1 A 83 83 THR HA H 83 3.750 3.951 -0.201 1
1 946 . 1 1 1 A 83 83 THR C C 83 176.300 176.284 0.016 1
1 947 . 1 1 1 A 83 83 THR CA C 83 66.500 66.291 0.209 1
1 948 . 1 1 1 A 83 83 THR CB C 83 68.700 68.817 -0.117 1
1 950 . 1 1 1 A 83 83 THR N N 83 122.700 119.907 2.793 1
1 951 . 1 1 1 A 84 84 ARG H H 84 8.990 8.247 0.743 1
1 952 . 1 1 1 A 84 84 ARG HA H 84 4.250 4.056 0.194 1
1 960 . 1 1 1 A 84 84 ARG C C 84 178.900 179.263 -0.363 1
1 961 . 1 1 1 A 84 84 ARG CA C 84 59.100 59.746 -0.646 1
1 962 . 1 1 1 A 84 84 ARG CB C 84 29.300 30.252 -0.952 1
1 965 . 1 1 1 A 84 84 ARG N N 84 120.100 121.386 -1.286 1
1 967 . 1 1 1 A 85 85 ASN H H 85 7.270 8.301 -1.031 1
1 968 . 1 1 1 A 85 85 ASN HA H 85 4.810 4.637 0.173 1
1 973 . 1 1 1 A 85 85 ASN C C 85 176.800 177.775 -0.975 1
1 974 . 1 1 1 A 85 85 ASN CA C 85 54.800 56.292 -1.492 1
1 975 . 1 1 1 A 85 85 ASN CB C 85 37.600 37.822 -0.222 1
1 976 . 1 1 1 A 85 85 ASN N N 85 117.400 118.466 -1.066 1
1 978 . 1 1 1 A 86 86 LYS H H 86 8.340 8.182 0.158 1
1 979 . 1 1 1 A 86 86 LYS HA H 86 3.890 4.033 -0.143 1
1 988 . 1 1 1 A 86 86 LYS C C 86 178.600 179.048 -0.448 1
1 989 . 1 1 1 A 86 86 LYS CA C 86 60.800 59.146 1.654 1
1 990 . 1 1 1 A 86 86 LYS CB C 86 32.700 32.195 0.505 1
1 994 . 1 1 1 A 86 86 LYS N N 86 124.200 120.731 3.469 1
1 995 . 1 1 1 A 87 87 PHE H H 87 8.120 8.696 -0.576 1
1 996 . 1 1 1 A 87 87 PHE HA H 87 4.260 4.133 0.127 1
1 1004 . 1 1 1 A 87 87 PHE C C 87 178.100 177.727 0.373 1
1 1005 . 1 1 1 A 87 87 PHE CA C 87 61.300 61.791 -0.491 1
1 1006 . 1 1 1 A 87 87 PHE CB C 87 38.200 39.228 -1.028 1
1 1010 . 1 1 1 A 87 87 PHE N N 87 118.300 120.948 -2.648 1
1 1011 . 1 1 1 A 88 88 ALA H H 88 7.860 8.555 -0.695 1
1 1012 . 1 1 1 A 88 88 ALA HA H 88 4.200 4.138 0.062 1
1 1016 . 1 1 1 A 88 88 ALA C C 88 180.600 179.892 0.708 1
1 1017 . 1 1 1 A 88 88 ALA CA C 88 54.900 54.986 -0.086 1
1 1018 . 1 1 1 A 88 88 ALA CB C 88 18.100 18.215 -0.115 1
1 1019 . 1 1 1 A 88 88 ALA N N 88 121.700 120.984 0.716 1
1 1020 . 1 1 1 A 89 89 PHE H H 89 8.690 8.361 0.329 1
1 1021 . 1 1 1 A 89 89 PHE HA H 89 4.080 4.081 -0.001 1
1 1029 . 1 1 1 A 89 89 PHE C C 89 176.300 177.719 -1.419 1
1 1030 . 1 1 1 A 89 89 PHE CA C 89 62.000 61.574 0.426 1
1 1031 . 1 1 1 A 89 89 PHE CB C 89 39.800 39.284 0.516 1
1 1035 . 1 1 1 A 89 89 PHE N N 89 120.100 119.643 0.457 1
1 1036 . 1 1 1 A 90 90 ARG H H 90 8.560 8.060 0.500 1
1 1037 . 1 1 1 A 90 90 ARG HA H 90 3.790 3.926 -0.136 1
1 1045 . 1 1 1 A 90 90 ARG C C 90 179.600 178.080 1.520 1
1 1046 . 1 1 1 A 90 90 ARG CA C 90 60.000 59.512 0.488 1
1 1047 . 1 1 1 A 90 90 ARG CB C 90 30.000 29.950 0.050 1
1 1050 . 1 1 1 A 90 90 ARG N N 90 118.000 118.166 -0.166 1
1 1052 . 1 1 1 A 91 91 GLU H H 91 8.120 8.156 -0.036 1
1 1053 . 1 1 1 A 91 91 GLU HA H 91 3.980 3.939 0.041 1
1 1058 . 1 1 1 A 91 91 GLU C C 91 178.400 178.837 -0.437 1
1 1059 . 1 1 1 A 91 91 GLU CA C 91 58.900 59.226 -0.326 1
1 1060 . 1 1 1 A 91 91 GLU CB C 91 28.800 29.227 -0.427 1
1 1062 . 1 1 1 A 91 91 GLU N N 91 119.300 118.007 1.293 1
1 1063 . 1 1 1 A 92 92 ALA H H 92 7.820 7.499 0.321 1
1 1064 . 1 1 1 A 92 92 ALA HA H 92 4.050 3.965 0.085 1
1 1068 . 1 1 1 A 92 92 ALA C C 92 179.800 179.827 -0.027 1
1 1069 . 1 1 1 A 92 92 ALA CA C 92 55.000 55.118 -0.118 1
1 1070 . 1 1 1 A 92 92 ALA CB C 92 18.000 18.190 -0.190 1
1 1071 . 1 1 1 A 92 92 ALA N N 92 123.400 122.210 1.190 1
1 1072 . 1 1 1 A 93 93 VAL H H 93 8.430 7.882 0.548 1
1 1073 . 1 1 1 A 93 93 VAL HA H 93 3.250 3.305 -0.055 1
1 1081 . 1 1 1 A 93 93 VAL C C 93 177.900 178.140 -0.240 1
1 1082 . 1 1 1 A 93 93 VAL CA C 93 66.800 66.798 0.002 1
1 1083 . 1 1 1 A 93 93 VAL CB C 93 31.300 31.374 -0.074 1
1 1086 . 1 1 1 A 93 93 VAL N N 93 119.900 118.153 1.747 1
1 1087 . 1 1 1 A 94 94 SER H H 94 7.990 8.216 -0.226 1
1 1088 . 1 1 1 A 94 94 SER HA H 94 4.230 4.206 0.024 1
1 1091 . 1 1 1 A 94 94 SER C C 94 177.200 176.688 0.512 1
1 1092 . 1 1 1 A 94 94 SER CA C 94 61.600 62.047 -0.447 1
1 1093 . 1 1 1 A 94 94 SER CB C 94 62.700 62.798 -0.098 1
1 1094 . 1 1 1 A 94 94 SER N N 94 116.000 116.069 -0.069 1
1 1095 . 1 1 1 A 95 95 LYS H H 95 7.710 7.853 -0.143 1
1 1096 . 1 1 1 A 95 95 LYS HA H 95 4.020 4.072 -0.052 1
1 1105 . 1 1 1 A 95 95 LYS C C 95 179.400 179.261 0.139 1
1 1106 . 1 1 1 A 95 95 LYS CA C 95 59.600 59.262 0.338 1
1 1107 . 1 1 1 A 95 95 LYS CB C 95 32.300 32.352 -0.052 1
1 1111 . 1 1 1 A 95 95 LYS N N 95 121.400 121.939 -0.539 1
1 1112 . 1 1 1 A 96 96 LEU H H 96 8.270 8.197 0.073 1
1 1113 . 1 1 1 A 96 96 LEU HA H 96 4.040 3.952 0.088 1
1 1123 . 1 1 1 A 96 96 LEU C C 96 177.700 178.301 -0.601 1
1 1124 . 1 1 1 A 96 96 LEU CA C 96 58.600 58.123 0.477 1
1 1125 . 1 1 1 A 96 96 LEU CB C 96 41.000 41.779 -0.779 1
1 1129 . 1 1 1 A 96 96 LEU N N 96 124.800 121.084 3.716 1
1 1130 . 1 1 1 A 97 97 GLU H H 97 8.500 8.296 0.204 1
1 1131 . 1 1 1 A 97 97 GLU HA H 97 3.760 4.115 -0.355 1
1 1136 . 1 1 1 A 97 97 GLU C C 97 179.100 179.640 -0.540 1
1 1137 . 1 1 1 A 97 97 GLU CA C 97 59.900 59.037 0.863 1
1 1138 . 1 1 1 A 97 97 GLU CB C 97 28.700 29.313 -0.613 1
1 1140 . 1 1 1 A 97 97 GLU N N 97 119.000 117.334 1.666 1
1 1141 . 1 1 1 A 98 98 LEU H H 98 7.740 7.803 -0.063 1
1 1142 . 1 1 1 A 98 98 LEU HA H 98 4.110 3.961 0.149 1
1 1152 . 1 1 1 A 98 98 LEU C C 98 179.700 179.018 0.682 1
1 1153 . 1 1 1 A 98 98 LEU CA C 98 57.900 57.865 0.035 1
1 1154 . 1 1 1 A 98 98 LEU CB C 98 41.800 41.387 0.413 1
1 1158 . 1 1 1 A 98 98 LEU N N 98 119.200 120.870 -1.670 1
1 1159 . 1 1 1 A 99 99 SER H H 99 8.290 7.968 0.322 1
1 1160 . 1 1 1 A 99 99 SER HA H 99 4.220 4.404 -0.184 1
1 1163 . 1 1 1 A 99 99 SER C C 99 176.600 177.594 -0.994 1
1 1164 . 1 1 1 A 99 99 SER CA C 99 62.400 61.300 1.100 1
1 1165 . 1 1 1 A 99 99 SER CB C 99 63.200 62.871 0.329 1
1 1166 . 1 1 1 A 99 99 SER N N 99 116.300 113.731 2.569 1
1 1167 . 1 1 1 A 100 100 LEU H H 100 8.490 8.531 -0.041 1
1 1168 . 1 1 1 A 100 100 LEU HA H 100 3.960 3.928 0.032 1
1 1178 . 1 1 1 A 100 100 LEU C C 100 179.300 179.609 -0.309 1
1 1179 . 1 1 1 A 100 100 LEU CA C 100 57.700 58.039 -0.339 1
1 1180 . 1 1 1 A 100 100 LEU CB C 100 41.300 41.241 0.059 1
1 1184 . 1 1 1 A 100 100 LEU N N 100 120.900 122.463 -1.563 1
1 1185 . 1 1 1 A 101 101 GLN H H 101 7.680 8.633 -0.953 1
1 1186 . 1 1 1 A 101 101 GLN HA H 101 4.100 3.982 0.118 1
1 1193 . 1 1 1 A 101 101 GLN C C 101 178.700 177.855 0.845 1
1 1194 . 1 1 1 A 101 101 GLN CA C 101 58.800 58.808 -0.008 1
1 1195 . 1 1 1 A 101 101 GLN CB C 101 27.900 27.725 0.175 1
1 1197 . 1 1 1 A 101 101 GLN N N 101 119.100 118.034 1.066 1
1 1199 . 1 1 1 A 102 102 GLU H H 102 7.850 8.098 -0.248 1
1 1200 . 1 1 1 A 102 102 GLU HA H 102 4.050 4.113 -0.063 1
1 1205 . 1 1 1 A 102 102 GLU C C 102 179.100 178.971 0.129 1
1 1206 . 1 1 1 A 102 102 GLU CA C 102 58.400 59.302 -0.902 1
1 1207 . 1 1 1 A 102 102 GLU CB C 102 28.600 29.209 -0.609 1
1 1209 . 1 1 1 A 102 102 GLU N N 102 118.400 119.148 -0.748 1
1 1210 . 1 1 1 A 103 103 LEU H H 103 8.080 8.211 -0.131 1
1 1211 . 1 1 1 A 103 103 LEU HA H 103 4.020 4.048 -0.028 1
1 1221 . 1 1 1 A 103 103 LEU C C 103 178.200 178.338 -0.138 1
1 1222 . 1 1 1 A 103 103 LEU CA C 103 57.000 57.962 -0.962 1
1 1223 . 1 1 1 A 103 103 LEU CB C 103 41.900 41.761 0.139 1
1 1227 . 1 1 1 A 103 103 LEU N N 103 120.600 123.499 -2.899 1
1 1228 . 1 1 1 A 104 104 GLN H H 104 7.900 8.340 -0.440 1
1 1229 . 1 1 1 A 104 104 GLN HA H 104 4.090 4.262 -0.172 1
1 1236 . 1 1 1 A 104 104 GLN C C 104 177.300 177.599 -0.299 1
1 1237 . 1 1 1 A 104 104 GLN CA C 104 58.100 58.287 -0.187 1
1 1238 . 1 1 1 A 104 104 GLN CB C 104 29.400 27.855 1.545 1
1 1240 . 1 1 1 A 104 104 GLN N N 104 117.700 116.448 1.252 1
1 1242 . 1 1 1 A 105 105 VAL H H 105 7.620 7.557 0.063 1
1 1243 . 1 1 1 A 105 105 VAL HA H 105 4.190 4.085 0.105 1
1 1251 . 1 1 1 A 105 105 VAL C C 105 176.800 176.501 0.299 1
1 1252 . 1 1 1 A 105 105 VAL CA C 105 62.600 64.059 -1.459 1
1 1253 . 1 1 1 A 105 105 VAL CB C 105 32.000 31.774 0.226 1
1 1256 . 1 1 1 A 105 105 VAL N N 105 114.900 117.375 -2.475 1
1 1257 . 1 1 1 A 106 106 SER H H 106 7.900 7.701 0.199 1
1 1258 . 1 1 1 A 106 106 SER HA H 106 4.460 4.877 -0.417 1
1 1261 . 1 1 1 A 106 106 SER C C 106 175.000 175.097 -0.097 1
1 1262 . 1 1 1 A 106 106 SER CA C 106 58.900 57.951 0.949 1
1 1263 . 1 1 1 A 106 106 SER CB C 106 63.900 63.655 0.245 1
1 1264 . 1 1 1 A 106 106 SER N N 106 116.900 117.325 -0.425 1
1 1265 . 1 1 1 A 107 107 SER H H 107 8.230 7.850 0.380 1
1 1266 . 1 1 1 A 107 107 SER HA H 107 4.390 4.164 0.226 1
1 1269 . 1 1 1 A 107 107 SER C C 107 174.600 175.145 -0.545 1
1 1270 . 1 1 1 A 107 107 SER CA C 107 58.400 60.956 -2.556 1
1 1271 . 1 1 1 A 107 107 SER CB C 107 63.600 62.986 0.614 1
1 1272 . 1 1 1 A 107 107 SER N N 107 117.500 117.009 0.491 1
1 1273 . 1 1 1 A 108 108 ALA H H 108 8.080 7.655 0.425 1
1 1274 . 1 1 1 A 108 108 ALA HA H 108 4.280 3.882 0.398 1
1 1278 . 1 1 1 A 108 108 ALA C C 108 177.500 178.503 -1.003 1
1 1279 . 1 1 1 A 108 108 ALA CA C 108 52.700 54.950 -2.250 1
1 1280 . 1 1 1 A 108 108 ALA CB C 108 19.200 17.865 1.335 1
1 1281 . 1 1 1 A 108 108 ALA N N 108 124.900 120.313 4.587 1
1 1282 . 1 1 1 A 109 109 ALA H H 109 8.080 8.333 -0.253 1
1 1283 . 1 1 1 A 109 109 ALA HA H 109 4.280 4.064 0.216 1
1 1287 . 1 1 1 A 109 109 ALA C C 109 177.700 178.155 -0.455 1
1 1288 . 1 1 1 A 109 109 ALA CA C 109 52.400 54.728 -2.328 1
1 1289 . 1 1 1 A 109 109 ALA CB C 109 19.400 19.204 0.196 1
1 1290 . 1 1 1 A 109 109 ALA N N 109 123.000 120.418 2.582 1
1 1291 . 1 1 1 A 110 110 ALA H H 110 8.300 8.027 0.273 1
1 1292 . 1 1 1 A 110 110 ALA HA H 110 4.280 3.904 0.376 1
1 1296 . 1 1 1 A 110 110 ALA C C 110 178.200 177.415 0.785 1
1 1297 . 1 1 1 A 110 110 ALA CA C 110 52.700 55.226 -2.526 1
1 1298 . 1 1 1 A 110 110 ALA CB C 110 19.200 17.646 1.554 1
1 1299 . 1 1 1 A 110 110 ALA N N 110 123.200 118.530 4.670 1
1 1300 . 1 1 1 A 111 111 GLY H H 111 8.300 8.427 -0.127 1
1 1301 . 1 1 1 A 111 111 GLY HA2 H 111 3.930 4.035 -0.105 1
1 1302 . 1 1 1 A 111 111 GLY HA3 H 111 3.940 4.036 -0.096 1
1 1303 . 1 1 1 A 111 111 GLY C C 111 173.700 172.502 1.198 1
1 1304 . 1 1 1 A 111 111 GLY CA C 111 45.100 46.142 -1.042 1
1 1305 . 1 1 1 A 111 111 GLY N N 111 108.000 105.013 2.987 1
1 1306 . 1 1 1 A 112 112 VAL H H 112 7.930 8.036 -0.106 1
1 1307 . 1 1 1 A 112 112 VAL HA H 112 4.420 4.569 -0.149 1
1 1315 . 1 1 1 A 112 112 VAL CA C 112 60.000 58.956 1.044 1
1 1316 . 1 1 1 A 112 112 VAL CB C 112 32.200 35.300 -3.100 1
1 1319 . 1 1 1 A 112 112 VAL N N 112 120.400 121.544 -1.144 1
1 1320 . 1 1 1 A 113 113 PRO HA H 113 4.370 4.286 0.084 1
1 1327 . 1 1 1 A 113 113 PRO C C 113 177.300 177.861 -0.561 1
1 1328 . 1 1 1 A 113 113 PRO CA C 113 63.900 63.611 0.289 1
1 1329 . 1 1 1 A 113 113 PRO CB C 113 31.800 31.319 0.481 1
1 1332 . 1 1 1 A 114 114 GLY H H 114 8.570 8.789 -0.219 1
1 1333 . 1 1 1 A 114 114 GLY HA2 H 114 3.880 3.957 -0.077 1
1 1334 . 1 1 1 A 114 114 GLY HA3 H 114 4.120 3.958 0.162 1
1 1335 . 1 1 1 A 114 114 GLY C C 114 174.900 175.393 -0.493 1
1 1336 . 1 1 1 A 114 114 GLY CA C 114 45.200 45.567 -0.367 1
1 1337 . 1 1 1 A 114 114 GLY N N 114 109.000 112.709 -3.709 1
1 1338 . 1 1 1 A 115 115 THR H H 115 7.900 7.468 0.432 1
1 1339 . 1 1 1 A 115 115 THR HA H 115 4.400 3.923 0.477 1
1 1344 . 1 1 1 A 115 115 THR C C 115 174.300 173.636 0.664 1
1 1345 . 1 1 1 A 115 115 THR CA C 115 61.700 65.020 -3.320 1
1 1346 . 1 1 1 A 115 115 THR CB C 115 69.700 69.135 0.565 1
1 1348 . 1 1 1 A 115 115 THR N N 115 111.400 115.719 -4.319 1
1 1349 . 1 1 1 A 116 116 ASN H H 116 8.450 8.136 0.314 1
1 1350 . 1 1 1 A 116 116 ASN HA H 116 4.970 5.175 -0.205 1
1 1355 . 1 1 1 A 116 116 ASN CA C 116 51.500 49.486 2.014 1
1 1356 . 1 1 1 A 116 116 ASN CB C 116 38.900 40.130 -1.230 1
1 1357 . 1 1 1 A 116 116 ASN N N 116 123.100 116.440 6.660 1
1 1359 . 1 1 1 A 117 117 PRO HA H 117 4.370 4.327 0.043 1
1 1366 . 1 1 1 A 117 117 PRO C C 117 178.400 178.124 0.276 1
1 1367 . 1 1 1 A 117 117 PRO CA C 117 64.800 64.614 0.186 1
1 1368 . 1 1 1 A 117 117 PRO CB C 117 32.100 32.040 0.060 1
1 1371 . 1 1 1 A 118 118 VAL H H 118 7.750 7.608 0.142 1
1 1372 . 1 1 1 A 118 118 VAL HA H 118 3.810 3.738 0.072 1
1 1380 . 1 1 1 A 118 118 VAL C C 118 178.300 178.160 0.140 1
1 1381 . 1 1 1 A 118 118 VAL CA C 118 65.200 65.470 -0.270 1
1 1382 . 1 1 1 A 118 118 VAL CB C 118 31.500 31.484 0.016 1
1 1385 . 1 1 1 A 118 118 VAL N N 118 118.300 116.344 1.956 1
1 1386 . 1 1 1 A 119 119 LEU H H 119 7.540 7.964 -0.424 1
1 1387 . 1 1 1 A 119 119 LEU HA H 119 4.030 3.932 0.098 1
1 1397 . 1 1 1 A 119 119 LEU C C 119 178.900 179.591 -0.691 1
1 1398 . 1 1 1 A 119 119 LEU CA C 119 57.800 58.077 -0.277 1
1 1399 . 1 1 1 A 119 119 LEU CB C 119 40.700 40.988 -0.288 1
1 1403 . 1 1 1 A 119 119 LEU N N 119 119.700 120.274 -0.574 1
1 1404 . 1 1 1 A 120 120 ASN H H 120 8.080 7.904 0.176 1
1 1405 . 1 1 1 A 120 120 ASN HA H 120 4.420 4.483 -0.063 1
1 1410 . 1 1 1 A 120 120 ASN C C 120 178.100 178.379 -0.279 1
1 1411 . 1 1 1 A 120 120 ASN CA C 120 56.100 55.956 0.144 1
1 1412 . 1 1 1 A 120 120 ASN CB C 120 37.800 38.094 -0.294 1
1 1413 . 1 1 1 A 120 120 ASN N N 120 117.700 118.578 -0.878 1
1 1415 . 1 1 1 A 121 121 ASN H H 121 8.120 8.015 0.105 1
1 1416 . 1 1 1 A 121 121 ASN HA H 121 4.490 4.557 -0.067 1
1 1421 . 1 1 1 A 121 121 ASN C C 121 178.000 178.204 -0.204 1
1 1422 . 1 1 1 A 121 121 ASN CA C 121 56.100 56.537 -0.437 1
1 1423 . 1 1 1 A 121 121 ASN CB C 121 37.800 38.147 -0.347 1
1 1424 . 1 1 1 A 121 121 ASN N N 121 120.000 118.259 1.741 1
1 1426 . 1 1 1 A 122 122 LEU H H 122 8.180 8.452 -0.272 1
1 1427 . 1 1 1 A 122 122 LEU HA H 122 4.050 3.925 0.125 1
1 1437 . 1 1 1 A 122 122 LEU C C 122 173.800 178.966 -5.166 1
1 1438 . 1 1 1 A 122 122 LEU CA C 122 58.500 57.869 0.631 1
1 1439 . 1 1 1 A 122 122 LEU CB C 122 41.900 42.144 -0.244 1
1 1443 . 1 1 1 A 122 122 LEU N N 122 122.600 120.909 1.691 1
1 1444 . 1 1 1 A 123 123 LEU H H 123 8.260 7.946 0.314 1
1 1445 . 1 1 1 A 123 123 LEU HA H 123 3.850 3.989 -0.139 1
1 1455 . 1 1 1 A 123 123 LEU C C 123 178.900 178.489 0.411 1
1 1456 . 1 1 1 A 123 123 LEU CA C 123 58.500 58.054 0.446 1
1 1457 . 1 1 1 A 123 123 LEU CB C 123 41.200 41.292 -0.092 1
1 1461 . 1 1 1 A 123 123 LEU N N 123 119.700 120.338 -0.638 1
1 1462 . 1 1 1 A 124 124 SER H H 124 7.950 8.294 -0.344 1
1 1463 . 1 1 1 A 124 124 SER HA H 124 4.240 4.033 0.207 1
1 1466 . 1 1 1 A 124 124 SER C C 124 177.500 177.088 0.412 1
1 1467 . 1 1 1 A 124 124 SER CA C 124 61.600 61.712 -0.112 1
1 1468 . 1 1 1 A 124 124 SER CB C 124 62.600 62.830 -0.230 1
1 1469 . 1 1 1 A 124 124 SER N N 124 113.400 114.436 -1.036 1
1 1470 . 1 1 1 A 125 125 CYS H H 125 8.040 8.150 -0.110 1
1 1471 . 1 1 1 A 125 125 CYS HA H 125 4.350 4.114 0.236 1
1 1474 . 1 1 1 A 125 125 CYS C C 125 176.800 176.965 -0.165 1
1 1475 . 1 1 1 A 125 125 CYS CA C 125 62.600 63.726 -1.126 1
1 1476 . 1 1 1 A 125 125 CYS CB C 125 27.100 26.742 0.358 1
1 1477 . 1 1 1 A 125 125 CYS N N 125 119.800 119.488 0.312 1
1 1478 . 1 1 1 A 126 126 VAL H H 126 8.290 8.400 -0.110 1
1 1479 . 1 1 1 A 126 126 VAL HA H 126 3.430 3.411 0.019 1
1 1487 . 1 1 1 A 126 126 VAL C C 126 177.800 177.684 0.116 1
1 1488 . 1 1 1 A 126 126 VAL CA C 126 67.100 66.926 0.174 1
1 1489 . 1 1 1 A 126 126 VAL CB C 126 31.400 31.467 -0.067 1
1 1492 . 1 1 1 A 126 126 VAL N N 126 121.900 120.638 1.262 1
1 1493 . 1 1 1 A 127 127 GLN H H 127 8.200 8.286 -0.086 1
1 1494 . 1 1 1 A 127 127 GLN HA H 127 3.970 3.961 0.009 1
1 1501 . 1 1 1 A 127 127 GLN C C 127 178.200 178.303 -0.103 1
1 1502 . 1 1 1 A 127 127 GLN CA C 127 58.700 58.916 -0.216 1
1 1503 . 1 1 1 A 127 127 GLN CB C 127 27.800 28.530 -0.730 1
1 1505 . 1 1 1 A 127 127 GLN N N 127 119.700 118.332 1.368 1
1 1507 . 1 1 1 A 128 128 GLU H H 128 7.880 7.942 -0.062 1
1 1508 . 1 1 1 A 128 128 GLU HA H 128 4.200 4.036 0.164 1
1 1513 . 1 1 1 A 128 128 GLU C C 128 178.400 178.586 -0.186 1
1 1514 . 1 1 1 A 128 128 GLU CA C 128 59.000 59.100 -0.100 1
1 1515 . 1 1 1 A 128 128 GLU CB C 128 28.400 29.305 -0.905 1
1 1517 . 1 1 1 A 128 128 GLU N N 128 119.800 119.675 0.125 1
1 1518 . 1 1 1 A 129 129 ILE H H 129 8.000 8.426 -0.426 1
1 1519 . 1 1 1 A 129 129 ILE HA H 129 3.460 3.517 -0.057 1
1 1529 . 1 1 1 A 129 129 ILE C C 129 176.800 178.162 -1.362 1
1 1530 . 1 1 1 A 129 129 ILE CA C 129 66.100 65.491 0.609 1
1 1531 . 1 1 1 A 129 129 ILE CB C 129 38.200 37.363 0.837 1
1 1535 . 1 1 1 A 129 129 ILE N N 129 119.500 120.275 -0.775 1
1 1536 . 1 1 1 A 130 130 SER H H 130 8.040 8.258 -0.218 1
1 1537 . 1 1 1 A 130 130 SER HA H 130 3.780 4.189 -0.409 1
1 1540 . 1 1 1 A 130 130 SER C C 130 176.200 176.194 0.006 1
1 1541 . 1 1 1 A 130 130 SER CA C 130 62.100 61.470 0.630 1
1 1542 . 1 1 1 A 130 130 SER CB C 130 62.600 62.025 0.575 1
1 1543 . 1 1 1 A 130 130 SER N N 130 112.800 114.841 -2.041 1
1 1544 . 1 1 1 A 131 131 ASP H H 131 8.270 8.281 -0.011 1
1 1545 . 1 1 1 A 131 131 ASP HA H 131 4.310 4.419 -0.109 1
1 1548 . 1 1 1 A 131 131 ASP C C 131 179.200 178.622 0.578 1
1 1549 . 1 1 1 A 131 131 ASP CA C 131 56.800 57.482 -0.682 1
1 1550 . 1 1 1 A 131 131 ASP CB C 131 40.900 41.237 -0.337 1
1 1551 . 1 1 1 A 131 131 ASP N N 131 119.600 121.691 -2.091 1
1 1552 . 1 1 1 A 132 132 VAL H H 132 8.470 8.555 -0.085 1
1 1553 . 1 1 1 A 132 132 VAL HA H 132 3.520 3.728 -0.208 1
1 1561 . 1 1 1 A 132 132 VAL C C 132 178.700 178.630 0.070 1
1 1562 . 1 1 1 A 132 132 VAL CA C 132 66.500 66.513 -0.013 1
1 1563 . 1 1 1 A 132 132 VAL CB C 132 31.500 31.726 -0.226 1
1 1566 . 1 1 1 A 132 132 VAL N N 132 118.100 119.817 -1.717 1
1 1567 . 1 1 1 A 133 133 VAL H H 133 8.140 7.874 0.266 1
1 1568 . 1 1 1 A 133 133 VAL HA H 133 3.770 3.684 0.086 1
1 1576 . 1 1 1 A 133 133 VAL C C 133 176.500 178.264 -1.764 1
1 1577 . 1 1 1 A 133 133 VAL CA C 133 65.100 66.924 -1.824 1
1 1578 . 1 1 1 A 133 133 VAL CB C 133 31.600 31.388 0.212 1
1 1581 . 1 1 1 A 133 133 VAL N N 133 117.000 120.919 -3.919 1
1 1582 . 1 1 1 A 134 134 GLN H H 134 7.490 7.923 -0.433 1
1 1583 . 1 1 1 A 134 134 GLN HA H 134 4.350 4.266 0.084 1
1 1590 . 1 1 1 A 134 134 GLN C C 134 175.400 176.951 -1.551 1
1 1591 . 1 1 1 A 134 134 GLN CA C 134 56.700 57.373 -0.673 1
1 1592 . 1 1 1 A 134 134 GLN CB C 134 30.500 28.565 1.935 1
1 1594 . 1 1 1 A 134 134 GLN N N 134 116.300 118.972 -2.672 1
1 1 . 2 1 1 A 2 2 GLY HA2 H 2 3.890 3.636 0.254 1
1 2 . 2 1 1 A 2 2 GLY HA3 H 2 3.890 3.825 0.065 1
1 3 . 2 1 1 A 2 2 GLY C C 2 174.200 173.811 0.389 1
1 4 . 2 1 1 A 2 2 GLY CA C 2 44.700 46.832 -2.132 1
1 5 . 2 1 1 A 3 3 HIS H H 3 8.380 7.503 0.877 1
1 6 . 2 1 1 A 3 3 HIS HA H 3 4.610 4.751 -0.141 1
1 9 . 2 1 1 A 3 3 HIS C C 3 174.500 174.852 -0.352 1
1 10 . 2 1 1 A 3 3 HIS CA C 3 55.200 54.998 0.202 1
1 11 . 2 1 1 A 3 3 HIS CB C 3 28.800 30.161 -1.361 1
1 12 . 2 1 1 A 3 3 HIS N N 3 117.600 121.155 -3.555 1
1 13 . 2 1 1 A 4 4 HIS H H 4 8.520 8.905 -0.385 1
1 14 . 2 1 1 A 4 4 HIS HA H 4 4.640 4.977 -0.337 1
1 17 . 2 1 1 A 4 4 HIS C C 4 174.200 174.101 0.099 1
1 18 . 2 1 1 A 4 4 HIS CA C 4 55.100 54.494 0.606 1
1 19 . 2 1 1 A 4 4 HIS CB C 4 28.900 33.622 -4.722 1
1 20 . 2 1 1 A 4 4 HIS N N 4 119.000 121.983 -2.983 1
1 21 . 2 1 1 A 5 5 HIS H H 5 8.530 8.565 -0.035 1
1 22 . 2 1 1 A 5 5 HIS HA H 5 4.410 5.199 -0.789 1
1 25 . 2 1 1 A 5 5 HIS CA C 5 54.900 54.246 0.654 1
1 26 . 2 1 1 A 5 5 HIS CB C 5 27.300 32.425 -5.125 1
1 27 . 2 1 1 A 5 5 HIS N N 5 121.600 117.494 4.106 1
1 28 . 2 1 1 A 6 6 HIS HA H 6 4.640 5.142 -0.502 1
1 31 . 2 1 1 A 6 6 HIS C C 6 174.100 173.966 0.134 1
1 32 . 2 1 1 A 6 6 HIS CA C 6 55.100 54.427 0.673 1
1 33 . 2 1 1 A 6 6 HIS CB C 6 29.100 33.151 -4.051 1
1 34 . 2 1 1 A 7 7 HIS H H 7 8.690 8.849 -0.159 1
1 35 . 2 1 1 A 7 7 HIS HA H 7 4.650 5.084 -0.434 1
1 38 . 2 1 1 A 7 7 HIS C C 7 174.200 173.266 0.934 1
1 39 . 2 1 1 A 7 7 HIS CA C 7 55.200 53.955 1.245 1
1 40 . 2 1 1 A 7 7 HIS CB C 7 29.300 32.765 -3.465 1
1 41 . 2 1 1 A 7 7 HIS N N 7 121.400 122.897 -1.497 1
1 42 . 2 1 1 A 8 8 HIS H H 8 8.660 8.446 0.214 1
1 43 . 2 1 1 A 8 8 HIS HA H 8 4.700 5.463 -0.763 1
1 46 . 2 1 1 A 8 8 HIS C C 8 174.200 173.316 0.884 1
1 47 . 2 1 1 A 8 8 HIS CA C 8 55.000 53.280 1.720 1
1 48 . 2 1 1 A 8 8 HIS CB C 8 29.300 33.006 -3.706 1
1 49 . 2 1 1 A 8 8 HIS N N 8 120.400 123.102 -2.702 1
1 50 . 2 1 1 A 9 9 SER H H 9 8.490 8.904 -0.414 1
1 51 . 2 1 1 A 9 9 SER HA H 9 4.390 4.662 -0.272 1
1 54 . 2 1 1 A 9 9 SER C C 9 174.100 173.802 0.298 1
1 55 . 2 1 1 A 9 9 SER CA C 9 58.300 57.225 1.075 1
1 56 . 2 1 1 A 9 9 SER CB C 9 63.700 63.678 0.022 1
1 57 . 2 1 1 A 9 9 SER N N 9 118.100 116.266 1.834 1
1 58 . 2 1 1 A 10 10 HIS H H 10 8.710 8.875 -0.165 1
1 59 . 2 1 1 A 10 10 HIS HA H 10 4.690 4.827 -0.137 1
1 63 . 2 1 1 A 10 10 HIS C C 10 174.200 174.972 -0.772 1
1 64 . 2 1 1 A 10 10 HIS CA C 10 55.200 54.924 0.276 1
1 65 . 2 1 1 A 10 10 HIS CB C 10 28.800 29.922 -1.122 1
1 66 . 2 1 1 A 10 10 HIS N N 10 120.700 129.191 -8.491 1
1 67 . 2 1 1 A 11 11 MET H H 11 8.410 8.313 0.097 1
1 68 . 2 1 1 A 11 11 MET HA H 11 4.420 4.346 0.074 1
1 76 . 2 1 1 A 11 11 MET C C 11 175.800 176.619 -0.819 1
1 77 . 2 1 1 A 11 11 MET CA C 11 55.100 55.185 -0.085 1
1 78 . 2 1 1 A 11 11 MET CB C 11 32.800 33.109 -0.309 1
1 81 . 2 1 1 A 11 11 MET N N 11 122.300 126.936 -4.636 1
1 82 . 2 1 1 A 12 12 ALA H H 12 8.440 8.604 -0.164 1
1 83 . 2 1 1 A 12 12 ALA HA H 12 4.280 4.462 -0.182 1
1 87 . 2 1 1 A 12 12 ALA C C 12 177.400 178.213 -0.813 1
1 88 . 2 1 1 A 12 12 ALA CA C 12 52.400 52.133 0.267 1
1 89 . 2 1 1 A 12 12 ALA CB C 12 18.800 19.767 -0.967 1
1 90 . 2 1 1 A 12 12 ALA N N 12 125.900 124.155 1.745 1
1 91 . 2 1 1 A 13 13 ASN H H 13 8.440 9.002 -0.562 1
1 92 . 2 1 1 A 13 13 ASN HA H 13 4.660 4.437 0.223 1
1 97 . 2 1 1 A 13 13 ASN C C 13 175.900 178.565 -2.665 1
1 98 . 2 1 1 A 13 13 ASN CA C 13 53.200 55.761 -2.561 1
1 99 . 2 1 1 A 13 13 ASN CB C 13 38.800 38.025 0.775 1
1 100 . 2 1 1 A 13 13 ASN N N 13 118.300 118.129 0.171 1
1 102 . 2 1 1 A 14 14 GLY H H 14 8.370 8.045 0.325 1
1 103 . 2 1 1 A 14 14 GLY HA2 H 14 3.920 3.740 0.180 1
1 104 . 2 1 1 A 14 14 GLY HA3 H 14 3.920 3.741 0.179 1
1 105 . 2 1 1 A 14 14 GLY C C 14 174.000 174.960 -0.960 1
1 106 . 2 1 1 A 14 14 GLY CA C 14 45.200 47.176 -1.976 1
1 107 . 2 1 1 A 14 14 GLY N N 14 109.600 109.707 -0.107 1
1 108 . 2 1 1 A 15 15 ALA H H 15 8.140 7.962 0.178 1
1 109 . 2 1 1 A 15 15 ALA HA H 15 4.280 3.909 0.371 1
1 113 . 2 1 1 A 15 15 ALA C C 15 177.300 176.243 1.057 1
1 114 . 2 1 1 A 15 15 ALA CA C 15 52.500 55.050 -2.550 1
1 115 . 2 1 1 A 15 15 ALA CB C 15 19.100 17.729 1.371 1
1 116 . 2 1 1 A 15 15 ALA N N 15 123.800 119.240 4.560 1
1 117 . 2 1 1 A 16 16 ALA H H 16 8.030 7.974 0.056 1
1 118 . 2 1 1 A 16 16 ALA HA H 16 4.280 4.412 -0.132 1
1 122 . 2 1 1 A 16 16 ALA C C 16 178.400 176.898 1.502 1
1 123 . 2 1 1 A 16 16 ALA CA C 16 52.600 51.169 1.431 1
1 124 . 2 1 1 A 16 16 ALA CB C 16 19.100 21.265 -2.165 1
1 125 . 2 1 1 A 16 16 ALA N N 16 122.300 117.337 4.963 1
1 126 . 2 1 1 A 17 17 GLY H H 17 8.320 8.914 -0.594 1
1 127 . 2 1 1 A 17 17 GLY HA2 H 17 3.960 3.905 0.055 1
1 128 . 2 1 1 A 17 17 GLY HA3 H 17 3.960 3.906 0.054 1
1 129 . 2 1 1 A 17 17 GLY C C 17 174.500 175.237 -0.737 1
1 130 . 2 1 1 A 17 17 GLY CA C 17 45.200 47.509 -2.309 1
1 131 . 2 1 1 A 17 17 GLY N N 17 107.800 106.118 1.682 1
1 132 . 2 1 1 A 18 18 THR H H 18 7.970 8.128 -0.158 1
1 133 . 2 1 1 A 18 18 THR HA H 18 4.290 3.783 0.507 1
1 138 . 2 1 1 A 18 18 THR C C 18 174.600 176.262 -1.662 1
1 139 . 2 1 1 A 18 18 THR CA C 18 62.000 66.552 -4.552 1
1 140 . 2 1 1 A 18 18 THR CB C 18 69.700 68.790 0.910 1
1 142 . 2 1 1 A 18 18 THR N N 18 113.800 117.248 -3.448 1
1 143 . 2 1 1 A 19 19 LYS H H 19 8.350 8.325 0.025 1
1 144 . 2 1 1 A 19 19 LYS HA H 19 4.270 4.095 0.175 1
1 153 . 2 1 1 A 19 19 LYS C C 19 176.600 177.974 -1.374 1
1 154 . 2 1 1 A 19 19 LYS CA C 19 56.500 58.793 -2.293 1
1 155 . 2 1 1 A 19 19 LYS CB C 19 32.800 32.340 0.460 1
1 159 . 2 1 1 A 19 19 LYS N N 19 124.000 119.684 4.316 1
1 160 . 2 1 1 A 20 20 VAL H H 20 8.060 7.339 0.721 1
1 161 . 2 1 1 A 20 20 VAL HA H 20 3.990 3.990 0.000 1
1 169 . 2 1 1 A 20 20 VAL C C 20 175.900 177.601 -1.701 1
1 170 . 2 1 1 A 20 20 VAL CA C 20 62.400 64.479 -2.079 1
1 171 . 2 1 1 A 20 20 VAL CB C 20 32.600 32.345 0.255 1
1 174 . 2 1 1 A 20 20 VAL N N 20 121.700 119.999 1.701 1
1 175 . 2 1 1 A 21 21 ALA H H 21 8.310 8.299 0.011 1
1 176 . 2 1 1 A 21 21 ALA HA H 21 4.290 4.063 0.227 1
1 180 . 2 1 1 A 21 21 ALA C C 21 177.600 180.162 -2.562 1
1 181 . 2 1 1 A 21 21 ALA CA C 21 52.400 55.036 -2.636 1
1 182 . 2 1 1 A 21 21 ALA CB C 21 19.000 18.266 0.734 1
1 183 . 2 1 1 A 21 21 ALA N N 21 127.700 122.864 4.836 1
1 184 . 2 1 1 A 22 22 LEU H H 22 8.150 7.467 0.683 1
1 185 . 2 1 1 A 22 22 LEU HA H 22 4.280 4.157 0.123 1
1 195 . 2 1 1 A 22 22 LEU C C 22 177.400 176.484 0.916 1
1 196 . 2 1 1 A 22 22 LEU CA C 22 55.200 56.281 -1.081 1
1 197 . 2 1 1 A 22 22 LEU CB C 22 42.200 42.044 0.156 1
1 201 . 2 1 1 A 22 22 LEU N N 22 121.800 118.388 3.412 1
1 202 . 2 1 1 A 23 23 ARG H H 23 8.240 7.824 0.416 1
1 203 . 2 1 1 A 23 23 ARG HA H 23 4.290 4.003 0.287 1
1 211 . 2 1 1 A 23 23 ARG C C 23 176.300 176.351 -0.051 1
1 212 . 2 1 1 A 23 23 ARG CA C 23 56.000 57.348 -1.348 1
1 213 . 2 1 1 A 23 23 ARG CB C 23 30.600 29.625 0.975 1
1 216 . 2 1 1 A 23 23 ARG N N 23 122.000 118.684 3.316 1
1 218 . 2 1 1 A 24 24 LYS H H 24 8.370 8.040 0.330 1
1 219 . 2 1 1 A 24 24 LYS HA H 24 4.330 4.251 0.079 1
1 228 . 2 1 1 A 24 24 LYS C C 24 176.800 176.366 0.434 1
1 229 . 2 1 1 A 24 24 LYS CA C 24 56.400 57.841 -1.441 1
1 230 . 2 1 1 A 24 24 LYS CB C 24 32.700 33.052 -0.352 1
1 234 . 2 1 1 A 24 24 LYS N N 24 122.900 118.489 4.411 1
1 235 . 2 1 1 A 25 25 THR H H 25 8.100 7.698 0.402 1
1 236 . 2 1 1 A 25 25 THR HA H 25 4.290 4.752 -0.462 1
1 241 . 2 1 1 A 25 25 THR C C 25 174.600 173.569 1.031 1
1 242 . 2 1 1 A 25 25 THR CA C 25 61.500 60.250 1.250 1
1 243 . 2 1 1 A 25 25 THR CB C 25 69.800 71.659 -1.859 1
1 245 . 2 1 1 A 25 25 THR N N 25 115.500 112.472 3.028 1
1 246 . 2 1 1 A 26 26 LYS H H 26 8.370 8.930 -0.560 1
1 247 . 2 1 1 A 26 26 LYS HA H 26 4.270 4.699 -0.429 1
1 256 . 2 1 1 A 26 26 LYS C C 26 176.600 176.810 -0.210 1
1 257 . 2 1 1 A 26 26 LYS CA C 26 56.600 54.123 2.477 1
1 258 . 2 1 1 A 26 26 LYS CB C 26 32.700 34.978 -2.278 1
1 262 . 2 1 1 A 26 26 LYS N N 26 123.700 127.357 -3.657 1
1 263 . 2 1 1 A 27 27 GLN H H 27 8.390 8.748 -0.358 1
1 264 . 2 1 1 A 27 27 GLN HA H 27 4.240 4.457 -0.217 1
1 271 . 2 1 1 A 27 27 GLN C C 27 175.900 175.826 0.074 1
1 272 . 2 1 1 A 27 27 GLN CA C 27 56.100 56.946 -0.846 1
1 273 . 2 1 1 A 27 27 GLN CB C 27 29.300 29.059 0.241 1
1 275 . 2 1 1 A 27 27 GLN N N 27 121.700 119.390 2.310 1
1 277 . 2 1 1 A 28 28 ALA H H 28 8.330 7.735 0.595 1
1 278 . 2 1 1 A 28 28 ALA HA H 28 4.240 4.502 -0.262 1
1 282 . 2 1 1 A 28 28 ALA C C 28 177.700 177.601 0.099 1
1 283 . 2 1 1 A 28 28 ALA CA C 28 52.500 51.455 1.045 1
1 284 . 2 1 1 A 28 28 ALA CB C 28 19.100 22.526 -3.426 1
1 285 . 2 1 1 A 28 28 ALA N N 28 125.400 119.588 5.812 1
1 286 . 2 1 1 A 29 29 ALA H H 29 8.250 9.004 -0.754 1
1 287 . 2 1 1 A 29 29 ALA HA H 29 4.230 3.933 0.297 1
1 291 . 2 1 1 A 29 29 ALA C C 29 178.000 179.611 -1.611 1
1 292 . 2 1 1 A 29 29 ALA CA C 29 52.500 55.356 -2.856 1
1 293 . 2 1 1 A 29 29 ALA CB C 29 19.100 18.394 0.706 1
1 294 . 2 1 1 A 29 29 ALA N N 29 123.000 125.867 -2.867 1
1 295 . 2 1 1 A 30 30 GLU H H 30 8.260 8.353 -0.093 1
1 296 . 2 1 1 A 30 30 GLU HA H 30 4.220 4.086 0.134 1
1 301 . 2 1 1 A 30 30 GLU C C 30 176.500 177.558 -1.058 1
1 302 . 2 1 1 A 30 30 GLU CA C 30 56.400 59.533 -3.133 1
1 303 . 2 1 1 A 30 30 GLU CB C 30 29.500 29.533 -0.033 1
1 305 . 2 1 1 A 30 30 GLU N N 30 119.700 118.383 1.317 1
1 306 . 2 1 1 A 31 31 LYS H H 31 8.230 8.044 0.186 1
1 307 . 2 1 1 A 31 31 LYS HA H 31 4.280 4.511 -0.231 1
1 316 . 2 1 1 A 31 31 LYS C C 31 176.500 176.667 -0.167 1
1 317 . 2 1 1 A 31 31 LYS CA C 31 56.400 55.923 0.477 1
1 318 . 2 1 1 A 31 31 LYS CB C 31 32.800 33.502 -0.702 1
1 322 . 2 1 1 A 31 31 LYS N N 31 122.700 118.240 4.460 1
1 323 . 2 1 1 A 32 32 ILE H H 32 8.140 7.284 0.856 1
1 324 . 2 1 1 A 32 32 ILE HA H 32 4.110 4.040 0.070 1
1 334 . 2 1 1 A 32 32 ILE C C 32 176.400 176.331 0.069 1
1 335 . 2 1 1 A 32 32 ILE CA C 32 61.200 62.154 -0.954 1
1 336 . 2 1 1 A 32 32 ILE CB C 32 38.600 37.851 0.749 1
1 340 . 2 1 1 A 32 32 ILE N N 32 122.300 122.114 0.186 1
1 341 . 2 1 1 A 33 33 SER H H 33 8.230 9.120 -0.890 1
1 342 . 2 1 1 A 33 33 SER HA H 33 4.400 4.218 0.182 1
1 345 . 2 1 1 A 33 33 SER C C 33 174.800 176.557 -1.757 1
1 346 . 2 1 1 A 33 33 SER CA C 33 58.300 61.277 -2.977 1
1 347 . 2 1 1 A 33 33 SER CB C 33 63.700 62.958 0.742 1
1 348 . 2 1 1 A 33 33 SER N N 33 119.600 122.829 -3.229 1
1 349 . 2 1 1 A 34 34 ALA H H 34 8.430 8.342 0.088 1
1 350 . 2 1 1 A 34 34 ALA HA H 34 4.220 4.020 0.200 1
1 354 . 2 1 1 A 34 34 ALA C C 34 179.500 180.033 -0.533 1
1 355 . 2 1 1 A 34 34 ALA CA C 34 53.500 55.210 -1.710 1
1 356 . 2 1 1 A 34 34 ALA CB C 34 18.800 18.552 0.248 1
1 357 . 2 1 1 A 34 34 ALA N N 34 126.000 123.584 2.416 1
1 358 . 2 1 1 A 35 35 ASP H H 35 8.380 8.238 0.142 1
1 359 . 2 1 1 A 35 35 ASP HA H 35 4.520 4.319 0.201 1
1 362 . 2 1 1 A 35 35 ASP C C 35 176.500 178.742 -2.242 1
1 363 . 2 1 1 A 35 35 ASP CA C 35 54.800 57.242 -2.442 1
1 364 . 2 1 1 A 35 35 ASP CB C 35 40.200 40.267 -0.067 1
1 365 . 2 1 1 A 35 35 ASP N N 35 118.200 117.745 0.455 1
1 366 . 2 1 1 A 36 36 LYS H H 36 8.000 7.656 0.344 1
1 367 . 2 1 1 A 36 36 LYS HA H 36 4.270 4.035 0.235 1
1 376 . 2 1 1 A 36 36 LYS C C 36 177.000 177.324 -0.324 1
1 377 . 2 1 1 A 36 36 LYS CA C 36 56.800 58.968 -2.168 1
1 378 . 2 1 1 A 36 36 LYS CB C 36 32.900 31.998 0.902 1
1 382 . 2 1 1 A 36 36 LYS N N 36 120.900 118.861 2.039 1
1 383 . 2 1 1 A 37 37 ILE H H 37 7.970 7.285 0.685 1
1 384 . 2 1 1 A 37 37 ILE HA H 37 4.020 3.812 0.208 1
1 394 . 2 1 1 A 37 37 ILE C C 37 176.100 175.451 0.649 1
1 395 . 2 1 1 A 37 37 ILE CA C 37 61.300 62.522 -1.222 1
1 396 . 2 1 1 A 37 37 ILE CB C 37 38.100 37.779 0.321 1
1 400 . 2 1 1 A 37 37 ILE N N 37 121.800 120.918 0.882 1
1 401 . 2 1 1 A 38 38 SER H H 38 7.980 8.672 -0.692 1
1 402 . 2 1 1 A 38 38 SER HA H 38 4.540 4.798 -0.258 1
1 405 . 2 1 1 A 38 38 SER C C 38 174.700 175.719 -1.019 1
1 406 . 2 1 1 A 38 38 SER CA C 38 58.200 57.350 0.850 1
1 407 . 2 1 1 A 38 38 SER CB C 38 64.400 65.240 -0.840 1
1 408 . 2 1 1 A 38 38 SER N N 38 119.000 123.825 -4.825 1
1 409 . 2 1 1 A 39 39 LYS H H 39 8.690 9.067 -0.377 1
1 410 . 2 1 1 A 39 39 LYS HA H 39 3.400 3.595 -0.195 1
1 419 . 2 1 1 A 39 39 LYS C C 39 177.400 177.995 -0.595 1
1 420 . 2 1 1 A 39 39 LYS CA C 39 59.800 60.420 -0.620 1
1 421 . 2 1 1 A 39 39 LYS CB C 39 32.400 32.307 0.093 1
1 425 . 2 1 1 A 39 39 LYS N N 39 124.200 124.837 -0.637 1
1 426 . 2 1 1 A 40 40 GLU H H 40 8.280 8.460 -0.180 1
1 427 . 2 1 1 A 40 40 GLU HA H 40 3.840 4.070 -0.230 1
1 432 . 2 1 1 A 40 40 GLU C C 40 178.400 178.663 -0.263 1
1 433 . 2 1 1 A 40 40 GLU CA C 40 59.400 59.283 0.117 1
1 434 . 2 1 1 A 40 40 GLU CB C 40 28.300 29.365 -1.065 1
1 436 . 2 1 1 A 40 40 GLU N N 40 116.300 117.259 -0.959 1
1 437 . 2 1 1 A 41 41 ALA H H 41 7.890 7.817 0.073 1
1 438 . 2 1 1 A 41 41 ALA HA H 41 3.910 4.214 -0.304 1
1 442 . 2 1 1 A 41 41 ALA C C 41 179.900 179.609 0.291 1
1 443 . 2 1 1 A 41 41 ALA CA C 41 54.700 54.926 -0.226 1
1 444 . 2 1 1 A 41 41 ALA CB C 41 17.900 18.508 -0.608 1
1 445 . 2 1 1 A 41 41 ALA N N 41 122.300 122.201 0.099 1
1 446 . 2 1 1 A 42 42 LEU H H 42 7.490 7.765 -0.275 1
1 447 . 2 1 1 A 42 42 LEU HA H 42 3.480 4.281 -0.801 1
1 457 . 2 1 1 A 42 42 LEU C C 42 178.900 178.526 0.374 1
1 458 . 2 1 1 A 42 42 LEU CA C 42 59.800 57.545 2.255 1
1 459 . 2 1 1 A 42 42 LEU CB C 42 42.300 41.673 0.627 1
1 463 . 2 1 1 A 42 42 LEU N N 42 121.000 120.272 0.728 1
1 464 . 2 1 1 A 43 43 LEU H H 43 8.290 8.318 -0.028 1
1 465 . 2 1 1 A 43 43 LEU HA H 43 3.780 3.835 -0.055 1
1 475 . 2 1 1 A 43 43 LEU C C 43 179.400 178.943 0.457 1
1 476 . 2 1 1 A 43 43 LEU CA C 43 57.600 58.173 -0.573 1
1 477 . 2 1 1 A 43 43 LEU CB C 43 40.900 41.508 -0.608 1
1 481 . 2 1 1 A 43 43 LEU N N 43 119.200 118.550 0.650 1
1 482 . 2 1 1 A 44 44 GLU H H 44 8.330 8.288 0.042 1
1 483 . 2 1 1 A 44 44 GLU HA H 44 4.050 4.044 0.006 1
1 488 . 2 1 1 A 44 44 GLU C C 44 178.600 178.675 -0.075 1
1 489 . 2 1 1 A 44 44 GLU CA C 44 58.900 59.242 -0.342 1
1 490 . 2 1 1 A 44 44 GLU CB C 44 28.300 29.453 -1.153 1
1 492 . 2 1 1 A 44 44 GLU N N 44 119.600 117.259 2.341 1
1 493 . 2 1 1 A 45 45 CYS H H 45 7.690 8.293 -0.603 1
1 494 . 2 1 1 A 45 45 CYS HA H 45 4.120 4.066 0.054 1
1 497 . 2 1 1 A 45 45 CYS C C 45 176.100 176.692 -0.592 1
1 498 . 2 1 1 A 45 45 CYS CA C 45 62.500 63.330 -0.830 1
1 499 . 2 1 1 A 45 45 CYS CB C 45 26.200 26.924 -0.724 1
1 500 . 2 1 1 A 45 45 CYS N N 45 120.900 118.934 1.966 1
1 501 . 2 1 1 A 46 46 ALA H H 46 8.540 8.100 0.440 1
1 502 . 2 1 1 A 46 46 ALA HA H 46 3.900 3.889 0.011 1
1 506 . 2 1 1 A 46 46 ALA C C 46 179.200 179.064 0.136 1
1 507 . 2 1 1 A 46 46 ALA CA C 46 55.500 55.517 -0.017 1
1 508 . 2 1 1 A 46 46 ALA CB C 46 16.800 17.850 -1.050 1
1 509 . 2 1 1 A 46 46 ALA N N 46 121.500 122.228 -0.728 1
1 510 . 2 1 1 A 47 47 ASP H H 47 8.460 8.137 0.323 1
1 511 . 2 1 1 A 47 47 ASP HA H 47 4.340 4.457 -0.117 1
1 514 . 2 1 1 A 47 47 ASP C C 47 178.800 178.356 0.444 1
1 515 . 2 1 1 A 47 47 ASP CA C 47 56.600 57.087 -0.487 1
1 516 . 2 1 1 A 47 47 ASP CB C 47 39.800 41.972 -2.172 1
1 517 . 2 1 1 A 47 47 ASP N N 47 119.000 118.571 0.429 1
1 518 . 2 1 1 A 48 48 LEU H H 48 8.040 8.029 0.011 1
1 519 . 2 1 1 A 48 48 LEU HA H 48 4.110 4.027 0.083 1
1 529 . 2 1 1 A 48 48 LEU C C 48 180.000 179.337 0.663 1
1 530 . 2 1 1 A 48 48 LEU CA C 48 58.000 58.011 -0.011 1
1 531 . 2 1 1 A 48 48 LEU CB C 48 41.700 41.688 0.012 1
1 535 . 2 1 1 A 48 48 LEU N N 48 123.000 119.504 3.496 1
1 536 . 2 1 1 A 49 49 LEU H H 49 8.300 7.797 0.503 1
1 537 . 2 1 1 A 49 49 LEU HA H 49 4.110 3.878 0.232 1
1 547 . 2 1 1 A 49 49 LEU C C 49 177.200 178.726 -1.526 1
1 548 . 2 1 1 A 49 49 LEU CA C 49 57.600 57.925 -0.325 1
1 549 . 2 1 1 A 49 49 LEU CB C 49 41.200 41.654 -0.454 1
1 553 . 2 1 1 A 49 49 LEU N N 49 120.900 119.363 1.537 1
1 554 . 2 1 1 A 50 50 SER H H 50 8.660 8.107 0.553 1
1 555 . 2 1 1 A 50 50 SER HA H 50 4.000 4.165 -0.165 1
1 558 . 2 1 1 A 50 50 SER C C 50 176.800 176.829 -0.029 1
1 559 . 2 1 1 A 50 50 SER CA C 50 62.500 61.385 1.115 1
1 560 . 2 1 1 A 50 50 SER CB C 50 62.600 62.160 0.440 1
1 561 . 2 1 1 A 50 50 SER N N 50 113.300 113.317 -0.017 1
1 562 . 2 1 1 A 51 51 SER H H 51 7.980 7.707 0.273 1
1 563 . 2 1 1 A 51 51 SER HA H 51 4.220 4.092 0.128 1
1 566 . 2 1 1 A 51 51 SER C C 51 176.300 177.241 -0.941 1
1 567 . 2 1 1 A 51 51 SER CA C 51 61.200 61.576 -0.376 1
1 568 . 2 1 1 A 51 51 SER CB C 51 62.700 62.941 -0.241 1
1 569 . 2 1 1 A 51 51 SER N N 51 115.900 115.834 0.066 1
1 570 . 2 1 1 A 52 52 ALA H H 52 8.030 8.145 -0.115 1
1 571 . 2 1 1 A 52 52 ALA HA H 52 4.130 4.157 -0.027 1
1 575 . 2 1 1 A 52 52 ALA C C 52 178.500 180.379 -1.879 1
1 576 . 2 1 1 A 52 52 ALA CA C 52 54.500 55.047 -0.547 1
1 577 . 2 1 1 A 52 52 ALA CB C 52 18.000 18.352 -0.352 1
1 578 . 2 1 1 A 52 52 ALA N N 52 125.400 123.223 2.177 1
1 579 . 2 1 1 A 53 53 LEU H H 53 7.710 8.366 -0.656 1
1 580 . 2 1 1 A 53 53 LEU HA H 53 4.180 4.049 0.131 1
1 590 . 2 1 1 A 53 53 LEU C C 53 177.700 178.363 -0.663 1
1 591 . 2 1 1 A 53 53 LEU CA C 53 56.500 57.248 -0.748 1
1 592 . 2 1 1 A 53 53 LEU CB C 53 42.400 41.742 0.658 1
1 596 . 2 1 1 A 53 53 LEU N N 53 113.800 119.674 -5.874 1
1 597 . 2 1 1 A 54 54 THR H H 54 7.550 7.491 0.059 1
1 598 . 2 1 1 A 54 54 THR HA H 54 4.420 4.315 0.105 1
1 603 . 2 1 1 A 54 54 THR C C 54 174.100 174.796 -0.696 1
1 604 . 2 1 1 A 54 54 THR CA C 54 61.600 63.093 -1.493 1
1 605 . 2 1 1 A 54 54 THR CB C 54 69.300 69.523 -0.223 1
1 607 . 2 1 1 A 54 54 THR N N 54 107.700 106.418 1.282 1
1 608 . 2 1 1 A 55 55 GLU H H 55 7.750 7.571 0.179 1
1 609 . 2 1 1 A 55 55 GLU HA H 55 4.760 4.619 0.141 1
1 614 . 2 1 1 A 55 55 GLU CA C 55 53.400 54.252 -0.852 1
1 615 . 2 1 1 A 55 55 GLU CB C 55 30.100 30.748 -0.648 1
1 617 . 2 1 1 A 55 55 GLU N N 55 122.800 120.469 2.331 1
1 618 . 2 1 1 A 56 56 PRO HA H 56 4.670 4.776 -0.106 1
1 625 . 2 1 1 A 56 56 PRO C C 56 176.200 176.433 -0.233 1
1 626 . 2 1 1 A 56 56 PRO CA C 56 62.900 62.661 0.239 1
1 627 . 2 1 1 A 56 56 PRO CB C 56 29.200 31.663 -2.463 1
1 630 . 2 1 1 A 57 57 VAL H H 57 8.010 8.369 -0.359 1
1 631 . 2 1 1 A 57 57 VAL HA H 57 4.590 4.961 -0.371 1
1 639 . 2 1 1 A 57 57 VAL CA C 57 58.600 58.268 0.332 1
1 640 . 2 1 1 A 57 57 VAL CB C 57 32.800 34.772 -1.972 1
1 643 . 2 1 1 A 57 57 VAL N N 57 121.400 117.483 3.917 1
1 644 . 2 1 1 A 58 58 PRO HA H 58 4.450 5.194 -0.744 1
1 651 . 2 1 1 A 58 58 PRO C C 58 177.500 177.877 -0.377 1
1 652 . 2 1 1 A 58 58 PRO CA C 58 62.600 62.727 -0.127 1
1 653 . 2 1 1 A 58 58 PRO CB C 58 32.200 32.469 -0.269 1
1 656 . 2 1 1 A 59 59 ASN H H 59 8.890 8.902 -0.012 1
1 657 . 2 1 1 A 59 59 ASN HA H 59 4.330 4.433 -0.103 1
1 662 . 2 1 1 A 59 59 ASN C C 59 177.600 177.012 0.588 1
1 663 . 2 1 1 A 59 59 ASN CA C 59 56.300 56.076 0.224 1
1 664 . 2 1 1 A 59 59 ASN CB C 59 38.400 38.785 -0.385 1
1 665 . 2 1 1 A 59 59 ASN N N 59 122.200 123.392 -1.192 1
1 667 . 2 1 1 A 60 60 SER H H 60 8.660 8.250 0.410 1
1 668 . 2 1 1 A 60 60 SER HA H 60 4.010 4.105 -0.095 1
1 671 . 2 1 1 A 60 60 SER C C 60 176.200 176.179 0.021 1
1 672 . 2 1 1 A 60 60 SER CA C 60 60.800 61.241 -0.441 1
1 673 . 2 1 1 A 60 60 SER CB C 60 61.500 62.649 -1.149 1
1 674 . 2 1 1 A 60 60 SER N N 60 113.200 115.492 -2.292 1
1 675 . 2 1 1 A 61 61 GLN H H 61 7.420 7.796 -0.376 1
1 676 . 2 1 1 A 61 61 GLN HA H 61 4.280 3.975 0.305 1
1 683 . 2 1 1 A 61 61 GLN C C 61 178.600 178.182 0.418 1
1 684 . 2 1 1 A 61 61 GLN CA C 61 57.900 58.927 -1.027 1
1 685 . 2 1 1 A 61 61 GLN CB C 61 28.600 28.081 0.519 1
1 687 . 2 1 1 A 61 61 GLN N N 61 122.200 121.212 0.988 1
1 689 . 2 1 1 A 62 62 LEU H H 62 7.430 7.777 -0.347 1
1 690 . 2 1 1 A 62 62 LEU HA H 62 3.850 3.955 -0.105 1
1 700 . 2 1 1 A 62 62 LEU C C 62 178.800 179.072 -0.272 1
1 701 . 2 1 1 A 62 62 LEU CA C 62 57.900 58.059 -0.159 1
1 702 . 2 1 1 A 62 62 LEU CB C 62 42.100 42.006 0.094 1
1 706 . 2 1 1 A 62 62 LEU N N 62 120.600 119.803 0.797 1
1 707 . 2 1 1 A 63 63 VAL H H 63 8.200 8.177 0.023 1
1 708 . 2 1 1 A 63 63 VAL HA H 63 3.370 3.310 0.060 1
1 716 . 2 1 1 A 63 63 VAL C C 63 178.000 177.496 0.504 1
1 717 . 2 1 1 A 63 63 VAL CA C 63 66.600 66.787 -0.187 1
1 718 . 2 1 1 A 63 63 VAL CB C 63 31.700 30.979 0.721 1
1 721 . 2 1 1 A 63 63 VAL N N 63 118.200 117.333 0.867 1
1 722 . 2 1 1 A 64 64 ASP H H 64 7.960 8.262 -0.302 1
1 723 . 2 1 1 A 64 64 ASP HA H 64 4.460 4.146 0.314 1
1 726 . 2 1 1 A 64 64 ASP C C 64 178.100 178.236 -0.136 1
1 727 . 2 1 1 A 64 64 ASP CA C 64 57.700 57.210 0.490 1
1 728 . 2 1 1 A 64 64 ASP CB C 64 39.800 41.260 -1.460 1
1 729 . 2 1 1 A 64 64 ASP N N 64 120.200 119.880 0.320 1
1 730 . 2 1 1 A 65 65 THR H H 65 8.380 8.338 0.042 1
1 731 . 2 1 1 A 65 65 THR HA H 65 3.970 3.918 0.052 1
1 736 . 2 1 1 A 65 65 THR C C 65 176.500 176.981 -0.481 1
1 737 . 2 1 1 A 65 65 THR CA C 65 66.500 66.543 -0.043 1
1 738 . 2 1 1 A 65 65 THR CB C 65 67.800 68.032 -0.232 1
1 740 . 2 1 1 A 65 65 THR N N 65 118.100 115.324 2.776 1
1 741 . 2 1 1 A 66 66 GLY H H 66 8.900 8.292 0.608 1
1 742 . 2 1 1 A 66 66 GLY HA2 H 66 3.630 3.613 0.017 1
1 743 . 2 1 1 A 66 66 GLY HA3 H 66 3.630 3.638 -0.008 1
1 744 . 2 1 1 A 66 66 GLY C C 66 174.200 176.619 -2.419 1
1 745 . 2 1 1 A 66 66 GLY CA C 66 47.500 47.233 0.267 1
1 746 . 2 1 1 A 66 66 GLY N N 66 110.500 107.306 3.194 1
1 747 . 2 1 1 A 67 67 HIS H H 67 8.650 7.431 1.219 1
1 748 . 2 1 1 A 67 67 HIS HA H 67 4.220 4.567 -0.347 1
1 752 . 2 1 1 A 67 67 HIS C C 67 176.900 177.762 -0.862 1
1 753 . 2 1 1 A 67 67 HIS CA C 67 59.000 58.111 0.889 1
1 754 . 2 1 1 A 67 67 HIS CB C 67 27.800 29.650 -1.850 1
1 756 . 2 1 1 A 67 67 HIS N N 67 120.100 120.150 -0.050 1
1 757 . 2 1 1 A 68 68 GLN H H 68 7.860 8.293 -0.433 1
1 758 . 2 1 1 A 68 68 GLN HA H 68 3.990 4.022 -0.032 1
1 765 . 2 1 1 A 68 68 GLN C C 68 177.800 178.222 -0.422 1
1 766 . 2 1 1 A 68 68 GLN CA C 68 58.800 58.390 0.410 1
1 767 . 2 1 1 A 68 68 GLN CB C 68 28.200 28.360 -0.160 1
1 769 . 2 1 1 A 68 68 GLN N N 68 121.400 117.174 4.226 1
1 771 . 2 1 1 A 69 69 LEU H H 69 8.300 7.649 0.651 1
1 772 . 2 1 1 A 69 69 LEU HA H 69 4.330 3.915 0.415 1
1 782 . 2 1 1 A 69 69 LEU C C 69 179.300 179.599 -0.299 1
1 783 . 2 1 1 A 69 69 LEU CA C 69 58.200 58.092 0.108 1
1 784 . 2 1 1 A 69 69 LEU CB C 69 40.500 41.261 -0.761 1
1 788 . 2 1 1 A 69 69 LEU N N 69 120.300 121.200 -0.900 1
1 789 . 2 1 1 A 70 70 LEU H H 70 8.460 8.025 0.435 1
1 790 . 2 1 1 A 70 70 LEU HA H 70 3.880 3.998 -0.118 1
1 800 . 2 1 1 A 70 70 LEU C C 70 179.100 178.745 0.355 1
1 801 . 2 1 1 A 70 70 LEU CA C 70 58.300 58.223 0.077 1
1 802 . 2 1 1 A 70 70 LEU CB C 70 41.500 41.345 0.155 1
1 806 . 2 1 1 A 70 70 LEU N N 70 121.200 119.380 1.820 1
1 807 . 2 1 1 A 71 71 ASP H H 71 8.140 8.065 0.075 1
1 808 . 2 1 1 A 71 71 ASP HA H 71 4.420 4.393 0.027 1
1 811 . 2 1 1 A 71 71 ASP C C 71 180.000 178.402 1.598 1
1 812 . 2 1 1 A 71 71 ASP CA C 71 57.300 57.403 -0.103 1
1 813 . 2 1 1 A 71 71 ASP CB C 71 39.300 41.562 -2.262 1
1 814 . 2 1 1 A 71 71 ASP N N 71 121.100 119.132 1.968 1
1 815 . 2 1 1 A 72 72 TYR H H 72 8.320 8.709 -0.389 1
1 816 . 2 1 1 A 72 72 TYR HA H 72 4.550 4.490 0.060 1
1 823 . 2 1 1 A 72 72 TYR C C 72 179.100 178.645 0.455 1
1 824 . 2 1 1 A 72 72 TYR CA C 72 60.500 60.758 -0.258 1
1 825 . 2 1 1 A 72 72 TYR CB C 72 37.600 38.288 -0.688 1
1 828 . 2 1 1 A 72 72 TYR N N 72 120.300 117.794 2.506 1
1 829 . 2 1 1 A 73 73 CYS H H 73 8.850 8.550 0.300 1
1 830 . 2 1 1 A 73 73 CYS HA H 73 4.380 4.593 -0.213 1
1 834 . 2 1 1 A 73 73 CYS C C 73 177.300 177.106 0.194 1
1 835 . 2 1 1 A 73 73 CYS CA C 73 64.400 63.836 0.564 1
1 836 . 2 1 1 A 73 73 CYS CB C 73 27.600 27.019 0.581 1
1 837 . 2 1 1 A 73 73 CYS N N 73 116.800 118.675 -1.875 1
1 838 . 2 1 1 A 74 74 SER H H 74 8.410 8.635 -0.225 1
1 839 . 2 1 1 A 74 74 SER HA H 74 4.290 4.279 0.011 1
1 842 . 2 1 1 A 74 74 SER C C 74 176.300 177.111 -0.811 1
1 843 . 2 1 1 A 74 74 SER CA C 74 61.400 61.391 0.009 1
1 844 . 2 1 1 A 74 74 SER CB C 74 62.600 62.407 0.193 1
1 845 . 2 1 1 A 74 74 SER N N 74 115.900 117.005 -1.105 1
1 846 . 2 1 1 A 75 75 GLY H H 75 7.790 8.310 -0.520 1
1 847 . 2 1 1 A 75 75 GLY HA2 H 75 4.320 3.725 0.595 1
1 848 . 2 1 1 A 75 75 GLY HA3 H 75 3.900 3.735 0.165 1
1 849 . 2 1 1 A 75 75 GLY C C 75 174.600 175.407 -0.807 1
1 850 . 2 1 1 A 75 75 GLY CA C 75 45.600 47.196 -1.596 1
1 851 . 2 1 1 A 75 75 GLY N N 75 107.500 109.660 -2.160 1
1 852 . 2 1 1 A 76 76 TYR H H 76 8.040 8.334 -0.294 1
1 853 . 2 1 1 A 76 76 TYR HA H 76 4.310 3.977 0.333 1
1 860 . 2 1 1 A 76 76 TYR C C 76 176.200 177.540 -1.340 1
1 861 . 2 1 1 A 76 76 TYR CA C 76 60.000 61.007 -1.007 1
1 862 . 2 1 1 A 76 76 TYR CB C 76 40.700 38.669 2.031 1
1 865 . 2 1 1 A 76 76 TYR N N 76 121.900 123.682 -1.782 1
1 866 . 2 1 1 A 77 77 VAL H H 77 7.540 8.453 -0.913 1
1 867 . 2 1 1 A 77 77 VAL HA H 77 3.450 3.396 0.054 1
1 875 . 2 1 1 A 77 77 VAL C C 77 175.500 177.202 -1.702 1
1 876 . 2 1 1 A 77 77 VAL CA C 77 65.500 64.372 1.128 1
1 877 . 2 1 1 A 77 77 VAL CB C 77 31.600 31.183 0.417 1
1 880 . 2 1 1 A 77 77 VAL N N 77 116.600 119.378 -2.778 1
1 881 . 2 1 1 A 78 78 ASP H H 78 7.580 8.065 -0.485 1
1 882 . 2 1 1 A 78 78 ASP HA H 78 4.380 4.294 0.086 1
1 885 . 2 1 1 A 78 78 ASP C C 78 177.000 177.757 -0.757 1
1 886 . 2 1 1 A 78 78 ASP CA C 78 55.800 57.290 -1.490 1
1 887 . 2 1 1 A 78 78 ASP CB C 78 39.900 41.034 -1.134 1
1 888 . 2 1 1 A 78 78 ASP N N 78 116.400 120.951 -4.551 1
1 889 . 2 1 1 A 79 79 CYS H H 79 8.040 7.405 0.635 1
1 890 . 2 1 1 A 79 79 CYS HA H 79 4.110 4.386 -0.276 1
1 893 . 2 1 1 A 79 79 CYS C C 79 174.200 174.660 -0.460 1
1 894 . 2 1 1 A 79 79 CYS CA C 79 58.600 58.317 0.283 1
1 895 . 2 1 1 A 79 79 CYS CB C 79 27.200 26.497 0.703 1
1 896 . 2 1 1 A 79 79 CYS N N 79 117.000 114.496 2.504 1
1 897 . 2 1 1 A 80 80 ILE H H 80 6.960 7.241 -0.281 1
1 898 . 2 1 1 A 80 80 ILE HA H 80 4.120 4.011 0.109 1
1 908 . 2 1 1 A 80 80 ILE CA C 80 58.700 59.303 -0.603 1
1 909 . 2 1 1 A 80 80 ILE CB C 80 38.500 37.752 0.748 1
1 913 . 2 1 1 A 80 80 ILE N N 80 123.200 122.976 0.224 1
1 914 . 2 1 1 A 81 81 PRO HA H 81 4.340 4.392 -0.052 1
1 921 . 2 1 1 A 81 81 PRO C C 81 178.000 176.278 1.722 1
1 922 . 2 1 1 A 81 81 PRO CA C 81 64.700 64.577 0.123 1
1 923 . 2 1 1 A 81 81 PRO CB C 81 32.600 31.980 0.620 1
1 926 . 2 1 1 A 82 82 GLN H H 82 7.560 8.057 -0.497 1
1 927 . 2 1 1 A 82 82 GLN HA H 82 4.600 4.479 0.121 1
1 934 . 2 1 1 A 82 82 GLN C C 82 177.400 176.321 1.079 1
1 935 . 2 1 1 A 82 82 GLN CA C 82 55.600 55.590 0.010 1
1 936 . 2 1 1 A 82 82 GLN CB C 82 28.800 29.161 -0.361 1
1 938 . 2 1 1 A 82 82 GLN N N 82 115.900 118.557 -2.657 1
1 940 . 2 1 1 A 83 83 THR H H 83 8.880 8.554 0.326 1
1 941 . 2 1 1 A 83 83 THR HA H 83 3.750 3.896 -0.146 1
1 946 . 2 1 1 A 83 83 THR C C 83 176.300 176.293 0.007 1
1 947 . 2 1 1 A 83 83 THR CA C 83 66.500 66.169 0.331 1
1 948 . 2 1 1 A 83 83 THR CB C 83 68.700 68.817 -0.117 1
1 950 . 2 1 1 A 83 83 THR N N 83 122.700 120.095 2.605 1
1 951 . 2 1 1 A 84 84 ARG H H 84 8.990 8.237 0.753 1
1 952 . 2 1 1 A 84 84 ARG HA H 84 4.250 4.054 0.196 1
1 960 . 2 1 1 A 84 84 ARG C C 84 178.900 179.287 -0.387 1
1 961 . 2 1 1 A 84 84 ARG CA C 84 59.100 59.738 -0.638 1
1 962 . 2 1 1 A 84 84 ARG CB C 84 29.300 30.252 -0.952 1
1 965 . 2 1 1 A 84 84 ARG N N 84 120.100 121.354 -1.254 1
1 967 . 2 1 1 A 85 85 ASN H H 85 7.270 8.327 -1.057 1
1 968 . 2 1 1 A 85 85 ASN HA H 85 4.810 4.660 0.150 1
1 973 . 2 1 1 A 85 85 ASN C C 85 176.800 177.721 -0.921 1
1 974 . 2 1 1 A 85 85 ASN CA C 85 54.800 56.277 -1.477 1
1 975 . 2 1 1 A 85 85 ASN CB C 85 37.600 37.895 -0.295 1
1 976 . 2 1 1 A 85 85 ASN N N 85 117.400 118.480 -1.080 1
1 978 . 2 1 1 A 86 86 LYS H H 86 8.340 8.208 0.132 1
1 979 . 2 1 1 A 86 86 LYS HA H 86 3.890 4.104 -0.214 1
1 988 . 2 1 1 A 86 86 LYS C C 86 178.600 178.811 -0.211 1
1 989 . 2 1 1 A 86 86 LYS CA C 86 60.800 59.201 1.599 1
1 990 . 2 1 1 A 86 86 LYS CB C 86 32.700 32.478 0.222 1
1 994 . 2 1 1 A 86 86 LYS N N 86 124.200 120.782 3.418 1
1 995 . 2 1 1 A 87 87 PHE H H 87 8.120 8.667 -0.547 1
1 996 . 2 1 1 A 87 87 PHE HA H 87 4.260 4.249 0.011 1
1 1004 . 2 1 1 A 87 87 PHE C C 87 178.100 177.703 0.397 1
1 1005 . 2 1 1 A 87 87 PHE CA C 87 61.300 61.818 -0.518 1
1 1006 . 2 1 1 A 87 87 PHE CB C 87 38.200 39.154 -0.954 1
1 1010 . 2 1 1 A 87 87 PHE N N 87 118.300 121.051 -2.751 1
1 1011 . 2 1 1 A 88 88 ALA H H 88 7.860 8.383 -0.523 1
1 1012 . 2 1 1 A 88 88 ALA HA H 88 4.200 4.360 -0.160 1
1 1016 . 2 1 1 A 88 88 ALA C C 88 180.600 180.039 0.561 1
1 1017 . 2 1 1 A 88 88 ALA CA C 88 54.900 55.075 -0.175 1
1 1018 . 2 1 1 A 88 88 ALA CB C 88 18.100 18.026 0.074 1
1 1019 . 2 1 1 A 88 88 ALA N N 88 121.700 121.141 0.559 1
1 1020 . 2 1 1 A 89 89 PHE H H 89 8.690 8.713 -0.023 1
1 1021 . 2 1 1 A 89 89 PHE HA H 89 4.080 4.125 -0.045 1
1 1029 . 2 1 1 A 89 89 PHE C C 89 176.300 177.690 -1.390 1
1 1030 . 2 1 1 A 89 89 PHE CA C 89 62.000 61.451 0.549 1
1 1031 . 2 1 1 A 89 89 PHE CB C 89 39.800 39.202 0.598 1
1 1035 . 2 1 1 A 89 89 PHE N N 89 120.100 120.285 -0.185 1
1 1036 . 2 1 1 A 90 90 ARG H H 90 8.560 8.327 0.233 1
1 1037 . 2 1 1 A 90 90 ARG HA H 90 3.790 3.912 -0.122 1
1 1045 . 2 1 1 A 90 90 ARG C C 90 179.600 178.796 0.804 1
1 1046 . 2 1 1 A 90 90 ARG CA C 90 60.000 59.457 0.543 1
1 1047 . 2 1 1 A 90 90 ARG CB C 90 30.000 29.853 0.147 1
1 1050 . 2 1 1 A 90 90 ARG N N 90 118.000 117.977 0.023 1
1 1052 . 2 1 1 A 91 91 GLU H H 91 8.120 8.286 -0.166 1
1 1053 . 2 1 1 A 91 91 GLU HA H 91 3.980 3.922 0.058 1
1 1058 . 2 1 1 A 91 91 GLU C C 91 178.400 178.848 -0.448 1
1 1059 . 2 1 1 A 91 91 GLU CA C 91 58.900 59.351 -0.451 1
1 1060 . 2 1 1 A 91 91 GLU CB C 91 28.800 28.801 -0.001 1
1 1062 . 2 1 1 A 91 91 GLU N N 91 119.300 118.147 1.153 1
1 1063 . 2 1 1 A 92 92 ALA H H 92 7.820 7.737 0.083 1
1 1064 . 2 1 1 A 92 92 ALA HA H 92 4.050 3.961 0.089 1
1 1068 . 2 1 1 A 92 92 ALA C C 92 179.800 179.817 -0.017 1
1 1069 . 2 1 1 A 92 92 ALA CA C 92 55.000 55.223 -0.223 1
1 1070 . 2 1 1 A 92 92 ALA CB C 92 18.000 17.998 0.002 1
1 1071 . 2 1 1 A 92 92 ALA N N 92 123.400 122.422 0.978 1
1 1072 . 2 1 1 A 93 93 VAL H H 93 8.430 7.809 0.621 1
1 1073 . 2 1 1 A 93 93 VAL HA H 93 3.250 3.322 -0.072 1
1 1081 . 2 1 1 A 93 93 VAL C C 93 177.900 177.973 -0.073 1
1 1082 . 2 1 1 A 93 93 VAL CA C 93 66.800 66.667 0.133 1
1 1083 . 2 1 1 A 93 93 VAL CB C 93 31.300 31.239 0.061 1
1 1086 . 2 1 1 A 93 93 VAL N N 93 119.900 118.520 1.380 1
1 1087 . 2 1 1 A 94 94 SER H H 94 7.990 8.056 -0.066 1
1 1088 . 2 1 1 A 94 94 SER HA H 94 4.230 4.002 0.228 1
1 1091 . 2 1 1 A 94 94 SER C C 94 177.200 176.458 0.742 1
1 1092 . 2 1 1 A 94 94 SER CA C 94 61.600 62.362 -0.762 1
1 1093 . 2 1 1 A 94 94 SER CB C 94 62.700 62.805 -0.105 1
1 1094 . 2 1 1 A 94 94 SER N N 94 116.000 116.446 -0.446 1
1 1095 . 2 1 1 A 95 95 LYS H H 95 7.710 7.393 0.317 1
1 1096 . 2 1 1 A 95 95 LYS HA H 95 4.020 4.035 -0.015 1
1 1105 . 2 1 1 A 95 95 LYS C C 95 179.400 178.776 0.624 1
1 1106 . 2 1 1 A 95 95 LYS CA C 95 59.600 59.425 0.175 1
1 1107 . 2 1 1 A 95 95 LYS CB C 95 32.300 32.274 0.026 1
1 1111 . 2 1 1 A 95 95 LYS N N 95 121.400 121.839 -0.439 1
1 1112 . 2 1 1 A 96 96 LEU H H 96 8.270 7.847 0.423 1
1 1113 . 2 1 1 A 96 96 LEU HA H 96 4.040 3.936 0.104 1
1 1123 . 2 1 1 A 96 96 LEU C C 96 177.700 178.392 -0.692 1
1 1124 . 2 1 1 A 96 96 LEU CA C 96 58.600 58.222 0.378 1
1 1125 . 2 1 1 A 96 96 LEU CB C 96 41.000 41.406 -0.406 1
1 1129 . 2 1 1 A 96 96 LEU N N 96 124.800 121.321 3.479 1
1 1130 . 2 1 1 A 97 97 GLU H H 97 8.500 8.476 0.024 1
1 1131 . 2 1 1 A 97 97 GLU HA H 97 3.760 4.062 -0.302 1
1 1136 . 2 1 1 A 97 97 GLU C C 97 179.100 179.198 -0.098 1
1 1137 . 2 1 1 A 97 97 GLU CA C 97 59.900 59.041 0.859 1
1 1138 . 2 1 1 A 97 97 GLU CB C 97 28.700 29.303 -0.603 1
1 1140 . 2 1 1 A 97 97 GLU N N 97 119.000 117.358 1.642 1
1 1141 . 2 1 1 A 98 98 LEU H H 98 7.740 8.252 -0.512 1
1 1142 . 2 1 1 A 98 98 LEU HA H 98 4.110 4.013 0.097 1
1 1152 . 2 1 1 A 98 98 LEU C C 98 179.700 179.366 0.334 1
1 1153 . 2 1 1 A 98 98 LEU CA C 98 57.900 57.721 0.179 1
1 1154 . 2 1 1 A 98 98 LEU CB C 98 41.800 41.360 0.440 1
1 1158 . 2 1 1 A 98 98 LEU N N 98 119.200 121.092 -1.892 1
1 1159 . 2 1 1 A 99 99 SER H H 99 8.290 8.139 0.151 1
1 1160 . 2 1 1 A 99 99 SER HA H 99 4.220 4.413 -0.193 1
1 1163 . 2 1 1 A 99 99 SER C C 99 176.600 177.353 -0.753 1
1 1164 . 2 1 1 A 99 99 SER CA C 99 62.400 61.123 1.277 1
1 1165 . 2 1 1 A 99 99 SER CB C 99 63.200 62.784 0.416 1
1 1166 . 2 1 1 A 99 99 SER N N 99 116.300 114.922 1.378 1
1 1167 . 2 1 1 A 100 100 LEU H H 100 8.490 8.217 0.273 1
1 1168 . 2 1 1 A 100 100 LEU HA H 100 3.960 3.964 -0.004 1
1 1178 . 2 1 1 A 100 100 LEU C C 100 179.300 179.605 -0.305 1
1 1179 . 2 1 1 A 100 100 LEU CA C 100 57.700 57.854 -0.154 1
1 1180 . 2 1 1 A 100 100 LEU CB C 100 41.300 41.212 0.088 1
1 1184 . 2 1 1 A 100 100 LEU N N 100 120.900 122.953 -2.053 1
1 1185 . 2 1 1 A 101 101 GLN H H 101 7.680 8.554 -0.874 1
1 1186 . 2 1 1 A 101 101 GLN HA H 101 4.100 3.949 0.151 1
1 1193 . 2 1 1 A 101 101 GLN C C 101 178.700 177.926 0.774 1
1 1194 . 2 1 1 A 101 101 GLN CA C 101 58.800 58.847 -0.047 1
1 1195 . 2 1 1 A 101 101 GLN CB C 101 27.900 27.841 0.059 1
1 1197 . 2 1 1 A 101 101 GLN N N 101 119.100 118.104 0.996 1
1 1199 . 2 1 1 A 102 102 GLU H H 102 7.850 7.879 -0.029 1
1 1200 . 2 1 1 A 102 102 GLU HA H 102 4.050 4.069 -0.019 1
1 1205 . 2 1 1 A 102 102 GLU C C 102 179.100 179.050 0.050 1
1 1206 . 2 1 1 A 102 102 GLU CA C 102 58.400 59.367 -0.967 1
1 1207 . 2 1 1 A 102 102 GLU CB C 102 28.600 29.143 -0.543 1
1 1209 . 2 1 1 A 102 102 GLU N N 102 118.400 118.661 -0.261 1
1 1210 . 2 1 1 A 103 103 LEU H H 103 8.080 8.168 -0.088 1
1 1211 . 2 1 1 A 103 103 LEU HA H 103 4.020 3.995 0.025 1
1 1221 . 2 1 1 A 103 103 LEU C C 103 178.200 178.349 -0.149 1
1 1222 . 2 1 1 A 103 103 LEU CA C 103 57.000 58.143 -1.143 1
1 1223 . 2 1 1 A 103 103 LEU CB C 103 41.900 41.543 0.357 1
1 1227 . 2 1 1 A 103 103 LEU N N 103 120.600 122.765 -2.165 1
1 1228 . 2 1 1 A 104 104 GLN H H 104 7.900 8.605 -0.705 1
1 1229 . 2 1 1 A 104 104 GLN HA H 104 4.090 4.095 -0.005 1
1 1236 . 2 1 1 A 104 104 GLN C C 104 177.300 176.853 0.447 1
1 1237 . 2 1 1 A 104 104 GLN CA C 104 58.100 57.888 0.212 1
1 1238 . 2 1 1 A 104 104 GLN CB C 104 29.400 27.482 1.918 1
1 1240 . 2 1 1 A 104 104 GLN N N 104 117.700 116.461 1.239 1
1 1242 . 2 1 1 A 105 105 VAL H H 105 7.620 6.997 0.623 1
1 1243 . 2 1 1 A 105 105 VAL HA H 105 4.190 4.326 -0.136 1
1 1251 . 2 1 1 A 105 105 VAL C C 105 176.800 176.456 0.344 1
1 1252 . 2 1 1 A 105 105 VAL CA C 105 62.600 61.794 0.806 1
1 1253 . 2 1 1 A 105 105 VAL CB C 105 32.000 33.018 -1.018 1
1 1256 . 2 1 1 A 105 105 VAL N N 105 114.900 115.782 -0.882 1
1 1257 . 2 1 1 A 106 106 SER H H 106 7.900 7.697 0.203 1
1 1258 . 2 1 1 A 106 106 SER HA H 106 4.460 4.571 -0.111 1
1 1261 . 2 1 1 A 106 106 SER C C 106 175.000 176.316 -1.316 1
1 1262 . 2 1 1 A 106 106 SER CA C 106 58.900 58.418 0.482 1
1 1263 . 2 1 1 A 106 106 SER CB C 106 63.900 64.495 -0.595 1
1 1264 . 2 1 1 A 106 106 SER N N 106 116.900 117.591 -0.691 1
1 1265 . 2 1 1 A 107 107 SER H H 107 8.230 8.064 0.166 1
1 1266 . 2 1 1 A 107 107 SER HA H 107 4.390 4.186 0.204 1
1 1269 . 2 1 1 A 107 107 SER C C 107 174.600 175.331 -0.731 1
1 1270 . 2 1 1 A 107 107 SER CA C 107 58.400 60.813 -2.413 1
1 1271 . 2 1 1 A 107 107 SER CB C 107 63.600 63.047 0.553 1
1 1272 . 2 1 1 A 107 107 SER N N 107 117.500 115.446 2.054 1
1 1273 . 2 1 1 A 108 108 ALA H H 108 8.080 7.807 0.273 1
1 1274 . 2 1 1 A 108 108 ALA HA H 108 4.280 3.933 0.347 1
1 1278 . 2 1 1 A 108 108 ALA C C 108 177.500 176.559 0.941 1
1 1279 . 2 1 1 A 108 108 ALA CA C 108 52.700 55.014 -2.314 1
1 1280 . 2 1 1 A 108 108 ALA CB C 108 19.200 16.856 2.344 1
1 1281 . 2 1 1 A 108 108 ALA N N 108 124.900 120.642 4.258 1
1 1282 . 2 1 1 A 109 109 ALA H H 109 8.080 8.034 0.046 1
1 1283 . 2 1 1 A 109 109 ALA HA H 109 4.280 4.332 -0.052 1
1 1287 . 2 1 1 A 109 109 ALA C C 109 177.700 177.478 0.222 1
1 1288 . 2 1 1 A 109 109 ALA CA C 109 52.400 52.067 0.333 1
1 1289 . 2 1 1 A 109 109 ALA CB C 109 19.400 19.959 -0.559 1
1 1290 . 2 1 1 A 109 109 ALA N N 109 123.000 121.195 1.805 1
1 1291 . 2 1 1 A 110 110 ALA H H 110 8.300 8.657 -0.357 1
1 1292 . 2 1 1 A 110 110 ALA HA H 110 4.280 4.214 0.066 1
1 1296 . 2 1 1 A 110 110 ALA C C 110 178.200 178.740 -0.540 1
1 1297 . 2 1 1 A 110 110 ALA CA C 110 52.700 54.900 -2.200 1
1 1298 . 2 1 1 A 110 110 ALA CB C 110 19.200 19.113 0.087 1
1 1299 . 2 1 1 A 110 110 ALA N N 110 123.200 122.558 0.642 1
1 1300 . 2 1 1 A 111 111 GLY H H 111 8.300 7.479 0.821 1
1 1301 . 2 1 1 A 111 111 GLY HA2 H 111 3.930 4.103 -0.173 1
1 1302 . 2 1 1 A 111 111 GLY HA3 H 111 3.940 4.105 -0.165 1
1 1303 . 2 1 1 A 111 111 GLY C C 111 173.700 173.188 0.512 1
1 1304 . 2 1 1 A 111 111 GLY CA C 111 45.100 45.815 -0.715 1
1 1305 . 2 1 1 A 111 111 GLY N N 111 108.000 102.243 5.757 1
1 1306 . 2 1 1 A 112 112 VAL H H 112 7.930 8.011 -0.081 1
1 1307 . 2 1 1 A 112 112 VAL HA H 112 4.420 4.495 -0.075 1
1 1315 . 2 1 1 A 112 112 VAL CA C 112 60.000 59.029 0.971 1
1 1316 . 2 1 1 A 112 112 VAL CB C 112 32.200 32.944 -0.744 1
1 1319 . 2 1 1 A 112 112 VAL N N 112 120.400 121.382 -0.982 1
1 1320 . 2 1 1 A 113 113 PRO HA H 113 4.370 4.268 0.102 1
1 1327 . 2 1 1 A 113 113 PRO C C 113 177.300 177.910 -0.610 1
1 1328 . 2 1 1 A 113 113 PRO CA C 113 63.900 63.946 -0.046 1
1 1329 . 2 1 1 A 113 113 PRO CB C 113 31.800 31.305 0.495 1
1 1332 . 2 1 1 A 114 114 GLY H H 114 8.570 8.776 -0.206 1
1 1333 . 2 1 1 A 114 114 GLY HA2 H 114 3.880 3.976 -0.096 1
1 1334 . 2 1 1 A 114 114 GLY HA3 H 114 4.120 3.978 0.142 1
1 1335 . 2 1 1 A 114 114 GLY C C 114 174.900 175.262 -0.362 1
1 1336 . 2 1 1 A 114 114 GLY CA C 114 45.200 45.850 -0.650 1
1 1337 . 2 1 1 A 114 114 GLY N N 114 109.000 113.232 -4.232 1
1 1338 . 2 1 1 A 115 115 THR H H 115 7.900 7.533 0.367 1
1 1339 . 2 1 1 A 115 115 THR HA H 115 4.400 3.998 0.402 1
1 1344 . 2 1 1 A 115 115 THR C C 115 174.300 173.700 0.600 1
1 1345 . 2 1 1 A 115 115 THR CA C 115 61.700 64.744 -3.044 1
1 1346 . 2 1 1 A 115 115 THR CB C 115 69.700 69.670 0.030 1
1 1348 . 2 1 1 A 115 115 THR N N 115 111.400 115.705 -4.305 1
1 1349 . 2 1 1 A 116 116 ASN H H 116 8.450 7.989 0.461 1
1 1350 . 2 1 1 A 116 116 ASN HA H 116 4.970 5.170 -0.200 1
1 1355 . 2 1 1 A 116 116 ASN CA C 116 51.500 49.668 1.832 1
1 1356 . 2 1 1 A 116 116 ASN CB C 116 38.900 40.304 -1.404 1
1 1357 . 2 1 1 A 116 116 ASN N N 116 123.100 116.525 6.575 1
1 1359 . 2 1 1 A 117 117 PRO HA H 117 4.370 4.279 0.091 1
1 1366 . 2 1 1 A 117 117 PRO C C 117 178.400 177.997 0.403 1
1 1367 . 2 1 1 A 117 117 PRO CA C 117 64.800 64.995 -0.195 1
1 1368 . 2 1 1 A 117 117 PRO CB C 117 32.100 31.723 0.377 1
1 1371 . 2 1 1 A 118 118 VAL H H 118 7.750 7.630 0.120 1
1 1372 . 2 1 1 A 118 118 VAL HA H 118 3.810 3.726 0.084 1
1 1380 . 2 1 1 A 118 118 VAL C C 118 178.300 178.302 -0.002 1
1 1381 . 2 1 1 A 118 118 VAL CA C 118 65.200 65.283 -0.083 1
1 1382 . 2 1 1 A 118 118 VAL CB C 118 31.500 31.591 -0.091 1
1 1385 . 2 1 1 A 118 118 VAL N N 118 118.300 116.153 2.147 1
1 1386 . 2 1 1 A 119 119 LEU H H 119 7.540 7.961 -0.421 1
1 1387 . 2 1 1 A 119 119 LEU HA H 119 4.030 3.931 0.099 1
1 1397 . 2 1 1 A 119 119 LEU C C 119 178.900 179.815 -0.915 1
1 1398 . 2 1 1 A 119 119 LEU CA C 119 57.800 58.118 -0.318 1
1 1399 . 2 1 1 A 119 119 LEU CB C 119 40.700 40.774 -0.074 1
1 1403 . 2 1 1 A 119 119 LEU N N 119 119.700 120.176 -0.476 1
1 1404 . 2 1 1 A 120 120 ASN H H 120 8.080 8.095 -0.015 1
1 1405 . 2 1 1 A 120 120 ASN HA H 120 4.420 4.483 -0.063 1
1 1410 . 2 1 1 A 120 120 ASN C C 120 178.100 178.546 -0.446 1
1 1411 . 2 1 1 A 120 120 ASN CA C 120 56.100 56.143 -0.043 1
1 1412 . 2 1 1 A 120 120 ASN CB C 120 37.800 37.931 -0.131 1
1 1413 . 2 1 1 A 120 120 ASN N N 120 117.700 118.795 -1.095 1
1 1415 . 2 1 1 A 121 121 ASN H H 121 8.120 7.870 0.250 1
1 1416 . 2 1 1 A 121 121 ASN HA H 121 4.490 4.430 0.060 1
1 1421 . 2 1 1 A 121 121 ASN C C 121 178.000 178.179 -0.179 1
1 1422 . 2 1 1 A 121 121 ASN CA C 121 56.100 56.426 -0.326 1
1 1423 . 2 1 1 A 121 121 ASN CB C 121 37.800 38.493 -0.693 1
1 1424 . 2 1 1 A 121 121 ASN N N 121 120.000 118.361 1.639 1
1 1426 . 2 1 1 A 122 122 LEU H H 122 8.180 8.125 0.055 1
1 1427 . 2 1 1 A 122 122 LEU HA H 122 4.050 3.891 0.159 1
1 1437 . 2 1 1 A 122 122 LEU C C 122 173.800 178.753 -4.953 1
1 1438 . 2 1 1 A 122 122 LEU CA C 122 58.500 58.094 0.406 1
1 1439 . 2 1 1 A 122 122 LEU CB C 122 41.900 41.447 0.453 1
1 1443 . 2 1 1 A 122 122 LEU N N 122 122.600 120.347 2.253 1
1 1444 . 2 1 1 A 123 123 LEU H H 123 8.260 8.082 0.178 1
1 1445 . 2 1 1 A 123 123 LEU HA H 123 3.850 3.967 -0.117 1
1 1455 . 2 1 1 A 123 123 LEU C C 123 178.900 178.407 0.493 1
1 1456 . 2 1 1 A 123 123 LEU CA C 123 58.500 58.062 0.438 1
1 1457 . 2 1 1 A 123 123 LEU CB C 123 41.200 41.397 -0.197 1
1 1461 . 2 1 1 A 123 123 LEU N N 123 119.700 120.921 -1.221 1
1 1462 . 2 1 1 A 124 124 SER H H 124 7.950 8.225 -0.275 1
1 1463 . 2 1 1 A 124 124 SER HA H 124 4.240 4.128 0.112 1
1 1466 . 2 1 1 A 124 124 SER C C 124 177.500 177.140 0.360 1
1 1467 . 2 1 1 A 124 124 SER CA C 124 61.600 61.783 -0.183 1
1 1468 . 2 1 1 A 124 124 SER CB C 124 62.600 62.841 -0.241 1
1 1469 . 2 1 1 A 124 124 SER N N 124 113.400 113.964 -0.564 1
1 1470 . 2 1 1 A 125 125 CYS H H 125 8.040 8.329 -0.289 1
1 1471 . 2 1 1 A 125 125 CYS HA H 125 4.350 4.100 0.250 1
1 1474 . 2 1 1 A 125 125 CYS C C 125 176.800 176.990 -0.190 1
1 1475 . 2 1 1 A 125 125 CYS CA C 125 62.600 63.884 -1.284 1
1 1476 . 2 1 1 A 125 125 CYS CB C 125 27.100 26.811 0.289 1
1 1477 . 2 1 1 A 125 125 CYS N N 125 119.800 119.717 0.083 1
1 1478 . 2 1 1 A 126 126 VAL H H 126 8.290 8.447 -0.157 1
1 1479 . 2 1 1 A 126 126 VAL HA H 126 3.430 3.371 0.059 1
1 1487 . 2 1 1 A 126 126 VAL C C 126 177.800 177.645 0.155 1
1 1488 . 2 1 1 A 126 126 VAL CA C 126 67.100 66.924 0.176 1
1 1489 . 2 1 1 A 126 126 VAL CB C 126 31.400 31.406 -0.006 1
1 1492 . 2 1 1 A 126 126 VAL N N 126 121.900 120.588 1.312 1
1 1493 . 2 1 1 A 127 127 GLN H H 127 8.200 8.397 -0.197 1
1 1494 . 2 1 1 A 127 127 GLN HA H 127 3.970 3.944 0.026 1
1 1501 . 2 1 1 A 127 127 GLN C C 127 178.200 178.228 -0.028 1
1 1502 . 2 1 1 A 127 127 GLN CA C 127 58.700 58.897 -0.197 1
1 1503 . 2 1 1 A 127 127 GLN CB C 127 27.800 28.595 -0.795 1
1 1505 . 2 1 1 A 127 127 GLN N N 127 119.700 118.297 1.403 1
1 1507 . 2 1 1 A 128 128 GLU H H 128 7.880 7.989 -0.109 1
1 1508 . 2 1 1 A 128 128 GLU HA H 128 4.200 4.094 0.106 1
1 1513 . 2 1 1 A 128 128 GLU C C 128 178.400 178.678 -0.278 1
1 1514 . 2 1 1 A 128 128 GLU CA C 128 59.000 58.962 0.038 1
1 1515 . 2 1 1 A 128 128 GLU CB C 128 28.400 29.516 -1.116 1
1 1517 . 2 1 1 A 128 128 GLU N N 128 119.800 119.718 0.082 1
1 1518 . 2 1 1 A 129 129 ILE H H 129 8.000 8.486 -0.486 1
1 1519 . 2 1 1 A 129 129 ILE HA H 129 3.460 3.443 0.017 1
1 1529 . 2 1 1 A 129 129 ILE C C 129 176.800 178.151 -1.351 1
1 1530 . 2 1 1 A 129 129 ILE CA C 129 66.100 65.422 0.678 1
1 1531 . 2 1 1 A 129 129 ILE CB C 129 38.200 37.448 0.752 1
1 1535 . 2 1 1 A 129 129 ILE N N 129 119.500 120.125 -0.625 1
1 1536 . 2 1 1 A 130 130 SER H H 130 8.040 8.270 -0.230 1
1 1537 . 2 1 1 A 130 130 SER HA H 130 3.780 4.196 -0.416 1
1 1540 . 2 1 1 A 130 130 SER C C 130 176.200 176.335 -0.135 1
1 1541 . 2 1 1 A 130 130 SER CA C 130 62.100 61.532 0.568 1
1 1542 . 2 1 1 A 130 130 SER CB C 130 62.600 62.154 0.446 1
1 1543 . 2 1 1 A 130 130 SER N N 130 112.800 114.809 -2.009 1
1 1544 . 2 1 1 A 131 131 ASP H H 131 8.270 7.870 0.400 1
1 1545 . 2 1 1 A 131 131 ASP HA H 131 4.310 4.420 -0.110 1
1 1548 . 2 1 1 A 131 131 ASP C C 131 179.200 178.577 0.623 1
1 1549 . 2 1 1 A 131 131 ASP CA C 131 56.800 57.606 -0.806 1
1 1550 . 2 1 1 A 131 131 ASP CB C 131 40.900 41.387 -0.487 1
1 1551 . 2 1 1 A 131 131 ASP N N 131 119.600 122.013 -2.413 1
1 1552 . 2 1 1 A 132 132 VAL H H 132 8.470 8.127 0.343 1
1 1553 . 2 1 1 A 132 132 VAL HA H 132 3.520 3.731 -0.211 1
1 1561 . 2 1 1 A 132 132 VAL C C 132 178.700 178.555 0.145 1
1 1562 . 2 1 1 A 132 132 VAL CA C 132 66.500 66.516 -0.016 1
1 1563 . 2 1 1 A 132 132 VAL CB C 132 31.500 31.714 -0.214 1
1 1566 . 2 1 1 A 132 132 VAL N N 132 118.100 119.573 -1.473 1
1 1567 . 2 1 1 A 133 133 VAL H H 133 8.140 7.807 0.333 1
1 1568 . 2 1 1 A 133 133 VAL HA H 133 3.770 3.832 -0.062 1
1 1576 . 2 1 1 A 133 133 VAL C C 133 176.500 176.541 -0.041 1
1 1577 . 2 1 1 A 133 133 VAL CA C 133 65.100 66.442 -1.342 1
1 1578 . 2 1 1 A 133 133 VAL CB C 133 31.600 31.607 -0.007 1
1 1581 . 2 1 1 A 133 133 VAL N N 133 117.000 120.718 -3.718 1
1 1582 . 2 1 1 A 134 134 GLN H H 134 7.490 7.784 -0.294 1
1 1583 . 2 1 1 A 134 134 GLN HA H 134 4.350 4.472 -0.122 1
1 1590 . 2 1 1 A 134 134 GLN C C 134 175.400 175.641 -0.241 1
1 1591 . 2 1 1 A 134 134 GLN CA C 134 56.700 55.503 1.197 1
1 1592 . 2 1 1 A 134 134 GLN CB C 134 30.500 29.238 1.262 1
1 1594 . 2 1 1 A 134 134 GLN N N 134 116.300 117.212 -0.912 1
1 1 . 3 1 1 A 2 2 GLY HA2 H 2 3.890 4.072 -0.182 1
1 2 . 3 1 1 A 2 2 GLY HA3 H 2 3.890 4.089 -0.199 1
1 3 . 3 1 1 A 2 2 GLY C C 2 174.200 173.208 0.992 1
1 4 . 3 1 1 A 2 2 GLY CA C 2 44.700 45.302 -0.602 1
1 5 . 3 1 1 A 3 3 HIS H H 3 8.380 8.715 -0.335 1
1 6 . 3 1 1 A 3 3 HIS HA H 3 4.610 4.769 -0.159 1
1 9 . 3 1 1 A 3 3 HIS C C 3 174.500 175.544 -1.044 1
1 10 . 3 1 1 A 3 3 HIS CA C 3 55.200 56.359 -1.159 1
1 11 . 3 1 1 A 3 3 HIS CB C 3 28.800 32.127 -3.327 1
1 12 . 3 1 1 A 3 3 HIS N N 3 117.600 118.266 -0.666 1
1 13 . 3 1 1 A 4 4 HIS H H 4 8.520 8.282 0.238 1
1 14 . 3 1 1 A 4 4 HIS HA H 4 4.640 4.105 0.535 1
1 17 . 3 1 1 A 4 4 HIS C C 4 174.200 175.210 -1.010 1
1 18 . 3 1 1 A 4 4 HIS CA C 4 55.100 56.874 -1.774 1
1 19 . 3 1 1 A 4 4 HIS CB C 4 28.900 28.859 0.041 1
1 20 . 3 1 1 A 4 4 HIS N N 4 119.000 117.359 1.641 1
1 21 . 3 1 1 A 5 5 HIS H H 5 8.530 7.958 0.572 1
1 22 . 3 1 1 A 5 5 HIS HA H 5 4.410 4.750 -0.340 1
1 25 . 3 1 1 A 5 5 HIS CA C 5 54.900 54.412 0.488 1
1 26 . 3 1 1 A 5 5 HIS CB C 5 27.300 29.582 -2.282 1
1 27 . 3 1 1 A 5 5 HIS N N 5 121.600 119.629 1.971 1
1 28 . 3 1 1 A 6 6 HIS HA H 6 4.640 4.764 -0.124 1
1 31 . 3 1 1 A 6 6 HIS C C 6 174.100 174.152 -0.052 1
1 32 . 3 1 1 A 6 6 HIS CA C 6 55.100 55.294 -0.194 1
1 33 . 3 1 1 A 6 6 HIS CB C 6 29.100 30.258 -1.158 1
1 34 . 3 1 1 A 7 7 HIS H H 7 8.690 8.690 0.000 1
1 35 . 3 1 1 A 7 7 HIS HA H 7 4.650 4.809 -0.159 1
1 38 . 3 1 1 A 7 7 HIS C C 7 174.200 173.364 0.836 1
1 39 . 3 1 1 A 7 7 HIS CA C 7 55.200 53.279 1.921 1
1 40 . 3 1 1 A 7 7 HIS CB C 7 29.300 32.337 -3.037 1
1 41 . 3 1 1 A 7 7 HIS N N 7 121.400 121.210 0.190 1
1 42 . 3 1 1 A 8 8 HIS H H 8 8.660 8.778 -0.118 1
1 43 . 3 1 1 A 8 8 HIS HA H 8 4.700 4.690 0.010 1
1 46 . 3 1 1 A 8 8 HIS C C 8 174.200 174.691 -0.491 1
1 47 . 3 1 1 A 8 8 HIS CA C 8 55.000 56.393 -1.393 1
1 48 . 3 1 1 A 8 8 HIS CB C 8 29.300 31.172 -1.872 1
1 49 . 3 1 1 A 8 8 HIS N N 8 120.400 117.784 2.616 1
1 50 . 3 1 1 A 9 9 SER H H 9 8.490 8.654 -0.164 1
1 51 . 3 1 1 A 9 9 SER HA H 9 4.390 4.903 -0.513 1
1 54 . 3 1 1 A 9 9 SER C C 9 174.100 173.149 0.951 1
1 55 . 3 1 1 A 9 9 SER CA C 9 58.300 55.735 2.565 1
1 56 . 3 1 1 A 9 9 SER CB C 9 63.700 65.407 -1.707 1
1 57 . 3 1 1 A 9 9 SER N N 9 118.100 115.473 2.627 1
1 58 . 3 1 1 A 10 10 HIS H H 10 8.710 8.774 -0.064 1
1 59 . 3 1 1 A 10 10 HIS HA H 10 4.690 4.579 0.111 1
1 63 . 3 1 1 A 10 10 HIS C C 10 174.200 174.903 -0.703 1
1 64 . 3 1 1 A 10 10 HIS CA C 10 55.200 56.047 -0.847 1
1 65 . 3 1 1 A 10 10 HIS CB C 10 28.800 29.959 -1.159 1
1 66 . 3 1 1 A 10 10 HIS N N 10 120.700 120.378 0.322 1
1 67 . 3 1 1 A 11 11 MET H H 11 8.410 8.850 -0.440 1
1 68 . 3 1 1 A 11 11 MET HA H 11 4.420 5.082 -0.662 1
1 76 . 3 1 1 A 11 11 MET C C 11 175.800 174.167 1.633 1
1 77 . 3 1 1 A 11 11 MET CA C 11 55.100 54.188 0.912 1
1 78 . 3 1 1 A 11 11 MET CB C 11 32.800 33.241 -0.441 1
1 81 . 3 1 1 A 11 11 MET N N 11 122.300 121.998 0.302 1
1 82 . 3 1 1 A 12 12 ALA H H 12 8.440 8.638 -0.198 1
1 83 . 3 1 1 A 12 12 ALA HA H 12 4.280 4.797 -0.517 1
1 87 . 3 1 1 A 12 12 ALA C C 12 177.400 176.788 0.612 1
1 88 . 3 1 1 A 12 12 ALA CA C 12 52.400 50.990 1.410 1
1 89 . 3 1 1 A 12 12 ALA CB C 12 18.800 19.967 -1.167 1
1 90 . 3 1 1 A 12 12 ALA N N 12 125.900 128.114 -2.214 1
1 91 . 3 1 1 A 13 13 ASN H H 13 8.440 8.813 -0.373 1
1 92 . 3 1 1 A 13 13 ASN HA H 13 4.660 4.720 -0.060 1
1 97 . 3 1 1 A 13 13 ASN C C 13 175.900 175.391 0.509 1
1 98 . 3 1 1 A 13 13 ASN CA C 13 53.200 53.556 -0.356 1
1 99 . 3 1 1 A 13 13 ASN CB C 13 38.800 39.077 -0.277 1
1 100 . 3 1 1 A 13 13 ASN N N 13 118.300 122.968 -4.668 1
1 102 . 3 1 1 A 14 14 GLY H H 14 8.370 8.301 0.069 1
1 103 . 3 1 1 A 14 14 GLY HA2 H 14 3.920 4.058 -0.138 1
1 104 . 3 1 1 A 14 14 GLY HA3 H 14 3.920 4.059 -0.139 1
1 105 . 3 1 1 A 14 14 GLY C C 14 174.000 173.403 0.597 1
1 106 . 3 1 1 A 14 14 GLY CA C 14 45.200 44.859 0.341 1
1 107 . 3 1 1 A 14 14 GLY N N 14 109.600 109.087 0.513 1
1 108 . 3 1 1 A 15 15 ALA H H 15 8.140 8.147 -0.007 1
1 109 . 3 1 1 A 15 15 ALA HA H 15 4.280 4.611 -0.331 1
1 113 . 3 1 1 A 15 15 ALA C C 15 177.300 177.117 0.183 1
1 114 . 3 1 1 A 15 15 ALA CA C 15 52.500 51.349 1.151 1
1 115 . 3 1 1 A 15 15 ALA CB C 15 19.100 20.153 -1.053 1
1 116 . 3 1 1 A 15 15 ALA N N 15 123.800 124.805 -1.005 1
1 117 . 3 1 1 A 16 16 ALA H H 16 8.030 8.617 -0.587 1
1 118 . 3 1 1 A 16 16 ALA HA H 16 4.280 4.460 -0.180 1
1 122 . 3 1 1 A 16 16 ALA C C 16 178.400 178.195 0.205 1
1 123 . 3 1 1 A 16 16 ALA CA C 16 52.600 52.371 0.229 1
1 124 . 3 1 1 A 16 16 ALA CB C 16 19.100 19.930 -0.830 1
1 125 . 3 1 1 A 16 16 ALA N N 16 122.300 125.223 -2.923 1
1 126 . 3 1 1 A 17 17 GLY H H 17 8.320 8.837 -0.517 1
1 127 . 3 1 1 A 17 17 GLY HA2 H 17 3.960 4.031 -0.071 1
1 128 . 3 1 1 A 17 17 GLY HA3 H 17 3.960 4.033 -0.073 1
1 129 . 3 1 1 A 17 17 GLY C C 17 174.500 175.241 -0.741 1
1 130 . 3 1 1 A 17 17 GLY CA C 17 45.200 46.606 -1.406 1
1 131 . 3 1 1 A 17 17 GLY N N 17 107.800 110.316 -2.516 1
1 132 . 3 1 1 A 18 18 THR H H 18 7.970 8.019 -0.049 1
1 133 . 3 1 1 A 18 18 THR HA H 18 4.290 3.962 0.328 1
1 138 . 3 1 1 A 18 18 THR C C 18 174.600 176.066 -1.466 1
1 139 . 3 1 1 A 18 18 THR CA C 18 62.000 66.184 -4.184 1
1 140 . 3 1 1 A 18 18 THR CB C 18 69.700 68.661 1.039 1
1 142 . 3 1 1 A 18 18 THR N N 18 113.800 112.563 1.237 1
1 143 . 3 1 1 A 19 19 LYS H H 19 8.350 8.662 -0.312 1
1 144 . 3 1 1 A 19 19 LYS HA H 19 4.270 4.175 0.095 1
1 153 . 3 1 1 A 19 19 LYS C C 19 176.600 176.938 -0.338 1
1 154 . 3 1 1 A 19 19 LYS CA C 19 56.500 58.783 -2.283 1
1 155 . 3 1 1 A 19 19 LYS CB C 19 32.800 32.220 0.580 1
1 159 . 3 1 1 A 19 19 LYS N N 19 124.000 119.520 4.480 1
1 160 . 3 1 1 A 20 20 VAL H H 20 8.060 7.893 0.167 1
1 161 . 3 1 1 A 20 20 VAL HA H 20 3.990 4.415 -0.425 1
1 169 . 3 1 1 A 20 20 VAL C C 20 175.900 176.390 -0.490 1
1 170 . 3 1 1 A 20 20 VAL CA C 20 62.400 60.994 1.406 1
1 171 . 3 1 1 A 20 20 VAL CB C 20 32.600 33.002 -0.402 1
1 174 . 3 1 1 A 20 20 VAL N N 20 121.700 119.078 2.622 1
1 175 . 3 1 1 A 21 21 ALA H H 21 8.310 7.682 0.628 1
1 176 . 3 1 1 A 21 21 ALA HA H 21 4.290 4.062 0.228 1
1 180 . 3 1 1 A 21 21 ALA C C 21 177.600 178.525 -0.925 1
1 181 . 3 1 1 A 21 21 ALA CA C 21 52.400 55.280 -2.880 1
1 182 . 3 1 1 A 21 21 ALA CB C 21 19.000 19.209 -0.209 1
1 183 . 3 1 1 A 21 21 ALA N N 21 127.700 125.629 2.071 1
1 184 . 3 1 1 A 22 22 LEU H H 22 8.150 7.873 0.277 1
1 185 . 3 1 1 A 22 22 LEU HA H 22 4.280 4.380 -0.100 1
1 195 . 3 1 1 A 22 22 LEU C C 22 177.400 175.627 1.773 1
1 196 . 3 1 1 A 22 22 LEU CA C 22 55.200 54.611 0.589 1
1 197 . 3 1 1 A 22 22 LEU CB C 22 42.200 39.433 2.767 1
1 201 . 3 1 1 A 22 22 LEU N N 22 121.800 118.092 3.708 1
1 202 . 3 1 1 A 23 23 ARG H H 23 8.240 7.978 0.262 1
1 203 . 3 1 1 A 23 23 ARG HA H 23 4.290 4.499 -0.209 1
1 211 . 3 1 1 A 23 23 ARG C C 23 176.300 175.300 1.000 1
1 212 . 3 1 1 A 23 23 ARG CA C 23 56.000 56.052 -0.052 1
1 213 . 3 1 1 A 23 23 ARG CB C 23 30.600 31.622 -1.022 1
1 216 . 3 1 1 A 23 23 ARG N N 23 122.000 123.154 -1.154 1
1 218 . 3 1 1 A 24 24 LYS H H 24 8.370 8.970 -0.600 1
1 219 . 3 1 1 A 24 24 LYS HA H 24 4.330 4.512 -0.182 1
1 228 . 3 1 1 A 24 24 LYS C C 24 176.800 176.404 0.396 1
1 229 . 3 1 1 A 24 24 LYS CA C 24 56.400 57.251 -0.851 1
1 230 . 3 1 1 A 24 24 LYS CB C 24 32.700 35.023 -2.323 1
1 234 . 3 1 1 A 24 24 LYS N N 24 122.900 125.948 -3.048 1
1 235 . 3 1 1 A 25 25 THR H H 25 8.100 7.897 0.203 1
1 236 . 3 1 1 A 25 25 THR HA H 25 4.290 4.773 -0.483 1
1 241 . 3 1 1 A 25 25 THR C C 25 174.600 173.236 1.364 1
1 242 . 3 1 1 A 25 25 THR CA C 25 61.500 60.388 1.112 1
1 243 . 3 1 1 A 25 25 THR CB C 25 69.800 71.217 -1.417 1
1 245 . 3 1 1 A 25 25 THR N N 25 115.500 111.916 3.584 1
1 246 . 3 1 1 A 26 26 LYS H H 26 8.370 8.498 -0.128 1
1 247 . 3 1 1 A 26 26 LYS HA H 26 4.270 4.741 -0.471 1
1 256 . 3 1 1 A 26 26 LYS C C 26 176.600 175.804 0.796 1
1 257 . 3 1 1 A 26 26 LYS CA C 26 56.600 54.517 2.083 1
1 258 . 3 1 1 A 26 26 LYS CB C 26 32.700 34.794 -2.094 1
1 262 . 3 1 1 A 26 26 LYS N N 26 123.700 125.687 -1.987 1
1 263 . 3 1 1 A 27 27 GLN H H 27 8.390 8.849 -0.459 1
1 264 . 3 1 1 A 27 27 GLN HA H 27 4.240 4.507 -0.267 1
1 271 . 3 1 1 A 27 27 GLN C C 27 175.900 174.578 1.322 1
1 272 . 3 1 1 A 27 27 GLN CA C 27 56.100 56.184 -0.084 1
1 273 . 3 1 1 A 27 27 GLN CB C 27 29.300 29.460 -0.160 1
1 275 . 3 1 1 A 27 27 GLN N N 27 121.700 117.118 4.582 1
1 277 . 3 1 1 A 28 28 ALA H H 28 8.330 8.077 0.253 1
1 278 . 3 1 1 A 28 28 ALA HA H 28 4.240 4.773 -0.533 1
1 282 . 3 1 1 A 28 28 ALA C C 28 177.700 177.716 -0.016 1
1 283 . 3 1 1 A 28 28 ALA CA C 28 52.500 50.498 2.002 1
1 284 . 3 1 1 A 28 28 ALA CB C 28 19.100 21.708 -2.608 1
1 285 . 3 1 1 A 28 28 ALA N N 28 125.400 120.061 5.339 1
1 286 . 3 1 1 A 29 29 ALA H H 29 8.250 8.977 -0.727 1
1 287 . 3 1 1 A 29 29 ALA HA H 29 4.230 4.013 0.217 1
1 291 . 3 1 1 A 29 29 ALA C C 29 178.000 179.635 -1.635 1
1 292 . 3 1 1 A 29 29 ALA CA C 29 52.500 54.600 -2.100 1
1 293 . 3 1 1 A 29 29 ALA CB C 29 19.100 18.391 0.709 1
1 294 . 3 1 1 A 29 29 ALA N N 29 123.000 125.698 -2.698 1
1 295 . 3 1 1 A 30 30 GLU H H 30 8.260 7.999 0.261 1
1 296 . 3 1 1 A 30 30 GLU HA H 30 4.220 4.064 0.156 1
1 301 . 3 1 1 A 30 30 GLU C C 30 176.500 178.576 -2.076 1
1 302 . 3 1 1 A 30 30 GLU CA C 30 56.400 59.366 -2.966 1
1 303 . 3 1 1 A 30 30 GLU CB C 30 29.500 29.482 0.018 1
1 305 . 3 1 1 A 30 30 GLU N N 30 119.700 118.804 0.896 1
1 306 . 3 1 1 A 31 31 LYS H H 31 8.230 7.612 0.618 1
1 307 . 3 1 1 A 31 31 LYS HA H 31 4.280 4.114 0.166 1
1 316 . 3 1 1 A 31 31 LYS C C 31 176.500 177.194 -0.694 1
1 317 . 3 1 1 A 31 31 LYS CA C 31 56.400 58.732 -2.332 1
1 318 . 3 1 1 A 31 31 LYS CB C 31 32.800 32.922 -0.122 1
1 322 . 3 1 1 A 31 31 LYS N N 31 122.700 118.688 4.012 1
1 323 . 3 1 1 A 32 32 ILE H H 32 8.140 7.570 0.570 1
1 324 . 3 1 1 A 32 32 ILE HA H 32 4.110 4.059 0.051 1
1 334 . 3 1 1 A 32 32 ILE C C 32 176.400 176.314 0.086 1
1 335 . 3 1 1 A 32 32 ILE CA C 32 61.200 62.155 -0.955 1
1 336 . 3 1 1 A 32 32 ILE CB C 32 38.600 37.940 0.660 1
1 340 . 3 1 1 A 32 32 ILE N N 32 122.300 119.520 2.780 1
1 341 . 3 1 1 A 33 33 SER H H 33 8.230 9.122 -0.892 1
1 342 . 3 1 1 A 33 33 SER HA H 33 4.400 4.262 0.138 1
1 345 . 3 1 1 A 33 33 SER C C 33 174.800 176.598 -1.798 1
1 346 . 3 1 1 A 33 33 SER CA C 33 58.300 61.315 -3.015 1
1 347 . 3 1 1 A 33 33 SER CB C 33 63.700 62.892 0.808 1
1 348 . 3 1 1 A 33 33 SER N N 33 119.600 123.067 -3.467 1
1 349 . 3 1 1 A 34 34 ALA H H 34 8.430 8.333 0.097 1
1 350 . 3 1 1 A 34 34 ALA HA H 34 4.220 4.050 0.170 1
1 354 . 3 1 1 A 34 34 ALA C C 34 179.500 179.894 -0.394 1
1 355 . 3 1 1 A 34 34 ALA CA C 34 53.500 55.286 -1.786 1
1 356 . 3 1 1 A 34 34 ALA CB C 34 18.800 18.526 0.274 1
1 357 . 3 1 1 A 34 34 ALA N N 34 126.000 123.477 2.523 1
1 358 . 3 1 1 A 35 35 ASP H H 35 8.380 8.279 0.101 1
1 359 . 3 1 1 A 35 35 ASP HA H 35 4.520 4.404 0.116 1
1 362 . 3 1 1 A 35 35 ASP C C 35 176.500 178.111 -1.611 1
1 363 . 3 1 1 A 35 35 ASP CA C 35 54.800 56.345 -1.545 1
1 364 . 3 1 1 A 35 35 ASP CB C 35 40.200 40.565 -0.365 1
1 365 . 3 1 1 A 35 35 ASP N N 35 118.200 116.773 1.427 1
1 366 . 3 1 1 A 36 36 LYS H H 36 8.000 7.997 0.003 1
1 367 . 3 1 1 A 36 36 LYS HA H 36 4.270 4.128 0.142 1
1 376 . 3 1 1 A 36 36 LYS C C 36 177.000 177.141 -0.141 1
1 377 . 3 1 1 A 36 36 LYS CA C 36 56.800 58.658 -1.858 1
1 378 . 3 1 1 A 36 36 LYS CB C 36 32.900 32.353 0.547 1
1 382 . 3 1 1 A 36 36 LYS N N 36 120.900 119.159 1.741 1
1 383 . 3 1 1 A 37 37 ILE H H 37 7.970 7.247 0.723 1
1 384 . 3 1 1 A 37 37 ILE HA H 37 4.020 4.149 -0.129 1
1 394 . 3 1 1 A 37 37 ILE C C 37 176.100 175.574 0.526 1
1 395 . 3 1 1 A 37 37 ILE CA C 37 61.300 62.437 -1.137 1
1 396 . 3 1 1 A 37 37 ILE CB C 37 38.100 38.169 -0.069 1
1 400 . 3 1 1 A 37 37 ILE N N 37 121.800 121.907 -0.107 1
1 401 . 3 1 1 A 38 38 SER H H 38 7.980 8.900 -0.920 1
1 402 . 3 1 1 A 38 38 SER HA H 38 4.540 4.655 -0.115 1
1 405 . 3 1 1 A 38 38 SER C C 38 174.700 175.505 -0.805 1
1 406 . 3 1 1 A 38 38 SER CA C 38 58.200 58.652 -0.452 1
1 407 . 3 1 1 A 38 38 SER CB C 38 64.400 64.141 0.259 1
1 408 . 3 1 1 A 38 38 SER N N 38 119.000 124.350 -5.350 1
1 409 . 3 1 1 A 39 39 LYS H H 39 8.690 9.017 -0.327 1
1 410 . 3 1 1 A 39 39 LYS HA H 39 3.400 3.813 -0.413 1
1 419 . 3 1 1 A 39 39 LYS C C 39 177.400 178.142 -0.742 1
1 420 . 3 1 1 A 39 39 LYS CA C 39 59.800 60.553 -0.753 1
1 421 . 3 1 1 A 39 39 LYS CB C 39 32.400 32.108 0.292 1
1 425 . 3 1 1 A 39 39 LYS N N 39 124.200 125.498 -1.298 1
1 426 . 3 1 1 A 40 40 GLU H H 40 8.280 8.358 -0.078 1
1 427 . 3 1 1 A 40 40 GLU HA H 40 3.840 4.033 -0.193 1
1 432 . 3 1 1 A 40 40 GLU C C 40 178.400 178.916 -0.516 1
1 433 . 3 1 1 A 40 40 GLU CA C 40 59.400 59.324 0.076 1
1 434 . 3 1 1 A 40 40 GLU CB C 40 28.300 29.320 -1.020 1
1 436 . 3 1 1 A 40 40 GLU N N 40 116.300 117.362 -1.062 1
1 437 . 3 1 1 A 41 41 ALA H H 41 7.890 7.882 0.008 1
1 438 . 3 1 1 A 41 41 ALA HA H 41 3.910 4.052 -0.142 1
1 442 . 3 1 1 A 41 41 ALA C C 41 179.900 180.580 -0.680 1
1 443 . 3 1 1 A 41 41 ALA CA C 41 54.700 55.148 -0.448 1
1 444 . 3 1 1 A 41 41 ALA CB C 41 17.900 18.151 -0.251 1
1 445 . 3 1 1 A 41 41 ALA N N 41 122.300 122.294 0.006 1
1 446 . 3 1 1 A 42 42 LEU H H 42 7.490 7.934 -0.444 1
1 447 . 3 1 1 A 42 42 LEU HA H 42 3.480 3.602 -0.122 1
1 457 . 3 1 1 A 42 42 LEU C C 42 178.900 178.481 0.419 1
1 458 . 3 1 1 A 42 42 LEU CA C 42 59.800 57.627 2.173 1
1 459 . 3 1 1 A 42 42 LEU CB C 42 42.300 41.300 1.000 1
1 463 . 3 1 1 A 42 42 LEU N N 42 121.000 119.220 1.780 1
1 464 . 3 1 1 A 43 43 LEU H H 43 8.290 7.758 0.532 1
1 465 . 3 1 1 A 43 43 LEU HA H 43 3.780 3.781 -0.001 1
1 475 . 3 1 1 A 43 43 LEU C C 43 179.400 179.105 0.295 1
1 476 . 3 1 1 A 43 43 LEU CA C 43 57.600 58.047 -0.447 1
1 477 . 3 1 1 A 43 43 LEU CB C 43 40.900 41.289 -0.389 1
1 481 . 3 1 1 A 43 43 LEU N N 43 119.200 118.300 0.900 1
1 482 . 3 1 1 A 44 44 GLU H H 44 8.330 8.368 -0.038 1
1 483 . 3 1 1 A 44 44 GLU HA H 44 4.050 3.985 0.065 1
1 488 . 3 1 1 A 44 44 GLU C C 44 178.600 178.537 0.063 1
1 489 . 3 1 1 A 44 44 GLU CA C 44 58.900 59.302 -0.402 1
1 490 . 3 1 1 A 44 44 GLU CB C 44 28.300 28.847 -0.547 1
1 492 . 3 1 1 A 44 44 GLU N N 44 119.600 117.266 2.334 1
1 493 . 3 1 1 A 45 45 CYS H H 45 7.690 7.965 -0.275 1
1 494 . 3 1 1 A 45 45 CYS HA H 45 4.120 4.051 0.069 1
1 497 . 3 1 1 A 45 45 CYS C C 45 176.100 176.821 -0.721 1
1 498 . 3 1 1 A 45 45 CYS CA C 45 62.500 63.071 -0.571 1
1 499 . 3 1 1 A 45 45 CYS CB C 45 26.200 26.609 -0.409 1
1 500 . 3 1 1 A 45 45 CYS N N 45 120.900 118.652 2.248 1
1 501 . 3 1 1 A 46 46 ALA H H 46 8.540 7.853 0.687 1
1 502 . 3 1 1 A 46 46 ALA HA H 46 3.900 3.977 -0.077 1
1 506 . 3 1 1 A 46 46 ALA C C 46 179.200 179.193 0.007 1
1 507 . 3 1 1 A 46 46 ALA CA C 46 55.500 55.283 0.217 1
1 508 . 3 1 1 A 46 46 ALA CB C 46 16.800 18.569 -1.769 1
1 509 . 3 1 1 A 46 46 ALA N N 46 121.500 122.028 -0.528 1
1 510 . 3 1 1 A 47 47 ASP H H 47 8.460 8.379 0.081 1
1 511 . 3 1 1 A 47 47 ASP HA H 47 4.340 4.334 0.006 1
1 514 . 3 1 1 A 47 47 ASP C C 47 178.800 178.652 0.148 1
1 515 . 3 1 1 A 47 47 ASP CA C 47 56.600 57.272 -0.672 1
1 516 . 3 1 1 A 47 47 ASP CB C 47 39.800 42.383 -2.583 1
1 517 . 3 1 1 A 47 47 ASP N N 47 119.000 118.390 0.610 1
1 518 . 3 1 1 A 48 48 LEU H H 48 8.040 7.711 0.329 1
1 519 . 3 1 1 A 48 48 LEU HA H 48 4.110 3.879 0.231 1
1 529 . 3 1 1 A 48 48 LEU C C 48 180.000 179.372 0.628 1
1 530 . 3 1 1 A 48 48 LEU CA C 48 58.000 58.013 -0.013 1
1 531 . 3 1 1 A 48 48 LEU CB C 48 41.700 41.534 0.166 1
1 535 . 3 1 1 A 48 48 LEU N N 48 123.000 119.863 3.137 1
1 536 . 3 1 1 A 49 49 LEU H H 49 8.300 7.745 0.555 1
1 537 . 3 1 1 A 49 49 LEU HA H 49 4.110 3.869 0.241 1
1 547 . 3 1 1 A 49 49 LEU C C 49 177.200 178.880 -1.680 1
1 548 . 3 1 1 A 49 49 LEU CA C 49 57.600 57.947 -0.347 1
1 549 . 3 1 1 A 49 49 LEU CB C 49 41.200 41.728 -0.528 1
1 553 . 3 1 1 A 49 49 LEU N N 49 120.900 118.618 2.282 1
1 554 . 3 1 1 A 50 50 SER H H 50 8.660 7.772 0.888 1
1 555 . 3 1 1 A 50 50 SER HA H 50 4.000 4.052 -0.052 1
1 558 . 3 1 1 A 50 50 SER C C 50 176.800 177.322 -0.522 1
1 559 . 3 1 1 A 50 50 SER CA C 50 62.500 61.672 0.828 1
1 560 . 3 1 1 A 50 50 SER CB C 50 62.600 63.034 -0.434 1
1 561 . 3 1 1 A 50 50 SER N N 50 113.300 114.393 -1.093 1
1 562 . 3 1 1 A 51 51 SER H H 51 7.980 8.437 -0.457 1
1 563 . 3 1 1 A 51 51 SER HA H 51 4.220 4.087 0.133 1
1 566 . 3 1 1 A 51 51 SER C C 51 176.300 176.316 -0.016 1
1 567 . 3 1 1 A 51 51 SER CA C 51 61.200 61.804 -0.604 1
1 568 . 3 1 1 A 51 51 SER CB C 51 62.700 62.787 -0.087 1
1 569 . 3 1 1 A 51 51 SER N N 51 115.900 116.646 -0.746 1
1 570 . 3 1 1 A 52 52 ALA H H 52 8.030 8.310 -0.280 1
1 571 . 3 1 1 A 52 52 ALA HA H 52 4.130 4.186 -0.056 1
1 575 . 3 1 1 A 52 52 ALA C C 52 178.500 179.639 -1.139 1
1 576 . 3 1 1 A 52 52 ALA CA C 52 54.500 54.904 -0.404 1
1 577 . 3 1 1 A 52 52 ALA CB C 52 18.000 18.311 -0.311 1
1 578 . 3 1 1 A 52 52 ALA N N 52 125.400 123.738 1.662 1
1 579 . 3 1 1 A 53 53 LEU H H 53 7.710 7.990 -0.280 1
1 580 . 3 1 1 A 53 53 LEU HA H 53 4.180 4.181 -0.001 1
1 590 . 3 1 1 A 53 53 LEU C C 53 177.700 178.164 -0.464 1
1 591 . 3 1 1 A 53 53 LEU CA C 53 56.500 56.557 -0.057 1
1 592 . 3 1 1 A 53 53 LEU CB C 53 42.400 41.623 0.777 1
1 596 . 3 1 1 A 53 53 LEU N N 53 113.800 118.700 -4.900 1
1 597 . 3 1 1 A 54 54 THR H H 54 7.550 7.553 -0.003 1
1 598 . 3 1 1 A 54 54 THR HA H 54 4.420 4.377 0.043 1
1 603 . 3 1 1 A 54 54 THR C C 54 174.100 173.235 0.865 1
1 604 . 3 1 1 A 54 54 THR CA C 54 61.600 62.188 -0.588 1
1 605 . 3 1 1 A 54 54 THR CB C 54 69.300 69.479 -0.179 1
1 607 . 3 1 1 A 54 54 THR N N 54 107.700 107.432 0.268 1
1 608 . 3 1 1 A 55 55 GLU H H 55 7.750 7.517 0.233 1
1 609 . 3 1 1 A 55 55 GLU HA H 55 4.760 4.907 -0.147 1
1 614 . 3 1 1 A 55 55 GLU CA C 55 53.400 53.886 -0.486 1
1 615 . 3 1 1 A 55 55 GLU CB C 55 30.100 32.303 -2.203 1
1 617 . 3 1 1 A 55 55 GLU N N 55 122.800 118.716 4.084 1
1 618 . 3 1 1 A 56 56 PRO HA H 56 4.670 4.742 -0.072 1
1 625 . 3 1 1 A 56 56 PRO C C 56 176.200 176.430 -0.230 1
1 626 . 3 1 1 A 56 56 PRO CA C 56 62.900 62.899 0.001 1
1 627 . 3 1 1 A 56 56 PRO CB C 56 29.200 31.650 -2.450 1
1 630 . 3 1 1 A 57 57 VAL H H 57 8.010 8.327 -0.317 1
1 631 . 3 1 1 A 57 57 VAL HA H 57 4.590 4.925 -0.335 1
1 639 . 3 1 1 A 57 57 VAL CA C 57 58.600 58.269 0.331 1
1 640 . 3 1 1 A 57 57 VAL CB C 57 32.800 34.682 -1.882 1
1 643 . 3 1 1 A 57 57 VAL N N 57 121.400 117.387 4.013 1
1 644 . 3 1 1 A 58 58 PRO HA H 58 4.450 4.586 -0.136 1
1 651 . 3 1 1 A 58 58 PRO C C 58 177.500 177.955 -0.455 1
1 652 . 3 1 1 A 58 58 PRO CA C 58 62.600 63.074 -0.474 1
1 653 . 3 1 1 A 58 58 PRO CB C 58 32.200 31.573 0.627 1
1 656 . 3 1 1 A 59 59 ASN H H 59 8.890 8.841 0.049 1
1 657 . 3 1 1 A 59 59 ASN HA H 59 4.330 4.368 -0.038 1
1 662 . 3 1 1 A 59 59 ASN C C 59 177.600 177.703 -0.103 1
1 663 . 3 1 1 A 59 59 ASN CA C 59 56.300 56.236 0.064 1
1 664 . 3 1 1 A 59 59 ASN CB C 59 38.400 38.245 0.155 1
1 665 . 3 1 1 A 59 59 ASN N N 59 122.200 122.162 0.038 1
1 667 . 3 1 1 A 60 60 SER H H 60 8.660 8.173 0.487 1
1 668 . 3 1 1 A 60 60 SER HA H 60 4.010 4.067 -0.057 1
1 671 . 3 1 1 A 60 60 SER C C 60 176.200 175.988 0.212 1
1 672 . 3 1 1 A 60 60 SER CA C 60 60.800 61.607 -0.807 1
1 673 . 3 1 1 A 60 60 SER CB C 60 61.500 62.842 -1.342 1
1 674 . 3 1 1 A 60 60 SER N N 60 113.200 117.319 -4.119 1
1 675 . 3 1 1 A 61 61 GLN H H 61 7.420 7.953 -0.533 1
1 676 . 3 1 1 A 61 61 GLN HA H 61 4.280 4.005 0.275 1
1 683 . 3 1 1 A 61 61 GLN C C 61 178.600 178.486 0.114 1
1 684 . 3 1 1 A 61 61 GLN CA C 61 57.900 58.849 -0.949 1
1 685 . 3 1 1 A 61 61 GLN CB C 61 28.600 28.095 0.505 1
1 687 . 3 1 1 A 61 61 GLN N N 61 122.200 121.148 1.052 1
1 689 . 3 1 1 A 62 62 LEU H H 62 7.430 7.806 -0.376 1
1 690 . 3 1 1 A 62 62 LEU HA H 62 3.850 4.011 -0.161 1
1 700 . 3 1 1 A 62 62 LEU C C 62 178.800 178.862 -0.062 1
1 701 . 3 1 1 A 62 62 LEU CA C 62 57.900 58.028 -0.128 1
1 702 . 3 1 1 A 62 62 LEU CB C 62 42.100 42.177 -0.077 1
1 706 . 3 1 1 A 62 62 LEU N N 62 120.600 120.033 0.567 1
1 707 . 3 1 1 A 63 63 VAL H H 63 8.200 7.901 0.299 1
1 708 . 3 1 1 A 63 63 VAL HA H 63 3.370 3.329 0.041 1
1 716 . 3 1 1 A 63 63 VAL C C 63 178.000 177.493 0.507 1
1 717 . 3 1 1 A 63 63 VAL CA C 63 66.600 66.834 -0.234 1
1 718 . 3 1 1 A 63 63 VAL CB C 63 31.700 30.863 0.837 1
1 721 . 3 1 1 A 63 63 VAL N N 63 118.200 117.410 0.790 1
1 722 . 3 1 1 A 64 64 ASP H H 64 7.960 8.224 -0.264 1
1 723 . 3 1 1 A 64 64 ASP HA H 64 4.460 4.302 0.158 1
1 726 . 3 1 1 A 64 64 ASP C C 64 178.100 178.399 -0.299 1
1 727 . 3 1 1 A 64 64 ASP CA C 64 57.700 57.267 0.433 1
1 728 . 3 1 1 A 64 64 ASP CB C 64 39.800 41.017 -1.217 1
1 729 . 3 1 1 A 64 64 ASP N N 64 120.200 119.912 0.288 1
1 730 . 3 1 1 A 65 65 THR H H 65 8.380 8.483 -0.103 1
1 731 . 3 1 1 A 65 65 THR HA H 65 3.970 3.992 -0.022 1
1 736 . 3 1 1 A 65 65 THR C C 65 176.500 177.295 -0.795 1
1 737 . 3 1 1 A 65 65 THR CA C 65 66.500 66.638 -0.138 1
1 738 . 3 1 1 A 65 65 THR CB C 65 67.800 68.015 -0.215 1
1 740 . 3 1 1 A 65 65 THR N N 65 118.100 115.638 2.462 1
1 741 . 3 1 1 A 66 66 GLY H H 66 8.900 8.253 0.647 1
1 742 . 3 1 1 A 66 66 GLY HA2 H 66 3.630 3.690 -0.060 1
1 743 . 3 1 1 A 66 66 GLY HA3 H 66 3.630 3.738 -0.108 1
1 744 . 3 1 1 A 66 66 GLY C C 66 174.200 176.352 -2.152 1
1 745 . 3 1 1 A 66 66 GLY CA C 66 47.500 47.082 0.418 1
1 746 . 3 1 1 A 66 66 GLY N N 66 110.500 107.343 3.157 1
1 747 . 3 1 1 A 67 67 HIS H H 67 8.650 7.473 1.177 1
1 748 . 3 1 1 A 67 67 HIS HA H 67 4.220 4.590 -0.370 1
1 752 . 3 1 1 A 67 67 HIS C C 67 176.900 177.709 -0.809 1
1 753 . 3 1 1 A 67 67 HIS CA C 67 59.000 58.106 0.894 1
1 754 . 3 1 1 A 67 67 HIS CB C 67 27.800 29.779 -1.979 1
1 756 . 3 1 1 A 67 67 HIS N N 67 120.100 120.330 -0.230 1
1 757 . 3 1 1 A 68 68 GLN H H 68 7.860 8.339 -0.479 1
1 758 . 3 1 1 A 68 68 GLN HA H 68 3.990 3.976 0.014 1
1 765 . 3 1 1 A 68 68 GLN C C 68 177.800 178.276 -0.476 1
1 766 . 3 1 1 A 68 68 GLN CA C 68 58.800 58.689 0.111 1
1 767 . 3 1 1 A 68 68 GLN CB C 68 28.200 27.912 0.288 1
1 769 . 3 1 1 A 68 68 GLN N N 68 121.400 117.065 4.335 1
1 771 . 3 1 1 A 69 69 LEU H H 69 8.300 8.292 0.008 1
1 772 . 3 1 1 A 69 69 LEU HA H 69 4.330 4.369 -0.039 1
1 782 . 3 1 1 A 69 69 LEU C C 69 179.300 179.990 -0.690 1
1 783 . 3 1 1 A 69 69 LEU CA C 69 58.200 58.365 -0.165 1
1 784 . 3 1 1 A 69 69 LEU CB C 69 40.500 40.993 -0.493 1
1 788 . 3 1 1 A 69 69 LEU N N 69 120.300 121.698 -1.398 1
1 789 . 3 1 1 A 70 70 LEU H H 70 8.460 7.999 0.461 1
1 790 . 3 1 1 A 70 70 LEU HA H 70 3.880 4.008 -0.128 1
1 800 . 3 1 1 A 70 70 LEU C C 70 179.100 179.333 -0.233 1
1 801 . 3 1 1 A 70 70 LEU CA C 70 58.300 58.114 0.186 1
1 802 . 3 1 1 A 70 70 LEU CB C 70 41.500 40.455 1.045 1
1 806 . 3 1 1 A 70 70 LEU N N 70 121.200 119.980 1.220 1
1 807 . 3 1 1 A 71 71 ASP H H 71 8.140 7.746 0.394 1
1 808 . 3 1 1 A 71 71 ASP HA H 71 4.420 4.306 0.114 1
1 811 . 3 1 1 A 71 71 ASP C C 71 180.000 178.253 1.747 1
1 812 . 3 1 1 A 71 71 ASP CA C 71 57.300 57.209 0.091 1
1 813 . 3 1 1 A 71 71 ASP CB C 71 39.300 40.953 -1.653 1
1 814 . 3 1 1 A 71 71 ASP N N 71 121.100 119.671 1.429 1
1 815 . 3 1 1 A 72 72 TYR H H 72 8.320 8.170 0.150 1
1 816 . 3 1 1 A 72 72 TYR HA H 72 4.550 4.471 0.079 1
1 823 . 3 1 1 A 72 72 TYR C C 72 179.100 178.585 0.515 1
1 824 . 3 1 1 A 72 72 TYR CA C 72 60.500 61.006 -0.506 1
1 825 . 3 1 1 A 72 72 TYR CB C 72 37.600 38.167 -0.567 1
1 828 . 3 1 1 A 72 72 TYR N N 72 120.300 118.260 2.040 1
1 829 . 3 1 1 A 73 73 CYS H H 73 8.850 8.565 0.285 1
1 830 . 3 1 1 A 73 73 CYS HA H 73 4.380 4.569 -0.189 1
1 834 . 3 1 1 A 73 73 CYS C C 73 177.300 177.357 -0.057 1
1 835 . 3 1 1 A 73 73 CYS CA C 73 64.400 63.818 0.582 1
1 836 . 3 1 1 A 73 73 CYS CB C 73 27.600 26.727 0.873 1
1 837 . 3 1 1 A 73 73 CYS N N 73 116.800 118.574 -1.774 1
1 838 . 3 1 1 A 74 74 SER H H 74 8.410 8.393 0.017 1
1 839 . 3 1 1 A 74 74 SER HA H 74 4.290 4.299 -0.009 1
1 842 . 3 1 1 A 74 74 SER C C 74 176.300 177.143 -0.843 1
1 843 . 3 1 1 A 74 74 SER CA C 74 61.400 61.179 0.221 1
1 844 . 3 1 1 A 74 74 SER CB C 74 62.600 62.912 -0.312 1
1 845 . 3 1 1 A 74 74 SER N N 74 115.900 116.058 -0.158 1
1 846 . 3 1 1 A 75 75 GLY H H 75 7.790 8.348 -0.558 1
1 847 . 3 1 1 A 75 75 GLY HA2 H 75 4.320 3.766 0.554 1
1 848 . 3 1 1 A 75 75 GLY HA3 H 75 3.900 3.786 0.114 1
1 849 . 3 1 1 A 75 75 GLY C C 75 174.600 175.417 -0.817 1
1 850 . 3 1 1 A 75 75 GLY CA C 75 45.600 47.294 -1.694 1
1 851 . 3 1 1 A 75 75 GLY N N 75 107.500 107.614 -0.114 1
1 852 . 3 1 1 A 76 76 TYR H H 76 8.040 8.281 -0.241 1
1 853 . 3 1 1 A 76 76 TYR HA H 76 4.310 4.045 0.265 1
1 860 . 3 1 1 A 76 76 TYR C C 76 176.200 177.561 -1.361 1
1 861 . 3 1 1 A 76 76 TYR CA C 76 60.000 61.044 -1.044 1
1 862 . 3 1 1 A 76 76 TYR CB C 76 40.700 38.477 2.223 1
1 865 . 3 1 1 A 76 76 TYR N N 76 121.900 123.111 -1.211 1
1 866 . 3 1 1 A 77 77 VAL H H 77 7.540 8.551 -1.011 1
1 867 . 3 1 1 A 77 77 VAL HA H 77 3.450 3.419 0.031 1
1 875 . 3 1 1 A 77 77 VAL C C 77 175.500 177.202 -1.702 1
1 876 . 3 1 1 A 77 77 VAL CA C 77 65.500 64.809 0.691 1
1 877 . 3 1 1 A 77 77 VAL CB C 77 31.600 31.330 0.270 1
1 880 . 3 1 1 A 77 77 VAL N N 77 116.600 119.475 -2.875 1
1 881 . 3 1 1 A 78 78 ASP H H 78 7.580 8.287 -0.707 1
1 882 . 3 1 1 A 78 78 ASP HA H 78 4.380 4.517 -0.137 1
1 885 . 3 1 1 A 78 78 ASP C C 78 177.000 177.065 -0.065 1
1 886 . 3 1 1 A 78 78 ASP CA C 78 55.800 55.778 0.022 1
1 887 . 3 1 1 A 78 78 ASP CB C 78 39.900 40.311 -0.411 1
1 888 . 3 1 1 A 78 78 ASP N N 78 116.400 120.755 -4.355 1
1 889 . 3 1 1 A 79 79 CYS H H 79 8.040 7.749 0.291 1
1 890 . 3 1 1 A 79 79 CYS HA H 79 4.110 4.542 -0.432 1
1 893 . 3 1 1 A 79 79 CYS C C 79 174.200 174.035 0.165 1
1 894 . 3 1 1 A 79 79 CYS CA C 79 58.600 58.031 0.569 1
1 895 . 3 1 1 A 79 79 CYS CB C 79 27.200 27.606 -0.406 1
1 896 . 3 1 1 A 79 79 CYS N N 79 117.000 116.188 0.812 1
1 897 . 3 1 1 A 80 80 ILE H H 80 6.960 7.228 -0.268 1
1 898 . 3 1 1 A 80 80 ILE HA H 80 4.120 4.141 -0.021 1
1 908 . 3 1 1 A 80 80 ILE CA C 80 58.700 58.332 0.368 1
1 909 . 3 1 1 A 80 80 ILE CB C 80 38.500 37.430 1.070 1
1 913 . 3 1 1 A 80 80 ILE N N 80 123.200 122.694 0.506 1
1 914 . 3 1 1 A 81 81 PRO HA H 81 4.340 4.437 -0.097 1
1 921 . 3 1 1 A 81 81 PRO C C 81 178.000 176.368 1.632 1
1 922 . 3 1 1 A 81 81 PRO CA C 81 64.700 64.705 -0.005 1
1 923 . 3 1 1 A 81 81 PRO CB C 81 32.600 32.068 0.532 1
1 926 . 3 1 1 A 82 82 GLN H H 82 7.560 8.360 -0.800 1
1 927 . 3 1 1 A 82 82 GLN HA H 82 4.600 4.572 0.028 1
1 934 . 3 1 1 A 82 82 GLN C C 82 177.400 175.832 1.568 1
1 935 . 3 1 1 A 82 82 GLN CA C 82 55.600 54.515 1.085 1
1 936 . 3 1 1 A 82 82 GLN CB C 82 28.800 27.322 1.478 1
1 938 . 3 1 1 A 82 82 GLN N N 82 115.900 117.554 -1.654 1
1 940 . 3 1 1 A 83 83 THR H H 83 8.880 7.767 1.113 1
1 941 . 3 1 1 A 83 83 THR HA H 83 3.750 3.898 -0.148 1
1 946 . 3 1 1 A 83 83 THR C C 83 176.300 176.364 -0.064 1
1 947 . 3 1 1 A 83 83 THR CA C 83 66.500 66.188 0.312 1
1 948 . 3 1 1 A 83 83 THR CB C 83 68.700 68.778 -0.078 1
1 950 . 3 1 1 A 83 83 THR N N 83 122.700 119.331 3.369 1
1 951 . 3 1 1 A 84 84 ARG H H 84 8.990 8.107 0.883 1
1 952 . 3 1 1 A 84 84 ARG HA H 84 4.250 4.024 0.226 1
1 960 . 3 1 1 A 84 84 ARG C C 84 178.900 178.728 0.172 1
1 961 . 3 1 1 A 84 84 ARG CA C 84 59.100 59.657 -0.557 1
1 962 . 3 1 1 A 84 84 ARG CB C 84 29.300 29.960 -0.660 1
1 965 . 3 1 1 A 84 84 ARG N N 84 120.100 121.675 -1.575 1
1 967 . 3 1 1 A 85 85 ASN H H 85 7.270 8.053 -0.783 1
1 968 . 3 1 1 A 85 85 ASN HA H 85 4.810 4.641 0.169 1
1 973 . 3 1 1 A 85 85 ASN C C 85 176.800 177.734 -0.934 1
1 974 . 3 1 1 A 85 85 ASN CA C 85 54.800 56.257 -1.457 1
1 975 . 3 1 1 A 85 85 ASN CB C 85 37.600 38.219 -0.619 1
1 976 . 3 1 1 A 85 85 ASN N N 85 117.400 118.410 -1.010 1
1 978 . 3 1 1 A 86 86 LYS H H 86 8.340 8.368 -0.028 1
1 979 . 3 1 1 A 86 86 LYS HA H 86 3.890 4.133 -0.243 1
1 988 . 3 1 1 A 86 86 LYS C C 86 178.600 178.839 -0.239 1
1 989 . 3 1 1 A 86 86 LYS CA C 86 60.800 58.998 1.802 1
1 990 . 3 1 1 A 86 86 LYS CB C 86 32.700 32.144 0.556 1
1 994 . 3 1 1 A 86 86 LYS N N 86 124.200 120.800 3.400 1
1 995 . 3 1 1 A 87 87 PHE H H 87 8.120 8.705 -0.585 1
1 996 . 3 1 1 A 87 87 PHE HA H 87 4.260 4.248 0.012 1
1 1004 . 3 1 1 A 87 87 PHE C C 87 178.100 177.190 0.910 1
1 1005 . 3 1 1 A 87 87 PHE CA C 87 61.300 61.591 -0.291 1
1 1006 . 3 1 1 A 87 87 PHE CB C 87 38.200 39.167 -0.967 1
1 1010 . 3 1 1 A 87 87 PHE N N 87 118.300 121.174 -2.874 1
1 1011 . 3 1 1 A 88 88 ALA H H 88 7.860 8.042 -0.182 1
1 1012 . 3 1 1 A 88 88 ALA HA H 88 4.200 3.979 0.221 1
1 1016 . 3 1 1 A 88 88 ALA C C 88 180.600 179.731 0.869 1
1 1017 . 3 1 1 A 88 88 ALA CA C 88 54.900 55.151 -0.251 1
1 1018 . 3 1 1 A 88 88 ALA CB C 88 18.100 17.714 0.386 1
1 1019 . 3 1 1 A 88 88 ALA N N 88 121.700 120.741 0.959 1
1 1020 . 3 1 1 A 89 89 PHE H H 89 8.690 8.374 0.316 1
1 1021 . 3 1 1 A 89 89 PHE HA H 89 4.080 4.132 -0.052 1
1 1029 . 3 1 1 A 89 89 PHE C C 89 176.300 177.581 -1.281 1
1 1030 . 3 1 1 A 89 89 PHE CA C 89 62.000 61.571 0.429 1
1 1031 . 3 1 1 A 89 89 PHE CB C 89 39.800 39.340 0.460 1
1 1035 . 3 1 1 A 89 89 PHE N N 89 120.100 119.993 0.107 1
1 1036 . 3 1 1 A 90 90 ARG H H 90 8.560 8.610 -0.050 1
1 1037 . 3 1 1 A 90 90 ARG HA H 90 3.790 3.941 -0.151 1
1 1045 . 3 1 1 A 90 90 ARG C C 90 179.600 178.654 0.946 1
1 1046 . 3 1 1 A 90 90 ARG CA C 90 60.000 59.767 0.233 1
1 1047 . 3 1 1 A 90 90 ARG CB C 90 30.000 29.994 0.006 1
1 1050 . 3 1 1 A 90 90 ARG N N 90 118.000 118.691 -0.691 1
1 1052 . 3 1 1 A 91 91 GLU H H 91 8.120 8.324 -0.204 1
1 1053 . 3 1 1 A 91 91 GLU HA H 91 3.980 3.902 0.078 1
1 1058 . 3 1 1 A 91 91 GLU C C 91 178.400 178.931 -0.531 1
1 1059 . 3 1 1 A 91 91 GLU CA C 91 58.900 59.191 -0.291 1
1 1060 . 3 1 1 A 91 91 GLU CB C 91 28.800 29.091 -0.291 1
1 1062 . 3 1 1 A 91 91 GLU N N 91 119.300 117.857 1.443 1
1 1063 . 3 1 1 A 92 92 ALA H H 92 7.820 7.622 0.198 1
1 1064 . 3 1 1 A 92 92 ALA HA H 92 4.050 3.953 0.097 1
1 1068 . 3 1 1 A 92 92 ALA C C 92 179.800 179.727 0.073 1
1 1069 . 3 1 1 A 92 92 ALA CA C 92 55.000 55.006 -0.006 1
1 1070 . 3 1 1 A 92 92 ALA CB C 92 18.000 18.404 -0.404 1
1 1071 . 3 1 1 A 92 92 ALA N N 92 123.400 122.258 1.142 1
1 1072 . 3 1 1 A 93 93 VAL H H 93 8.430 7.970 0.460 1
1 1073 . 3 1 1 A 93 93 VAL HA H 93 3.250 3.317 -0.067 1
1 1081 . 3 1 1 A 93 93 VAL C C 93 177.900 178.273 -0.373 1
1 1082 . 3 1 1 A 93 93 VAL CA C 93 66.800 66.656 0.144 1
1 1083 . 3 1 1 A 93 93 VAL CB C 93 31.300 31.215 0.085 1
1 1086 . 3 1 1 A 93 93 VAL N N 93 119.900 118.143 1.757 1
1 1087 . 3 1 1 A 94 94 SER H H 94 7.990 8.404 -0.414 1
1 1088 . 3 1 1 A 94 94 SER HA H 94 4.230 4.067 0.163 1
1 1091 . 3 1 1 A 94 94 SER C C 94 177.200 176.103 1.097 1
1 1092 . 3 1 1 A 94 94 SER CA C 94 61.600 62.289 -0.689 1
1 1093 . 3 1 1 A 94 94 SER CB C 94 62.700 62.737 -0.037 1
1 1094 . 3 1 1 A 94 94 SER N N 94 116.000 116.332 -0.332 1
1 1095 . 3 1 1 A 95 95 LYS H H 95 7.710 7.392 0.318 1
1 1096 . 3 1 1 A 95 95 LYS HA H 95 4.020 4.137 -0.117 1
1 1105 . 3 1 1 A 95 95 LYS C C 95 179.400 178.878 0.522 1
1 1106 . 3 1 1 A 95 95 LYS CA C 95 59.600 59.051 0.549 1
1 1107 . 3 1 1 A 95 95 LYS CB C 95 32.300 32.470 -0.170 1
1 1111 . 3 1 1 A 95 95 LYS N N 95 121.400 121.684 -0.284 1
1 1112 . 3 1 1 A 96 96 LEU H H 96 8.270 7.973 0.297 1
1 1113 . 3 1 1 A 96 96 LEU HA H 96 4.040 3.960 0.080 1
1 1123 . 3 1 1 A 96 96 LEU C C 96 177.700 178.273 -0.573 1
1 1124 . 3 1 1 A 96 96 LEU CA C 96 58.600 58.219 0.381 1
1 1125 . 3 1 1 A 96 96 LEU CB C 96 41.000 41.446 -0.446 1
1 1129 . 3 1 1 A 96 96 LEU N N 96 124.800 121.290 3.510 1
1 1130 . 3 1 1 A 97 97 GLU H H 97 8.500 8.397 0.103 1
1 1131 . 3 1 1 A 97 97 GLU HA H 97 3.760 4.114 -0.354 1
1 1136 . 3 1 1 A 97 97 GLU C C 97 179.100 179.514 -0.414 1
1 1137 . 3 1 1 A 97 97 GLU CA C 97 59.900 59.038 0.862 1
1 1138 . 3 1 1 A 97 97 GLU CB C 97 28.700 29.434 -0.734 1
1 1140 . 3 1 1 A 97 97 GLU N N 97 119.000 117.246 1.754 1
1 1141 . 3 1 1 A 98 98 LEU H H 98 7.740 8.217 -0.477 1
1 1142 . 3 1 1 A 98 98 LEU HA H 98 4.110 4.015 0.095 1
1 1152 . 3 1 1 A 98 98 LEU C C 98 179.700 178.829 0.871 1
1 1153 . 3 1 1 A 98 98 LEU CA C 98 57.900 57.764 0.136 1
1 1154 . 3 1 1 A 98 98 LEU CB C 98 41.800 41.506 0.294 1
1 1158 . 3 1 1 A 98 98 LEU N N 98 119.200 121.419 -2.219 1
1 1159 . 3 1 1 A 99 99 SER H H 99 8.290 8.036 0.254 1
1 1160 . 3 1 1 A 99 99 SER HA H 99 4.220 4.051 0.169 1
1 1163 . 3 1 1 A 99 99 SER C C 99 176.600 176.332 0.268 1
1 1164 . 3 1 1 A 99 99 SER CA C 99 62.400 62.389 0.011 1
1 1165 . 3 1 1 A 99 99 SER CB C 99 63.200 63.053 0.147 1
1 1166 . 3 1 1 A 99 99 SER N N 99 116.300 114.014 2.286 1
1 1167 . 3 1 1 A 100 100 LEU H H 100 8.490 8.482 0.008 1
1 1168 . 3 1 1 A 100 100 LEU HA H 100 3.960 3.968 -0.008 1
1 1178 . 3 1 1 A 100 100 LEU C C 100 179.300 179.767 -0.467 1
1 1179 . 3 1 1 A 100 100 LEU CA C 100 57.700 57.947 -0.247 1
1 1180 . 3 1 1 A 100 100 LEU CB C 100 41.300 41.227 0.073 1
1 1184 . 3 1 1 A 100 100 LEU N N 100 120.900 121.181 -0.281 1
1 1185 . 3 1 1 A 101 101 GLN H H 101 7.680 8.367 -0.687 1
1 1186 . 3 1 1 A 101 101 GLN HA H 101 4.100 4.032 0.068 1
1 1193 . 3 1 1 A 101 101 GLN C C 101 178.700 177.744 0.956 1
1 1194 . 3 1 1 A 101 101 GLN CA C 101 58.800 58.778 0.022 1
1 1195 . 3 1 1 A 101 101 GLN CB C 101 27.900 27.848 0.052 1
1 1197 . 3 1 1 A 101 101 GLN N N 101 119.100 118.122 0.978 1
1 1199 . 3 1 1 A 102 102 GLU H H 102 7.850 8.155 -0.305 1
1 1200 . 3 1 1 A 102 102 GLU HA H 102 4.050 4.121 -0.071 1
1 1205 . 3 1 1 A 102 102 GLU C C 102 179.100 179.038 0.062 1
1 1206 . 3 1 1 A 102 102 GLU CA C 102 58.400 59.167 -0.767 1
1 1207 . 3 1 1 A 102 102 GLU CB C 102 28.600 29.227 -0.627 1
1 1209 . 3 1 1 A 102 102 GLU N N 102 118.400 118.901 -0.501 1
1 1210 . 3 1 1 A 103 103 LEU H H 103 8.080 8.148 -0.068 1
1 1211 . 3 1 1 A 103 103 LEU HA H 103 4.020 4.030 -0.010 1
1 1221 . 3 1 1 A 103 103 LEU C C 103 178.200 178.289 -0.089 1
1 1222 . 3 1 1 A 103 103 LEU CA C 103 57.000 58.004 -1.004 1
1 1223 . 3 1 1 A 103 103 LEU CB C 103 41.900 41.798 0.102 1
1 1227 . 3 1 1 A 103 103 LEU N N 103 120.600 123.300 -2.700 1
1 1228 . 3 1 1 A 104 104 GLN H H 104 7.900 8.472 -0.572 1
1 1229 . 3 1 1 A 104 104 GLN HA H 104 4.090 4.140 -0.050 1
1 1236 . 3 1 1 A 104 104 GLN C C 104 177.300 176.527 0.773 1
1 1237 . 3 1 1 A 104 104 GLN CA C 104 58.100 58.202 -0.102 1
1 1238 . 3 1 1 A 104 104 GLN CB C 104 29.400 27.880 1.520 1
1 1240 . 3 1 1 A 104 104 GLN N N 104 117.700 116.516 1.184 1
1 1242 . 3 1 1 A 105 105 VAL H H 105 7.620 7.279 0.341 1
1 1243 . 3 1 1 A 105 105 VAL HA H 105 4.190 4.396 -0.206 1
1 1251 . 3 1 1 A 105 105 VAL C C 105 176.800 176.598 0.202 1
1 1252 . 3 1 1 A 105 105 VAL CA C 105 62.600 61.781 0.819 1
1 1253 . 3 1 1 A 105 105 VAL CB C 105 32.000 32.610 -0.610 1
1 1256 . 3 1 1 A 105 105 VAL N N 105 114.900 115.315 -0.415 1
1 1257 . 3 1 1 A 106 106 SER H H 106 7.900 7.814 0.086 1
1 1258 . 3 1 1 A 106 106 SER HA H 106 4.460 4.828 -0.368 1
1 1261 . 3 1 1 A 106 106 SER C C 106 175.000 174.866 0.134 1
1 1262 . 3 1 1 A 106 106 SER CA C 106 58.900 57.895 1.005 1
1 1263 . 3 1 1 A 106 106 SER CB C 106 63.900 64.826 -0.926 1
1 1264 . 3 1 1 A 106 106 SER N N 106 116.900 117.633 -0.733 1
1 1265 . 3 1 1 A 107 107 SER H H 107 8.230 7.844 0.386 1
1 1266 . 3 1 1 A 107 107 SER HA H 107 4.390 4.150 0.240 1
1 1269 . 3 1 1 A 107 107 SER C C 107 174.600 175.386 -0.786 1
1 1270 . 3 1 1 A 107 107 SER CA C 107 58.400 60.980 -2.580 1
1 1271 . 3 1 1 A 107 107 SER CB C 107 63.600 63.201 0.399 1
1 1272 . 3 1 1 A 107 107 SER N N 107 117.500 117.455 0.045 1
1 1273 . 3 1 1 A 108 108 ALA H H 108 8.080 7.713 0.367 1
1 1274 . 3 1 1 A 108 108 ALA HA H 108 4.280 3.868 0.412 1
1 1278 . 3 1 1 A 108 108 ALA C C 108 177.500 178.489 -0.989 1
1 1279 . 3 1 1 A 108 108 ALA CA C 108 52.700 54.976 -2.276 1
1 1280 . 3 1 1 A 108 108 ALA CB C 108 19.200 17.806 1.394 1
1 1281 . 3 1 1 A 108 108 ALA N N 108 124.900 120.122 4.778 1
1 1282 . 3 1 1 A 109 109 ALA H H 109 8.080 8.464 -0.384 1
1 1283 . 3 1 1 A 109 109 ALA HA H 109 4.280 4.123 0.157 1
1 1287 . 3 1 1 A 109 109 ALA C C 109 177.700 178.125 -0.425 1
1 1288 . 3 1 1 A 109 109 ALA CA C 109 52.400 53.708 -1.308 1
1 1289 . 3 1 1 A 109 109 ALA CB C 109 19.400 19.414 -0.014 1
1 1290 . 3 1 1 A 109 109 ALA N N 109 123.000 120.288 2.712 1
1 1291 . 3 1 1 A 110 110 ALA H H 110 8.300 8.026 0.274 1
1 1292 . 3 1 1 A 110 110 ALA HA H 110 4.280 3.929 0.351 1
1 1296 . 3 1 1 A 110 110 ALA C C 110 178.200 177.524 0.676 1
1 1297 . 3 1 1 A 110 110 ALA CA C 110 52.700 55.102 -2.402 1
1 1298 . 3 1 1 A 110 110 ALA CB C 110 19.200 17.497 1.703 1
1 1299 . 3 1 1 A 110 110 ALA N N 110 123.200 119.149 4.051 1
1 1300 . 3 1 1 A 111 111 GLY H H 111 8.300 8.395 -0.095 1
1 1301 . 3 1 1 A 111 111 GLY HA2 H 111 3.930 4.032 -0.102 1
1 1302 . 3 1 1 A 111 111 GLY HA3 H 111 3.940 4.033 -0.093 1
1 1303 . 3 1 1 A 111 111 GLY C C 111 173.700 172.576 1.124 1
1 1304 . 3 1 1 A 111 111 GLY CA C 111 45.100 45.944 -0.844 1
1 1305 . 3 1 1 A 111 111 GLY N N 111 108.000 104.123 3.877 1
1 1306 . 3 1 1 A 112 112 VAL H H 112 7.930 7.855 0.075 1
1 1307 . 3 1 1 A 112 112 VAL HA H 112 4.420 4.557 -0.137 1
1 1315 . 3 1 1 A 112 112 VAL CA C 112 60.000 58.877 1.123 1
1 1316 . 3 1 1 A 112 112 VAL CB C 112 32.200 35.498 -3.298 1
1 1319 . 3 1 1 A 112 112 VAL N N 112 120.400 121.352 -0.952 1
1 1320 . 3 1 1 A 113 113 PRO HA H 113 4.370 4.673 -0.303 1
1 1327 . 3 1 1 A 113 113 PRO C C 113 177.300 178.024 -0.724 1
1 1328 . 3 1 1 A 113 113 PRO CA C 113 63.900 62.841 1.059 1
1 1329 . 3 1 1 A 113 113 PRO CB C 113 31.800 32.522 -0.722 1
1 1332 . 3 1 1 A 114 114 GLY H H 114 8.570 8.726 -0.156 1
1 1333 . 3 1 1 A 114 114 GLY HA2 H 114 3.880 3.903 -0.023 1
1 1334 . 3 1 1 A 114 114 GLY HA3 H 114 4.120 3.905 0.215 1
1 1335 . 3 1 1 A 114 114 GLY C C 114 174.900 175.239 -0.339 1
1 1336 . 3 1 1 A 114 114 GLY CA C 114 45.200 45.482 -0.282 1
1 1337 . 3 1 1 A 114 114 GLY N N 114 109.000 111.417 -2.417 1
1 1338 . 3 1 1 A 115 115 THR H H 115 7.900 7.975 -0.075 1
1 1339 . 3 1 1 A 115 115 THR HA H 115 4.400 3.916 0.484 1
1 1344 . 3 1 1 A 115 115 THR C C 115 174.300 173.671 0.629 1
1 1345 . 3 1 1 A 115 115 THR CA C 115 61.700 65.296 -3.596 1
1 1346 . 3 1 1 A 115 115 THR CB C 115 69.700 69.268 0.432 1
1 1348 . 3 1 1 A 115 115 THR N N 115 111.400 116.310 -4.910 1
1 1349 . 3 1 1 A 116 116 ASN H H 116 8.450 8.167 0.283 1
1 1350 . 3 1 1 A 116 116 ASN HA H 116 4.970 5.124 -0.154 1
1 1355 . 3 1 1 A 116 116 ASN CA C 116 51.500 49.444 2.056 1
1 1356 . 3 1 1 A 116 116 ASN CB C 116 38.900 39.767 -0.867 1
1 1357 . 3 1 1 A 116 116 ASN N N 116 123.100 116.783 6.317 1
1 1359 . 3 1 1 A 117 117 PRO HA H 117 4.370 4.322 0.048 1
1 1366 . 3 1 1 A 117 117 PRO C C 117 178.400 178.170 0.230 1
1 1367 . 3 1 1 A 117 117 PRO CA C 117 64.800 64.823 -0.023 1
1 1368 . 3 1 1 A 117 117 PRO CB C 117 32.100 31.966 0.134 1
1 1371 . 3 1 1 A 118 118 VAL H H 118 7.750 7.572 0.178 1
1 1372 . 3 1 1 A 118 118 VAL HA H 118 3.810 3.749 0.061 1
1 1380 . 3 1 1 A 118 118 VAL C C 118 178.300 178.219 0.081 1
1 1381 . 3 1 1 A 118 118 VAL CA C 118 65.200 65.612 -0.412 1
1 1382 . 3 1 1 A 118 118 VAL CB C 118 31.500 31.500 0.000 1
1 1385 . 3 1 1 A 118 118 VAL N N 118 118.300 116.284 2.016 1
1 1386 . 3 1 1 A 119 119 LEU H H 119 7.540 8.152 -0.612 1
1 1387 . 3 1 1 A 119 119 LEU HA H 119 4.030 3.930 0.100 1
1 1397 . 3 1 1 A 119 119 LEU C C 119 178.900 179.420 -0.520 1
1 1398 . 3 1 1 A 119 119 LEU CA C 119 57.800 58.186 -0.386 1
1 1399 . 3 1 1 A 119 119 LEU CB C 119 40.700 40.690 0.010 1
1 1403 . 3 1 1 A 119 119 LEU N N 119 119.700 119.926 -0.226 1
1 1404 . 3 1 1 A 120 120 ASN H H 120 8.080 8.392 -0.312 1
1 1405 . 3 1 1 A 120 120 ASN HA H 120 4.420 4.511 -0.091 1
1 1410 . 3 1 1 A 120 120 ASN C C 120 178.100 178.557 -0.457 1
1 1411 . 3 1 1 A 120 120 ASN CA C 120 56.100 56.591 -0.491 1
1 1412 . 3 1 1 A 120 120 ASN CB C 120 37.800 37.678 0.122 1
1 1413 . 3 1 1 A 120 120 ASN N N 120 117.700 118.700 -1.000 1
1 1415 . 3 1 1 A 121 121 ASN H H 121 8.120 8.001 0.119 1
1 1416 . 3 1 1 A 121 121 ASN HA H 121 4.490 4.503 -0.013 1
1 1421 . 3 1 1 A 121 121 ASN C C 121 178.000 178.120 -0.120 1
1 1422 . 3 1 1 A 121 121 ASN CA C 121 56.100 56.483 -0.383 1
1 1423 . 3 1 1 A 121 121 ASN CB C 121 37.800 38.641 -0.841 1
1 1424 . 3 1 1 A 121 121 ASN N N 121 120.000 118.237 1.763 1
1 1426 . 3 1 1 A 122 122 LEU H H 122 8.180 8.257 -0.077 1
1 1427 . 3 1 1 A 122 122 LEU HA H 122 4.050 3.881 0.169 1
1 1437 . 3 1 1 A 122 122 LEU C C 122 173.800 178.884 -5.084 1
1 1438 . 3 1 1 A 122 122 LEU CA C 122 58.500 57.859 0.641 1
1 1439 . 3 1 1 A 122 122 LEU CB C 122 41.900 42.103 -0.203 1
1 1443 . 3 1 1 A 122 122 LEU N N 122 122.600 120.727 1.873 1
1 1444 . 3 1 1 A 123 123 LEU H H 123 8.260 8.066 0.194 1
1 1445 . 3 1 1 A 123 123 LEU HA H 123 3.850 3.982 -0.132 1
1 1455 . 3 1 1 A 123 123 LEU C C 123 178.900 178.411 0.489 1
1 1456 . 3 1 1 A 123 123 LEU CA C 123 58.500 58.154 0.346 1
1 1457 . 3 1 1 A 123 123 LEU CB C 123 41.200 41.471 -0.271 1
1 1461 . 3 1 1 A 123 123 LEU N N 123 119.700 120.332 -0.632 1
1 1462 . 3 1 1 A 124 124 SER H H 124 7.950 7.968 -0.018 1
1 1463 . 3 1 1 A 124 124 SER HA H 124 4.240 4.069 0.171 1
1 1466 . 3 1 1 A 124 124 SER C C 124 177.500 177.214 0.286 1
1 1467 . 3 1 1 A 124 124 SER CA C 124 61.600 61.801 -0.201 1
1 1468 . 3 1 1 A 124 124 SER CB C 124 62.600 62.771 -0.171 1
1 1469 . 3 1 1 A 124 124 SER N N 124 113.400 113.903 -0.503 1
1 1470 . 3 1 1 A 125 125 CYS H H 125 8.040 8.609 -0.569 1
1 1471 . 3 1 1 A 125 125 CYS HA H 125 4.350 4.104 0.246 1
1 1474 . 3 1 1 A 125 125 CYS C C 125 176.800 176.954 -0.154 1
1 1475 . 3 1 1 A 125 125 CYS CA C 125 62.600 63.824 -1.224 1
1 1476 . 3 1 1 A 125 125 CYS CB C 125 27.100 26.827 0.273 1
1 1477 . 3 1 1 A 125 125 CYS N N 125 119.800 119.618 0.182 1
1 1478 . 3 1 1 A 126 126 VAL H H 126 8.290 8.426 -0.136 1
1 1479 . 3 1 1 A 126 126 VAL HA H 126 3.430 3.406 0.024 1
1 1487 . 3 1 1 A 126 126 VAL C C 126 177.800 177.783 0.017 1
1 1488 . 3 1 1 A 126 126 VAL CA C 126 67.100 66.831 0.269 1
1 1489 . 3 1 1 A 126 126 VAL CB C 126 31.400 31.417 -0.017 1
1 1492 . 3 1 1 A 126 126 VAL N N 126 121.900 120.470 1.430 1
1 1493 . 3 1 1 A 127 127 GLN H H 127 8.200 7.876 0.324 1
1 1494 . 3 1 1 A 127 127 GLN HA H 127 3.970 4.061 -0.091 1
1 1501 . 3 1 1 A 127 127 GLN C C 127 178.200 178.532 -0.332 1
1 1502 . 3 1 1 A 127 127 GLN CA C 127 58.700 58.909 -0.209 1
1 1503 . 3 1 1 A 127 127 GLN CB C 127 27.800 28.185 -0.385 1
1 1505 . 3 1 1 A 127 127 GLN N N 127 119.700 117.891 1.809 1
1 1507 . 3 1 1 A 128 128 GLU H H 128 7.880 8.098 -0.218 1
1 1508 . 3 1 1 A 128 128 GLU HA H 128 4.200 4.073 0.127 1
1 1513 . 3 1 1 A 128 128 GLU C C 128 178.400 178.613 -0.213 1
1 1514 . 3 1 1 A 128 128 GLU CA C 128 59.000 58.953 0.047 1
1 1515 . 3 1 1 A 128 128 GLU CB C 128 28.400 29.394 -0.994 1
1 1517 . 3 1 1 A 128 128 GLU N N 128 119.800 119.151 0.649 1
1 1518 . 3 1 1 A 129 129 ILE H H 129 8.000 8.397 -0.397 1
1 1519 . 3 1 1 A 129 129 ILE HA H 129 3.460 3.463 -0.003 1
1 1529 . 3 1 1 A 129 129 ILE C C 129 176.800 178.067 -1.267 1
1 1530 . 3 1 1 A 129 129 ILE CA C 129 66.100 65.312 0.788 1
1 1531 . 3 1 1 A 129 129 ILE CB C 129 38.200 37.562 0.638 1
1 1535 . 3 1 1 A 129 129 ILE N N 129 119.500 120.249 -0.749 1
1 1536 . 3 1 1 A 130 130 SER H H 130 8.040 8.214 -0.174 1
1 1537 . 3 1 1 A 130 130 SER HA H 130 3.780 4.122 -0.342 1
1 1540 . 3 1 1 A 130 130 SER C C 130 176.200 176.339 -0.139 1
1 1541 . 3 1 1 A 130 130 SER CA C 130 62.100 61.346 0.754 1
1 1542 . 3 1 1 A 130 130 SER CB C 130 62.600 62.265 0.335 1
1 1543 . 3 1 1 A 130 130 SER N N 130 112.800 114.718 -1.918 1
1 1544 . 3 1 1 A 131 131 ASP H H 131 8.270 7.928 0.342 1
1 1545 . 3 1 1 A 131 131 ASP HA H 131 4.310 4.403 -0.093 1
1 1548 . 3 1 1 A 131 131 ASP C C 131 179.200 178.608 0.592 1
1 1549 . 3 1 1 A 131 131 ASP CA C 131 56.800 57.571 -0.771 1
1 1550 . 3 1 1 A 131 131 ASP CB C 131 40.900 41.199 -0.299 1
1 1551 . 3 1 1 A 131 131 ASP N N 131 119.600 121.573 -1.973 1
1 1552 . 3 1 1 A 132 132 VAL H H 132 8.470 8.313 0.157 1
1 1553 . 3 1 1 A 132 132 VAL HA H 132 3.520 3.710 -0.190 1
1 1561 . 3 1 1 A 132 132 VAL C C 132 178.700 178.517 0.183 1
1 1562 . 3 1 1 A 132 132 VAL CA C 132 66.500 66.481 0.019 1
1 1563 . 3 1 1 A 132 132 VAL CB C 132 31.500 31.695 -0.195 1
1 1566 . 3 1 1 A 132 132 VAL N N 132 118.100 119.645 -1.545 1
1 1567 . 3 1 1 A 133 133 VAL H H 133 8.140 7.856 0.284 1
1 1568 . 3 1 1 A 133 133 VAL HA H 133 3.770 3.851 -0.081 1
1 1576 . 3 1 1 A 133 133 VAL C C 133 176.500 176.141 0.359 1
1 1577 . 3 1 1 A 133 133 VAL CA C 133 65.100 66.211 -1.111 1
1 1578 . 3 1 1 A 133 133 VAL CB C 133 31.600 31.552 0.048 1
1 1581 . 3 1 1 A 133 133 VAL N N 133 117.000 120.323 -3.323 1
1 1582 . 3 1 1 A 134 134 GLN H H 134 7.490 7.778 -0.288 1
1 1583 . 3 1 1 A 134 134 GLN HA H 134 4.350 4.450 -0.100 1
1 1590 . 3 1 1 A 134 134 GLN C C 134 175.400 176.099 -0.699 1
1 1591 . 3 1 1 A 134 134 GLN CA C 134 56.700 55.372 1.328 1
1 1592 . 3 1 1 A 134 134 GLN CB C 134 30.500 29.508 0.992 1
1 1594 . 3 1 1 A 134 134 GLN N N 134 116.300 117.051 -0.751 1
1 1 . 4 1 1 A 2 2 GLY HA2 H 2 3.890 4.342 -0.452 1
1 2 . 4 1 1 A 2 2 GLY HA3 H 2 3.890 4.361 -0.471 1
1 3 . 4 1 1 A 2 2 GLY C C 2 174.200 172.155 2.045 1
1 4 . 4 1 1 A 2 2 GLY CA C 2 44.700 45.786 -1.086 1
1 5 . 4 1 1 A 3 3 HIS H H 3 8.380 8.594 -0.214 1
1 6 . 4 1 1 A 3 3 HIS HA H 3 4.610 4.946 -0.336 1
1 9 . 4 1 1 A 3 3 HIS C C 3 174.500 173.482 1.018 1
1 10 . 4 1 1 A 3 3 HIS CA C 3 55.200 55.815 -0.615 1
1 11 . 4 1 1 A 3 3 HIS CB C 3 28.800 32.405 -3.605 1
1 12 . 4 1 1 A 3 3 HIS N N 3 117.600 120.465 -2.865 1
1 13 . 4 1 1 A 4 4 HIS H H 4 8.520 8.793 -0.273 1
1 14 . 4 1 1 A 4 4 HIS HA H 4 4.640 4.653 -0.013 1
1 17 . 4 1 1 A 4 4 HIS C C 4 174.200 175.004 -0.804 1
1 18 . 4 1 1 A 4 4 HIS CA C 4 55.100 57.341 -2.241 1
1 19 . 4 1 1 A 4 4 HIS CB C 4 28.900 31.688 -2.788 1
1 20 . 4 1 1 A 4 4 HIS N N 4 119.000 124.856 -5.856 1
1 21 . 4 1 1 A 5 5 HIS H H 5 8.530 7.884 0.646 1
1 22 . 4 1 1 A 5 5 HIS HA H 5 4.410 4.389 0.021 1
1 25 . 4 1 1 A 5 5 HIS CA C 5 54.900 56.235 -1.335 1
1 26 . 4 1 1 A 5 5 HIS CB C 5 27.300 30.713 -3.413 1
1 27 . 4 1 1 A 5 5 HIS N N 5 121.600 114.885 6.715 1
1 28 . 4 1 1 A 6 6 HIS HA H 6 4.640 4.928 -0.288 1
1 31 . 4 1 1 A 6 6 HIS C C 6 174.100 173.411 0.689 1
1 32 . 4 1 1 A 6 6 HIS CA C 6 55.100 53.804 1.296 1
1 33 . 4 1 1 A 6 6 HIS CB C 6 29.100 32.045 -2.945 1
1 34 . 4 1 1 A 7 7 HIS H H 7 8.690 8.812 -0.122 1
1 35 . 4 1 1 A 7 7 HIS HA H 7 4.650 4.753 -0.103 1
1 38 . 4 1 1 A 7 7 HIS C C 7 174.200 174.599 -0.399 1
1 39 . 4 1 1 A 7 7 HIS CA C 7 55.200 55.502 -0.302 1
1 40 . 4 1 1 A 7 7 HIS CB C 7 29.300 31.391 -2.091 1
1 41 . 4 1 1 A 7 7 HIS N N 7 121.400 118.024 3.376 1
1 42 . 4 1 1 A 8 8 HIS H H 8 8.660 9.193 -0.533 1
1 43 . 4 1 1 A 8 8 HIS HA H 8 4.700 5.064 -0.364 1
1 46 . 4 1 1 A 8 8 HIS C C 8 174.200 175.455 -1.255 1
1 47 . 4 1 1 A 8 8 HIS CA C 8 55.000 54.491 0.509 1
1 48 . 4 1 1 A 8 8 HIS CB C 8 29.300 31.996 -2.696 1
1 49 . 4 1 1 A 8 8 HIS N N 8 120.400 117.792 2.608 1
1 50 . 4 1 1 A 9 9 SER H H 9 8.490 9.160 -0.670 1
1 51 . 4 1 1 A 9 9 SER HA H 9 4.390 5.236 -0.846 1
1 54 . 4 1 1 A 9 9 SER C C 9 174.100 174.250 -0.150 1
1 55 . 4 1 1 A 9 9 SER CA C 9 58.300 56.992 1.308 1
1 56 . 4 1 1 A 9 9 SER CB C 9 63.700 65.180 -1.480 1
1 57 . 4 1 1 A 9 9 SER N N 9 118.100 119.070 -0.970 1
1 58 . 4 1 1 A 10 10 HIS H H 10 8.710 8.642 0.068 1
1 59 . 4 1 1 A 10 10 HIS HA H 10 4.690 5.200 -0.510 1
1 63 . 4 1 1 A 10 10 HIS C C 10 174.200 172.288 1.912 1
1 64 . 4 1 1 A 10 10 HIS CA C 10 55.200 54.572 0.628 1
1 65 . 4 1 1 A 10 10 HIS CB C 10 28.800 32.284 -3.484 1
1 66 . 4 1 1 A 10 10 HIS N N 10 120.700 116.576 4.124 1
1 67 . 4 1 1 A 11 11 MET H H 11 8.410 8.700 -0.290 1
1 68 . 4 1 1 A 11 11 MET HA H 11 4.420 4.927 -0.507 1
1 76 . 4 1 1 A 11 11 MET C C 11 175.800 174.936 0.864 1
1 77 . 4 1 1 A 11 11 MET CA C 11 55.100 54.280 0.820 1
1 78 . 4 1 1 A 11 11 MET CB C 11 32.800 32.758 0.042 1
1 81 . 4 1 1 A 11 11 MET N N 11 122.300 123.740 -1.440 1
1 82 . 4 1 1 A 12 12 ALA H H 12 8.440 8.930 -0.490 1
1 83 . 4 1 1 A 12 12 ALA HA H 12 4.280 4.765 -0.485 1
1 87 . 4 1 1 A 12 12 ALA C C 12 177.400 176.040 1.360 1
1 88 . 4 1 1 A 12 12 ALA CA C 12 52.400 50.852 1.548 1
1 89 . 4 1 1 A 12 12 ALA CB C 12 18.800 19.219 -0.419 1
1 90 . 4 1 1 A 12 12 ALA N N 12 125.900 127.490 -1.590 1
1 91 . 4 1 1 A 13 13 ASN H H 13 8.440 8.956 -0.516 1
1 92 . 4 1 1 A 13 13 ASN HA H 13 4.660 5.319 -0.659 1
1 97 . 4 1 1 A 13 13 ASN C C 13 175.900 175.209 0.691 1
1 98 . 4 1 1 A 13 13 ASN CA C 13 53.200 52.572 0.628 1
1 99 . 4 1 1 A 13 13 ASN CB C 13 38.800 40.481 -1.681 1
1 100 . 4 1 1 A 13 13 ASN N N 13 118.300 121.483 -3.183 1
1 102 . 4 1 1 A 14 14 GLY H H 14 8.370 8.454 -0.084 1
1 103 . 4 1 1 A 14 14 GLY HA2 H 14 3.920 4.227 -0.307 1
1 104 . 4 1 1 A 14 14 GLY HA3 H 14 3.920 4.228 -0.308 1
1 105 . 4 1 1 A 14 14 GLY C C 14 174.000 172.529 1.471 1
1 106 . 4 1 1 A 14 14 GLY CA C 14 45.200 45.559 -0.359 1
1 107 . 4 1 1 A 14 14 GLY N N 14 109.600 108.165 1.435 1
1 108 . 4 1 1 A 15 15 ALA H H 15 8.140 8.676 -0.536 1
1 109 . 4 1 1 A 15 15 ALA HA H 15 4.280 5.064 -0.784 1
1 113 . 4 1 1 A 15 15 ALA C C 15 177.300 175.741 1.559 1
1 114 . 4 1 1 A 15 15 ALA CA C 15 52.500 51.817 0.683 1
1 115 . 4 1 1 A 15 15 ALA CB C 15 19.100 20.638 -1.538 1
1 116 . 4 1 1 A 15 15 ALA N N 15 123.800 124.782 -0.982 1
1 117 . 4 1 1 A 16 16 ALA H H 16 8.030 8.600 -0.570 1
1 118 . 4 1 1 A 16 16 ALA HA H 16 4.280 4.725 -0.445 1
1 122 . 4 1 1 A 16 16 ALA C C 16 178.400 176.556 1.844 1
1 123 . 4 1 1 A 16 16 ALA CA C 16 52.600 51.514 1.086 1
1 124 . 4 1 1 A 16 16 ALA CB C 16 19.100 22.250 -3.150 1
1 125 . 4 1 1 A 16 16 ALA N N 16 122.300 124.625 -2.325 1
1 126 . 4 1 1 A 17 17 GLY H H 17 8.320 8.692 -0.372 1
1 127 . 4 1 1 A 17 17 GLY HA2 H 17 3.960 4.000 -0.040 1
1 128 . 4 1 1 A 17 17 GLY HA3 H 17 3.960 4.001 -0.041 1
1 129 . 4 1 1 A 17 17 GLY C C 17 174.500 174.054 0.446 1
1 130 . 4 1 1 A 17 17 GLY CA C 17 45.200 45.694 -0.494 1
1 131 . 4 1 1 A 17 17 GLY N N 17 107.800 109.758 -1.958 1
1 132 . 4 1 1 A 18 18 THR H H 18 7.970 8.028 -0.058 1
1 133 . 4 1 1 A 18 18 THR HA H 18 4.290 4.376 -0.086 1
1 138 . 4 1 1 A 18 18 THR C C 18 174.600 176.292 -1.692 1
1 139 . 4 1 1 A 18 18 THR CA C 18 62.000 63.540 -1.540 1
1 140 . 4 1 1 A 18 18 THR CB C 18 69.700 70.309 -0.609 1
1 142 . 4 1 1 A 18 18 THR N N 18 113.800 112.800 1.000 1
1 143 . 4 1 1 A 19 19 LYS H H 19 8.350 8.379 -0.029 1
1 144 . 4 1 1 A 19 19 LYS HA H 19 4.270 4.141 0.129 1
1 153 . 4 1 1 A 19 19 LYS C C 19 176.600 177.173 -0.573 1
1 154 . 4 1 1 A 19 19 LYS CA C 19 56.500 58.459 -1.959 1
1 155 . 4 1 1 A 19 19 LYS CB C 19 32.800 31.561 1.239 1
1 159 . 4 1 1 A 19 19 LYS N N 19 124.000 121.039 2.961 1
1 160 . 4 1 1 A 20 20 VAL H H 20 8.060 7.627 0.433 1
1 161 . 4 1 1 A 20 20 VAL HA H 20 3.990 4.520 -0.530 1
1 169 . 4 1 1 A 20 20 VAL C C 20 175.900 176.484 -0.584 1
1 170 . 4 1 1 A 20 20 VAL CA C 20 62.400 61.942 0.458 1
1 171 . 4 1 1 A 20 20 VAL CB C 20 32.600 32.175 0.425 1
1 174 . 4 1 1 A 20 20 VAL N N 20 121.700 118.292 3.408 1
1 175 . 4 1 1 A 21 21 ALA H H 21 8.310 8.093 0.217 1
1 176 . 4 1 1 A 21 21 ALA HA H 21 4.290 3.988 0.302 1
1 180 . 4 1 1 A 21 21 ALA C C 21 177.600 180.387 -2.787 1
1 181 . 4 1 1 A 21 21 ALA CA C 21 52.400 55.342 -2.942 1
1 182 . 4 1 1 A 21 21 ALA CB C 21 19.000 19.095 -0.095 1
1 183 . 4 1 1 A 21 21 ALA N N 21 127.700 125.997 1.703 1
1 184 . 4 1 1 A 22 22 LEU H H 22 8.150 8.018 0.132 1
1 185 . 4 1 1 A 22 22 LEU HA H 22 4.280 4.172 0.108 1
1 195 . 4 1 1 A 22 22 LEU C C 22 177.400 177.939 -0.539 1
1 196 . 4 1 1 A 22 22 LEU CA C 22 55.200 55.443 -0.243 1
1 197 . 4 1 1 A 22 22 LEU CB C 22 42.200 41.678 0.522 1
1 201 . 4 1 1 A 22 22 LEU N N 22 121.800 117.328 4.472 1
1 202 . 4 1 1 A 23 23 ARG H H 23 8.240 7.849 0.391 1
1 203 . 4 1 1 A 23 23 ARG HA H 23 4.290 4.338 -0.048 1
1 211 . 4 1 1 A 23 23 ARG C C 23 176.300 176.786 -0.486 1
1 212 . 4 1 1 A 23 23 ARG CA C 23 56.000 54.957 1.043 1
1 213 . 4 1 1 A 23 23 ARG CB C 23 30.600 28.737 1.863 1
1 216 . 4 1 1 A 23 23 ARG N N 23 122.000 120.580 1.420 1
1 218 . 4 1 1 A 24 24 LYS H H 24 8.370 8.393 -0.023 1
1 219 . 4 1 1 A 24 24 LYS HA H 24 4.330 4.324 0.006 1
1 228 . 4 1 1 A 24 24 LYS C C 24 176.800 176.390 0.410 1
1 229 . 4 1 1 A 24 24 LYS CA C 24 56.400 58.099 -1.699 1
1 230 . 4 1 1 A 24 24 LYS CB C 24 32.700 33.053 -0.353 1
1 234 . 4 1 1 A 24 24 LYS N N 24 122.900 125.882 -2.982 1
1 235 . 4 1 1 A 25 25 THR H H 25 8.100 7.763 0.337 1
1 236 . 4 1 1 A 25 25 THR HA H 25 4.290 4.651 -0.361 1
1 241 . 4 1 1 A 25 25 THR C C 25 174.600 173.024 1.576 1
1 242 . 4 1 1 A 25 25 THR CA C 25 61.500 59.537 1.963 1
1 243 . 4 1 1 A 25 25 THR CB C 25 69.800 71.233 -1.433 1
1 245 . 4 1 1 A 25 25 THR N N 25 115.500 110.097 5.403 1
1 246 . 4 1 1 A 26 26 LYS H H 26 8.370 8.598 -0.228 1
1 247 . 4 1 1 A 26 26 LYS HA H 26 4.270 4.262 0.008 1
1 256 . 4 1 1 A 26 26 LYS C C 26 176.600 177.624 -1.024 1
1 257 . 4 1 1 A 26 26 LYS CA C 26 56.600 57.091 -0.491 1
1 258 . 4 1 1 A 26 26 LYS CB C 26 32.700 32.747 -0.047 1
1 262 . 4 1 1 A 26 26 LYS N N 26 123.700 123.178 0.522 1
1 263 . 4 1 1 A 27 27 GLN H H 27 8.390 8.995 -0.605 1
1 264 . 4 1 1 A 27 27 GLN HA H 27 4.240 4.442 -0.202 1
1 271 . 4 1 1 A 27 27 GLN C C 27 175.900 176.079 -0.179 1
1 272 . 4 1 1 A 27 27 GLN CA C 27 56.100 57.325 -1.225 1
1 273 . 4 1 1 A 27 27 GLN CB C 27 29.300 28.875 0.425 1
1 275 . 4 1 1 A 27 27 GLN N N 27 121.700 120.881 0.819 1
1 277 . 4 1 1 A 28 28 ALA H H 28 8.330 7.828 0.502 1
1 278 . 4 1 1 A 28 28 ALA HA H 28 4.240 4.471 -0.231 1
1 282 . 4 1 1 A 28 28 ALA C C 28 177.700 177.146 0.554 1
1 283 . 4 1 1 A 28 28 ALA CA C 28 52.500 51.547 0.953 1
1 284 . 4 1 1 A 28 28 ALA CB C 28 19.100 22.320 -3.220 1
1 285 . 4 1 1 A 28 28 ALA N N 28 125.400 119.099 6.301 1
1 286 . 4 1 1 A 29 29 ALA H H 29 8.250 8.902 -0.652 1
1 287 . 4 1 1 A 29 29 ALA HA H 29 4.230 4.003 0.227 1
1 291 . 4 1 1 A 29 29 ALA C C 29 178.000 179.584 -1.584 1
1 292 . 4 1 1 A 29 29 ALA CA C 29 52.500 55.138 -2.638 1
1 293 . 4 1 1 A 29 29 ALA CB C 29 19.100 18.456 0.644 1
1 294 . 4 1 1 A 29 29 ALA N N 29 123.000 124.168 -1.168 1
1 295 . 4 1 1 A 30 30 GLU H H 30 8.260 8.334 -0.074 1
1 296 . 4 1 1 A 30 30 GLU HA H 30 4.220 4.066 0.154 1
1 301 . 4 1 1 A 30 30 GLU C C 30 176.500 177.407 -0.907 1
1 302 . 4 1 1 A 30 30 GLU CA C 30 56.400 59.625 -3.225 1
1 303 . 4 1 1 A 30 30 GLU CB C 30 29.500 29.734 -0.234 1
1 305 . 4 1 1 A 30 30 GLU N N 30 119.700 118.722 0.978 1
1 306 . 4 1 1 A 31 31 LYS H H 31 8.230 7.882 0.348 1
1 307 . 4 1 1 A 31 31 LYS HA H 31 4.280 4.493 -0.213 1
1 316 . 4 1 1 A 31 31 LYS C C 31 176.500 176.512 -0.012 1
1 317 . 4 1 1 A 31 31 LYS CA C 31 56.400 55.804 0.596 1
1 318 . 4 1 1 A 31 31 LYS CB C 31 32.800 33.406 -0.606 1
1 322 . 4 1 1 A 31 31 LYS N N 31 122.700 117.884 4.816 1
1 323 . 4 1 1 A 32 32 ILE H H 32 8.140 7.186 0.954 1
1 324 . 4 1 1 A 32 32 ILE HA H 32 4.110 4.208 -0.098 1
1 334 . 4 1 1 A 32 32 ILE C C 32 176.400 175.892 0.508 1
1 335 . 4 1 1 A 32 32 ILE CA C 32 61.200 61.592 -0.392 1
1 336 . 4 1 1 A 32 32 ILE CB C 32 38.600 36.905 1.695 1
1 340 . 4 1 1 A 32 32 ILE N N 32 122.300 122.327 -0.027 1
1 341 . 4 1 1 A 33 33 SER H H 33 8.230 8.916 -0.686 1
1 342 . 4 1 1 A 33 33 SER HA H 33 4.400 3.937 0.463 1
1 345 . 4 1 1 A 33 33 SER C C 33 174.800 176.504 -1.704 1
1 346 . 4 1 1 A 33 33 SER CA C 33 58.300 62.205 -3.905 1
1 347 . 4 1 1 A 33 33 SER CB C 33 63.700 62.748 0.952 1
1 348 . 4 1 1 A 33 33 SER N N 33 119.600 123.414 -3.814 1
1 349 . 4 1 1 A 34 34 ALA H H 34 8.430 8.359 0.071 1
1 350 . 4 1 1 A 34 34 ALA HA H 34 4.220 4.025 0.195 1
1 354 . 4 1 1 A 34 34 ALA C C 34 179.500 180.078 -0.578 1
1 355 . 4 1 1 A 34 34 ALA CA C 34 53.500 55.189 -1.689 1
1 356 . 4 1 1 A 34 34 ALA CB C 34 18.800 18.148 0.652 1
1 357 . 4 1 1 A 34 34 ALA N N 34 126.000 123.546 2.454 1
1 358 . 4 1 1 A 35 35 ASP H H 35 8.380 7.926 0.454 1
1 359 . 4 1 1 A 35 35 ASP HA H 35 4.520 4.313 0.207 1
1 362 . 4 1 1 A 35 35 ASP C C 35 176.500 178.471 -1.971 1
1 363 . 4 1 1 A 35 35 ASP CA C 35 54.800 56.833 -2.033 1
1 364 . 4 1 1 A 35 35 ASP CB C 35 40.200 40.672 -0.472 1
1 365 . 4 1 1 A 35 35 ASP N N 35 118.200 118.238 -0.038 1
1 366 . 4 1 1 A 36 36 LYS H H 36 8.000 7.787 0.213 1
1 367 . 4 1 1 A 36 36 LYS HA H 36 4.270 4.027 0.243 1
1 376 . 4 1 1 A 36 36 LYS C C 36 177.000 177.352 -0.352 1
1 377 . 4 1 1 A 36 36 LYS CA C 36 56.800 58.900 -2.100 1
1 378 . 4 1 1 A 36 36 LYS CB C 36 32.900 31.983 0.917 1
1 382 . 4 1 1 A 36 36 LYS N N 36 120.900 118.215 2.685 1
1 383 . 4 1 1 A 37 37 ILE H H 37 7.970 7.284 0.686 1
1 384 . 4 1 1 A 37 37 ILE HA H 37 4.020 3.874 0.146 1
1 394 . 4 1 1 A 37 37 ILE C C 37 176.100 175.908 0.192 1
1 395 . 4 1 1 A 37 37 ILE CA C 37 61.300 62.541 -1.241 1
1 396 . 4 1 1 A 37 37 ILE CB C 37 38.100 37.738 0.362 1
1 400 . 4 1 1 A 37 37 ILE N N 37 121.800 120.973 0.827 1
1 401 . 4 1 1 A 38 38 SER H H 38 7.980 8.712 -0.732 1
1 402 . 4 1 1 A 38 38 SER HA H 38 4.540 5.097 -0.557 1
1 405 . 4 1 1 A 38 38 SER C C 38 174.700 174.862 -0.162 1
1 406 . 4 1 1 A 38 38 SER CA C 38 58.200 57.143 1.057 1
1 407 . 4 1 1 A 38 38 SER CB C 38 64.400 66.673 -2.273 1
1 408 . 4 1 1 A 38 38 SER N N 38 119.000 124.019 -5.019 1
1 409 . 4 1 1 A 39 39 LYS H H 39 8.690 8.845 -0.155 1
1 410 . 4 1 1 A 39 39 LYS HA H 39 3.400 3.531 -0.131 1
1 419 . 4 1 1 A 39 39 LYS C C 39 177.400 177.992 -0.592 1
1 420 . 4 1 1 A 39 39 LYS CA C 39 59.800 60.380 -0.580 1
1 421 . 4 1 1 A 39 39 LYS CB C 39 32.400 32.349 0.051 1
1 425 . 4 1 1 A 39 39 LYS N N 39 124.200 124.632 -0.432 1
1 426 . 4 1 1 A 40 40 GLU H H 40 8.280 8.413 -0.133 1
1 427 . 4 1 1 A 40 40 GLU HA H 40 3.840 4.047 -0.207 1
1 432 . 4 1 1 A 40 40 GLU C C 40 178.400 178.988 -0.588 1
1 433 . 4 1 1 A 40 40 GLU CA C 40 59.400 59.335 0.065 1
1 434 . 4 1 1 A 40 40 GLU CB C 40 28.300 29.282 -0.982 1
1 436 . 4 1 1 A 40 40 GLU N N 40 116.300 117.393 -1.093 1
1 437 . 4 1 1 A 41 41 ALA H H 41 7.890 7.981 -0.091 1
1 438 . 4 1 1 A 41 41 ALA HA H 41 3.910 4.177 -0.267 1
1 442 . 4 1 1 A 41 41 ALA C C 41 179.900 179.067 0.833 1
1 443 . 4 1 1 A 41 41 ALA CA C 41 54.700 55.002 -0.302 1
1 444 . 4 1 1 A 41 41 ALA CB C 41 17.900 18.300 -0.400 1
1 445 . 4 1 1 A 41 41 ALA N N 41 122.300 122.162 0.138 1
1 446 . 4 1 1 A 42 42 LEU H H 42 7.490 7.795 -0.305 1
1 447 . 4 1 1 A 42 42 LEU HA H 42 3.480 4.200 -0.720 1
1 457 . 4 1 1 A 42 42 LEU C C 42 178.900 178.521 0.379 1
1 458 . 4 1 1 A 42 42 LEU CA C 42 59.800 57.498 2.302 1
1 459 . 4 1 1 A 42 42 LEU CB C 42 42.300 41.612 0.688 1
1 463 . 4 1 1 A 42 42 LEU N N 42 121.000 119.910 1.090 1
1 464 . 4 1 1 A 43 43 LEU H H 43 8.290 7.929 0.361 1
1 465 . 4 1 1 A 43 43 LEU HA H 43 3.780 3.805 -0.025 1
1 475 . 4 1 1 A 43 43 LEU C C 43 179.400 179.215 0.185 1
1 476 . 4 1 1 A 43 43 LEU CA C 43 57.600 58.168 -0.568 1
1 477 . 4 1 1 A 43 43 LEU CB C 43 40.900 41.630 -0.730 1
1 481 . 4 1 1 A 43 43 LEU N N 43 119.200 118.826 0.374 1
1 482 . 4 1 1 A 44 44 GLU H H 44 8.330 8.649 -0.319 1
1 483 . 4 1 1 A 44 44 GLU HA H 44 4.050 4.015 0.035 1
1 488 . 4 1 1 A 44 44 GLU C C 44 178.600 178.243 0.357 1
1 489 . 4 1 1 A 44 44 GLU CA C 44 58.900 58.858 0.042 1
1 490 . 4 1 1 A 44 44 GLU CB C 44 28.300 28.682 -0.382 1
1 492 . 4 1 1 A 44 44 GLU N N 44 119.600 116.863 2.737 1
1 493 . 4 1 1 A 45 45 CYS H H 45 7.690 7.665 0.025 1
1 494 . 4 1 1 A 45 45 CYS HA H 45 4.120 4.263 -0.143 1
1 497 . 4 1 1 A 45 45 CYS C C 45 176.100 176.660 -0.560 1
1 498 . 4 1 1 A 45 45 CYS CA C 45 62.500 62.874 -0.374 1
1 499 . 4 1 1 A 45 45 CYS CB C 45 26.200 27.458 -1.258 1
1 500 . 4 1 1 A 45 45 CYS N N 45 120.900 117.859 3.041 1
1 501 . 4 1 1 A 46 46 ALA H H 46 8.540 8.156 0.384 1
1 502 . 4 1 1 A 46 46 ALA HA H 46 3.900 3.988 -0.088 1
1 506 . 4 1 1 A 46 46 ALA C C 46 179.200 178.922 0.278 1
1 507 . 4 1 1 A 46 46 ALA CA C 46 55.500 55.247 0.253 1
1 508 . 4 1 1 A 46 46 ALA CB C 46 16.800 18.363 -1.563 1
1 509 . 4 1 1 A 46 46 ALA N N 46 121.500 122.167 -0.667 1
1 510 . 4 1 1 A 47 47 ASP H H 47 8.460 8.193 0.267 1
1 511 . 4 1 1 A 47 47 ASP HA H 47 4.340 4.496 -0.156 1
1 514 . 4 1 1 A 47 47 ASP C C 47 178.800 178.345 0.455 1
1 515 . 4 1 1 A 47 47 ASP CA C 47 56.600 56.933 -0.333 1
1 516 . 4 1 1 A 47 47 ASP CB C 47 39.800 41.735 -1.935 1
1 517 . 4 1 1 A 47 47 ASP N N 47 119.000 118.341 0.659 1
1 518 . 4 1 1 A 48 48 LEU H H 48 8.040 7.929 0.111 1
1 519 . 4 1 1 A 48 48 LEU HA H 48 4.110 4.111 -0.001 1
1 529 . 4 1 1 A 48 48 LEU C C 48 180.000 179.887 0.113 1
1 530 . 4 1 1 A 48 48 LEU CA C 48 58.000 58.077 -0.077 1
1 531 . 4 1 1 A 48 48 LEU CB C 48 41.700 41.095 0.605 1
1 535 . 4 1 1 A 48 48 LEU N N 48 123.000 118.557 4.443 1
1 536 . 4 1 1 A 49 49 LEU H H 49 8.300 7.890 0.410 1
1 537 . 4 1 1 A 49 49 LEU HA H 49 4.110 4.011 0.099 1
1 547 . 4 1 1 A 49 49 LEU C C 49 177.200 178.761 -1.561 1
1 548 . 4 1 1 A 49 49 LEU CA C 49 57.600 57.865 -0.265 1
1 549 . 4 1 1 A 49 49 LEU CB C 49 41.200 41.718 -0.518 1
1 553 . 4 1 1 A 49 49 LEU N N 49 120.900 120.923 -0.023 1
1 554 . 4 1 1 A 50 50 SER H H 50 8.660 7.871 0.789 1
1 555 . 4 1 1 A 50 50 SER HA H 50 4.000 4.185 -0.185 1
1 558 . 4 1 1 A 50 50 SER C C 50 176.800 176.271 0.529 1
1 559 . 4 1 1 A 50 50 SER CA C 50 62.500 61.608 0.892 1
1 560 . 4 1 1 A 50 50 SER CB C 50 62.600 62.411 0.189 1
1 561 . 4 1 1 A 50 50 SER N N 50 113.300 113.214 0.086 1
1 562 . 4 1 1 A 51 51 SER H H 51 7.980 8.527 -0.547 1
1 563 . 4 1 1 A 51 51 SER HA H 51 4.220 4.212 0.008 1
1 566 . 4 1 1 A 51 51 SER C C 51 176.300 177.080 -0.780 1
1 567 . 4 1 1 A 51 51 SER CA C 51 61.200 61.362 -0.162 1
1 568 . 4 1 1 A 51 51 SER CB C 51 62.700 62.337 0.363 1
1 569 . 4 1 1 A 51 51 SER N N 51 115.900 115.746 0.154 1
1 570 . 4 1 1 A 52 52 ALA H H 52 8.030 7.927 0.103 1
1 571 . 4 1 1 A 52 52 ALA HA H 52 4.130 4.205 -0.075 1
1 575 . 4 1 1 A 52 52 ALA C C 52 178.500 180.432 -1.932 1
1 576 . 4 1 1 A 52 52 ALA CA C 52 54.500 54.898 -0.398 1
1 577 . 4 1 1 A 52 52 ALA CB C 52 18.000 18.298 -0.298 1
1 578 . 4 1 1 A 52 52 ALA N N 52 125.400 123.887 1.513 1
1 579 . 4 1 1 A 53 53 LEU H H 53 7.710 8.044 -0.334 1
1 580 . 4 1 1 A 53 53 LEU HA H 53 4.180 4.024 0.156 1
1 590 . 4 1 1 A 53 53 LEU C C 53 177.700 178.357 -0.657 1
1 591 . 4 1 1 A 53 53 LEU CA C 53 56.500 57.557 -1.057 1
1 592 . 4 1 1 A 53 53 LEU CB C 53 42.400 41.737 0.663 1
1 596 . 4 1 1 A 53 53 LEU N N 53 113.800 119.347 -5.547 1
1 597 . 4 1 1 A 54 54 THR H H 54 7.550 7.318 0.232 1
1 598 . 4 1 1 A 54 54 THR HA H 54 4.420 4.319 0.101 1
1 603 . 4 1 1 A 54 54 THR C C 54 174.100 173.289 0.811 1
1 604 . 4 1 1 A 54 54 THR CA C 54 61.600 62.352 -0.752 1
1 605 . 4 1 1 A 54 54 THR CB C 54 69.300 69.283 0.017 1
1 607 . 4 1 1 A 54 54 THR N N 54 107.700 107.680 0.020 1
1 608 . 4 1 1 A 55 55 GLU H H 55 7.750 7.734 0.016 1
1 609 . 4 1 1 A 55 55 GLU HA H 55 4.760 4.900 -0.140 1
1 614 . 4 1 1 A 55 55 GLU CA C 55 53.400 53.909 -0.509 1
1 615 . 4 1 1 A 55 55 GLU CB C 55 30.100 32.605 -2.505 1
1 617 . 4 1 1 A 55 55 GLU N N 55 122.800 118.868 3.932 1
1 618 . 4 1 1 A 56 56 PRO HA H 56 4.670 4.676 -0.006 1
1 625 . 4 1 1 A 56 56 PRO C C 56 176.200 176.421 -0.221 1
1 626 . 4 1 1 A 56 56 PRO CA C 56 62.900 63.120 -0.220 1
1 627 . 4 1 1 A 56 56 PRO CB C 56 29.200 31.797 -2.597 1
1 630 . 4 1 1 A 57 57 VAL H H 57 8.010 8.376 -0.366 1
1 631 . 4 1 1 A 57 57 VAL HA H 57 4.590 4.949 -0.359 1
1 639 . 4 1 1 A 57 57 VAL CA C 57 58.600 58.415 0.185 1
1 640 . 4 1 1 A 57 57 VAL CB C 57 32.800 34.987 -2.187 1
1 643 . 4 1 1 A 57 57 VAL N N 57 121.400 117.352 4.048 1
1 644 . 4 1 1 A 58 58 PRO HA H 58 4.450 4.682 -0.232 1
1 651 . 4 1 1 A 58 58 PRO C C 58 177.500 177.811 -0.311 1
1 652 . 4 1 1 A 58 58 PRO CA C 58 62.600 62.772 -0.172 1
1 653 . 4 1 1 A 58 58 PRO CB C 58 32.200 32.283 -0.083 1
1 656 . 4 1 1 A 59 59 ASN H H 59 8.890 8.861 0.029 1
1 657 . 4 1 1 A 59 59 ASN HA H 59 4.330 4.386 -0.056 1
1 662 . 4 1 1 A 59 59 ASN C C 59 177.600 177.716 -0.116 1
1 663 . 4 1 1 A 59 59 ASN CA C 59 56.300 56.489 -0.189 1
1 664 . 4 1 1 A 59 59 ASN CB C 59 38.400 38.307 0.093 1
1 665 . 4 1 1 A 59 59 ASN N N 59 122.200 121.505 0.695 1
1 667 . 4 1 1 A 60 60 SER H H 60 8.660 7.985 0.675 1
1 668 . 4 1 1 A 60 60 SER HA H 60 4.010 4.174 -0.164 1
1 671 . 4 1 1 A 60 60 SER C C 60 176.200 177.340 -1.140 1
1 672 . 4 1 1 A 60 60 SER CA C 60 60.800 61.356 -0.556 1
1 673 . 4 1 1 A 60 60 SER CB C 60 61.500 62.707 -1.207 1
1 674 . 4 1 1 A 60 60 SER N N 60 113.200 115.532 -2.332 1
1 675 . 4 1 1 A 61 61 GLN H H 61 7.420 8.011 -0.591 1
1 676 . 4 1 1 A 61 61 GLN HA H 61 4.280 4.029 0.251 1
1 683 . 4 1 1 A 61 61 GLN C C 61 178.600 178.430 0.170 1
1 684 . 4 1 1 A 61 61 GLN CA C 61 57.900 58.819 -0.919 1
1 685 . 4 1 1 A 61 61 GLN CB C 61 28.600 28.107 0.493 1
1 687 . 4 1 1 A 61 61 GLN N N 61 122.200 120.671 1.529 1
1 689 . 4 1 1 A 62 62 LEU H H 62 7.430 8.014 -0.584 1
1 690 . 4 1 1 A 62 62 LEU HA H 62 3.850 4.067 -0.217 1
1 700 . 4 1 1 A 62 62 LEU C C 62 178.800 179.124 -0.324 1
1 701 . 4 1 1 A 62 62 LEU CA C 62 57.900 58.103 -0.203 1
1 702 . 4 1 1 A 62 62 LEU CB C 62 42.100 42.060 0.040 1
1 706 . 4 1 1 A 62 62 LEU N N 62 120.600 119.932 0.668 1
1 707 . 4 1 1 A 63 63 VAL H H 63 8.200 8.056 0.144 1
1 708 . 4 1 1 A 63 63 VAL HA H 63 3.370 3.492 -0.122 1
1 716 . 4 1 1 A 63 63 VAL C C 63 178.000 178.016 -0.016 1
1 717 . 4 1 1 A 63 63 VAL CA C 63 66.600 67.173 -0.573 1
1 718 . 4 1 1 A 63 63 VAL CB C 63 31.700 31.303 0.397 1
1 721 . 4 1 1 A 63 63 VAL N N 63 118.200 117.501 0.699 1
1 722 . 4 1 1 A 64 64 ASP H H 64 7.960 8.209 -0.249 1
1 723 . 4 1 1 A 64 64 ASP HA H 64 4.460 4.276 0.184 1
1 726 . 4 1 1 A 64 64 ASP C C 64 178.100 178.591 -0.491 1
1 727 . 4 1 1 A 64 64 ASP CA C 64 57.700 57.522 0.178 1
1 728 . 4 1 1 A 64 64 ASP CB C 64 39.800 41.015 -1.215 1
1 729 . 4 1 1 A 64 64 ASP N N 64 120.200 120.307 -0.107 1
1 730 . 4 1 1 A 65 65 THR H H 65 8.380 8.494 -0.114 1
1 731 . 4 1 1 A 65 65 THR HA H 65 3.970 4.030 -0.060 1
1 736 . 4 1 1 A 65 65 THR C C 65 176.500 177.328 -0.828 1
1 737 . 4 1 1 A 65 65 THR CA C 65 66.500 66.750 -0.250 1
1 738 . 4 1 1 A 65 65 THR CB C 65 67.800 67.703 0.097 1
1 740 . 4 1 1 A 65 65 THR N N 65 118.100 116.347 1.753 1
1 741 . 4 1 1 A 66 66 GLY H H 66 8.900 8.589 0.311 1
1 742 . 4 1 1 A 66 66 GLY HA2 H 66 3.630 3.732 -0.102 1
1 743 . 4 1 1 A 66 66 GLY HA3 H 66 3.630 3.756 -0.126 1
1 744 . 4 1 1 A 66 66 GLY C C 66 174.200 175.435 -1.235 1
1 745 . 4 1 1 A 66 66 GLY CA C 66 47.500 46.987 0.513 1
1 746 . 4 1 1 A 66 66 GLY N N 66 110.500 108.021 2.479 1
1 747 . 4 1 1 A 67 67 HIS H H 67 8.650 8.237 0.413 1
1 748 . 4 1 1 A 67 67 HIS HA H 67 4.220 4.137 0.083 1
1 752 . 4 1 1 A 67 67 HIS C C 67 176.900 177.563 -0.663 1
1 753 . 4 1 1 A 67 67 HIS CA C 67 59.000 59.022 -0.022 1
1 754 . 4 1 1 A 67 67 HIS CB C 67 27.800 29.669 -1.869 1
1 756 . 4 1 1 A 67 67 HIS N N 67 120.100 122.100 -2.000 1
1 757 . 4 1 1 A 68 68 GLN H H 68 7.860 8.320 -0.460 1
1 758 . 4 1 1 A 68 68 GLN HA H 68 3.990 3.864 0.126 1
1 765 . 4 1 1 A 68 68 GLN C C 68 177.800 177.570 0.230 1
1 766 . 4 1 1 A 68 68 GLN CA C 68 58.800 58.399 0.401 1
1 767 . 4 1 1 A 68 68 GLN CB C 68 28.200 27.284 0.916 1
1 769 . 4 1 1 A 68 68 GLN N N 68 121.400 116.396 5.004 1
1 771 . 4 1 1 A 69 69 LEU H H 69 8.300 7.812 0.488 1
1 772 . 4 1 1 A 69 69 LEU HA H 69 4.330 4.012 0.318 1
1 782 . 4 1 1 A 69 69 LEU C C 69 179.300 179.994 -0.694 1
1 783 . 4 1 1 A 69 69 LEU CA C 69 58.200 58.050 0.150 1
1 784 . 4 1 1 A 69 69 LEU CB C 69 40.500 40.705 -0.205 1
1 788 . 4 1 1 A 69 69 LEU N N 69 120.300 121.754 -1.454 1
1 789 . 4 1 1 A 70 70 LEU H H 70 8.460 7.925 0.535 1
1 790 . 4 1 1 A 70 70 LEU HA H 70 3.880 3.944 -0.064 1
1 800 . 4 1 1 A 70 70 LEU C C 70 179.100 179.342 -0.242 1
1 801 . 4 1 1 A 70 70 LEU CA C 70 58.300 57.741 0.559 1
1 802 . 4 1 1 A 70 70 LEU CB C 70 41.500 40.400 1.100 1
1 806 . 4 1 1 A 70 70 LEU N N 70 121.200 120.514 0.686 1
1 807 . 4 1 1 A 71 71 ASP H H 71 8.140 8.039 0.101 1
1 808 . 4 1 1 A 71 71 ASP HA H 71 4.420 4.358 0.062 1
1 811 . 4 1 1 A 71 71 ASP C C 71 180.000 178.256 1.744 1
1 812 . 4 1 1 A 71 71 ASP CA C 71 57.300 57.217 0.083 1
1 813 . 4 1 1 A 71 71 ASP CB C 71 39.300 41.011 -1.711 1
1 814 . 4 1 1 A 71 71 ASP N N 71 121.100 119.904 1.196 1
1 815 . 4 1 1 A 72 72 TYR H H 72 8.320 8.230 0.090 1
1 816 . 4 1 1 A 72 72 TYR HA H 72 4.550 4.447 0.103 1
1 823 . 4 1 1 A 72 72 TYR C C 72 179.100 178.662 0.438 1
1 824 . 4 1 1 A 72 72 TYR CA C 72 60.500 60.782 -0.282 1
1 825 . 4 1 1 A 72 72 TYR CB C 72 37.600 38.173 -0.573 1
1 828 . 4 1 1 A 72 72 TYR N N 72 120.300 117.997 2.303 1
1 829 . 4 1 1 A 73 73 CYS H H 73 8.850 8.587 0.263 1
1 830 . 4 1 1 A 73 73 CYS HA H 73 4.380 4.569 -0.189 1
1 834 . 4 1 1 A 73 73 CYS C C 73 177.300 177.342 -0.042 1
1 835 . 4 1 1 A 73 73 CYS CA C 73 64.400 63.599 0.801 1
1 836 . 4 1 1 A 73 73 CYS CB C 73 27.600 26.231 1.369 1
1 837 . 4 1 1 A 73 73 CYS N N 73 116.800 118.555 -1.755 1
1 838 . 4 1 1 A 74 74 SER H H 74 8.410 7.974 0.436 1
1 839 . 4 1 1 A 74 74 SER HA H 74 4.290 4.282 0.008 1
1 842 . 4 1 1 A 74 74 SER C C 74 176.300 177.099 -0.799 1
1 843 . 4 1 1 A 74 74 SER CA C 74 61.400 61.197 0.203 1
1 844 . 4 1 1 A 74 74 SER CB C 74 62.600 62.942 -0.342 1
1 845 . 4 1 1 A 74 74 SER N N 74 115.900 116.064 -0.164 1
1 846 . 4 1 1 A 75 75 GLY H H 75 7.790 8.115 -0.325 1
1 847 . 4 1 1 A 75 75 GLY HA2 H 75 4.320 3.763 0.557 1
1 848 . 4 1 1 A 75 75 GLY HA3 H 75 3.900 3.766 0.134 1
1 849 . 4 1 1 A 75 75 GLY C C 75 174.600 175.398 -0.798 1
1 850 . 4 1 1 A 75 75 GLY CA C 75 45.600 47.184 -1.584 1
1 851 . 4 1 1 A 75 75 GLY N N 75 107.500 107.461 0.039 1
1 852 . 4 1 1 A 76 76 TYR H H 76 8.040 8.270 -0.230 1
1 853 . 4 1 1 A 76 76 TYR HA H 76 4.310 4.038 0.272 1
1 860 . 4 1 1 A 76 76 TYR C C 76 176.200 177.582 -1.382 1
1 861 . 4 1 1 A 76 76 TYR CA C 76 60.000 61.082 -1.082 1
1 862 . 4 1 1 A 76 76 TYR CB C 76 40.700 38.545 2.155 1
1 865 . 4 1 1 A 76 76 TYR N N 76 121.900 123.300 -1.400 1
1 866 . 4 1 1 A 77 77 VAL H H 77 7.540 8.414 -0.874 1
1 867 . 4 1 1 A 77 77 VAL HA H 77 3.450 3.260 0.190 1
1 875 . 4 1 1 A 77 77 VAL C C 77 175.500 177.205 -1.705 1
1 876 . 4 1 1 A 77 77 VAL CA C 77 65.500 64.819 0.681 1
1 877 . 4 1 1 A 77 77 VAL CB C 77 31.600 31.125 0.475 1
1 880 . 4 1 1 A 77 77 VAL N N 77 116.600 119.362 -2.762 1
1 881 . 4 1 1 A 78 78 ASP H H 78 7.580 8.083 -0.503 1
1 882 . 4 1 1 A 78 78 ASP HA H 78 4.380 4.318 0.062 1
1 885 . 4 1 1 A 78 78 ASP C C 78 177.000 178.035 -1.035 1
1 886 . 4 1 1 A 78 78 ASP CA C 78 55.800 57.242 -1.442 1
1 887 . 4 1 1 A 78 78 ASP CB C 78 39.900 41.367 -1.467 1
1 888 . 4 1 1 A 78 78 ASP N N 78 116.400 120.642 -4.242 1
1 889 . 4 1 1 A 79 79 CYS H H 79 8.040 7.627 0.413 1
1 890 . 4 1 1 A 79 79 CYS HA H 79 4.110 4.369 -0.259 1
1 893 . 4 1 1 A 79 79 CYS C C 79 174.200 174.848 -0.648 1
1 894 . 4 1 1 A 79 79 CYS CA C 79 58.600 59.909 -1.309 1
1 895 . 4 1 1 A 79 79 CYS CB C 79 27.200 27.610 -0.410 1
1 896 . 4 1 1 A 79 79 CYS N N 79 117.000 114.472 2.528 1
1 897 . 4 1 1 A 80 80 ILE H H 80 6.960 7.077 -0.117 1
1 898 . 4 1 1 A 80 80 ILE HA H 80 4.120 4.086 0.034 1
1 908 . 4 1 1 A 80 80 ILE CA C 80 58.700 59.342 -0.642 1
1 909 . 4 1 1 A 80 80 ILE CB C 80 38.500 37.708 0.792 1
1 913 . 4 1 1 A 80 80 ILE N N 80 123.200 122.753 0.447 1
1 914 . 4 1 1 A 81 81 PRO HA H 81 4.340 4.328 0.012 1
1 921 . 4 1 1 A 81 81 PRO C C 81 178.000 176.315 1.685 1
1 922 . 4 1 1 A 81 81 PRO CA C 81 64.700 65.126 -0.426 1
1 923 . 4 1 1 A 81 81 PRO CB C 81 32.600 31.995 0.605 1
1 926 . 4 1 1 A 82 82 GLN H H 82 7.560 8.450 -0.890 1
1 927 . 4 1 1 A 82 82 GLN HA H 82 4.600 4.513 0.087 1
1 934 . 4 1 1 A 82 82 GLN C C 82 177.400 175.850 1.550 1
1 935 . 4 1 1 A 82 82 GLN CA C 82 55.600 55.106 0.494 1
1 936 . 4 1 1 A 82 82 GLN CB C 82 28.800 28.299 0.501 1
1 938 . 4 1 1 A 82 82 GLN N N 82 115.900 117.216 -1.316 1
1 940 . 4 1 1 A 83 83 THR H H 83 8.880 8.251 0.629 1
1 941 . 4 1 1 A 83 83 THR HA H 83 3.750 3.906 -0.156 1
1 946 . 4 1 1 A 83 83 THR C C 83 176.300 176.392 -0.092 1
1 947 . 4 1 1 A 83 83 THR CA C 83 66.500 66.321 0.179 1
1 948 . 4 1 1 A 83 83 THR CB C 83 68.700 68.767 -0.067 1
1 950 . 4 1 1 A 83 83 THR N N 83 122.700 119.651 3.049 1
1 951 . 4 1 1 A 84 84 ARG H H 84 8.990 8.192 0.798 1
1 952 . 4 1 1 A 84 84 ARG HA H 84 4.250 4.072 0.178 1
1 960 . 4 1 1 A 84 84 ARG C C 84 178.900 179.385 -0.485 1
1 961 . 4 1 1 A 84 84 ARG CA C 84 59.100 59.601 -0.501 1
1 962 . 4 1 1 A 84 84 ARG CB C 84 29.300 30.336 -1.036 1
1 965 . 4 1 1 A 84 84 ARG N N 84 120.100 121.663 -1.563 1
1 967 . 4 1 1 A 85 85 ASN H H 85 7.270 8.280 -1.010 1
1 968 . 4 1 1 A 85 85 ASN HA H 85 4.810 4.633 0.177 1
1 973 . 4 1 1 A 85 85 ASN C C 85 176.800 177.575 -0.775 1
1 974 . 4 1 1 A 85 85 ASN CA C 85 54.800 56.244 -1.444 1
1 975 . 4 1 1 A 85 85 ASN CB C 85 37.600 37.734 -0.134 1
1 976 . 4 1 1 A 85 85 ASN N N 85 117.400 118.255 -0.855 1
1 978 . 4 1 1 A 86 86 LYS H H 86 8.340 8.081 0.259 1
1 979 . 4 1 1 A 86 86 LYS HA H 86 3.890 4.072 -0.182 1
1 988 . 4 1 1 A 86 86 LYS C C 86 178.600 179.256 -0.656 1
1 989 . 4 1 1 A 86 86 LYS CA C 86 60.800 58.964 1.836 1
1 990 . 4 1 1 A 86 86 LYS CB C 86 32.700 32.098 0.602 1
1 994 . 4 1 1 A 86 86 LYS N N 86 124.200 120.771 3.429 1
1 995 . 4 1 1 A 87 87 PHE H H 87 8.120 8.845 -0.725 1
1 996 . 4 1 1 A 87 87 PHE HA H 87 4.260 4.121 0.139 1
1 1004 . 4 1 1 A 87 87 PHE C C 87 178.100 177.431 0.669 1
1 1005 . 4 1 1 A 87 87 PHE CA C 87 61.300 61.880 -0.580 1
1 1006 . 4 1 1 A 87 87 PHE CB C 87 38.200 39.297 -1.097 1
1 1010 . 4 1 1 A 87 87 PHE N N 87 118.300 121.278 -2.978 1
1 1011 . 4 1 1 A 88 88 ALA H H 88 7.860 8.324 -0.464 1
1 1012 . 4 1 1 A 88 88 ALA HA H 88 4.200 3.995 0.205 1
1 1016 . 4 1 1 A 88 88 ALA C C 88 180.600 179.294 1.306 1
1 1017 . 4 1 1 A 88 88 ALA CA C 88 54.900 55.214 -0.314 1
1 1018 . 4 1 1 A 88 88 ALA CB C 88 18.100 18.018 0.082 1
1 1019 . 4 1 1 A 88 88 ALA N N 88 121.700 120.935 0.765 1
1 1020 . 4 1 1 A 89 89 PHE H H 89 8.690 8.614 0.076 1
1 1021 . 4 1 1 A 89 89 PHE HA H 89 4.080 4.152 -0.072 1
1 1029 . 4 1 1 A 89 89 PHE C C 89 176.300 177.767 -1.467 1
1 1030 . 4 1 1 A 89 89 PHE CA C 89 62.000 61.534 0.466 1
1 1031 . 4 1 1 A 89 89 PHE CB C 89 39.800 39.417 0.383 1
1 1035 . 4 1 1 A 89 89 PHE N N 89 120.100 119.731 0.369 1
1 1036 . 4 1 1 A 90 90 ARG H H 90 8.560 8.057 0.503 1
1 1037 . 4 1 1 A 90 90 ARG HA H 90 3.790 3.852 -0.062 1
1 1045 . 4 1 1 A 90 90 ARG C C 90 179.600 178.650 0.950 1
1 1046 . 4 1 1 A 90 90 ARG CA C 90 60.000 59.479 0.521 1
1 1047 . 4 1 1 A 90 90 ARG CB C 90 30.000 30.025 -0.025 1
1 1050 . 4 1 1 A 90 90 ARG N N 90 118.000 118.194 -0.194 1
1 1052 . 4 1 1 A 91 91 GLU H H 91 8.120 8.211 -0.091 1
1 1053 . 4 1 1 A 91 91 GLU HA H 91 3.980 3.932 0.048 1
1 1058 . 4 1 1 A 91 91 GLU C C 91 178.400 178.625 -0.225 1
1 1059 . 4 1 1 A 91 91 GLU CA C 91 58.900 59.218 -0.318 1
1 1060 . 4 1 1 A 91 91 GLU CB C 91 28.800 28.829 -0.029 1
1 1062 . 4 1 1 A 91 91 GLU N N 91 119.300 118.066 1.234 1
1 1063 . 4 1 1 A 92 92 ALA H H 92 7.820 7.873 -0.053 1
1 1064 . 4 1 1 A 92 92 ALA HA H 92 4.050 3.996 0.054 1
1 1068 . 4 1 1 A 92 92 ALA C C 92 179.800 179.734 0.066 1
1 1069 . 4 1 1 A 92 92 ALA CA C 92 55.000 55.060 -0.060 1
1 1070 . 4 1 1 A 92 92 ALA CB C 92 18.000 18.288 -0.288 1
1 1071 . 4 1 1 A 92 92 ALA N N 92 123.400 122.655 0.745 1
1 1072 . 4 1 1 A 93 93 VAL H H 93 8.430 7.694 0.736 1
1 1073 . 4 1 1 A 93 93 VAL HA H 93 3.250 3.267 -0.017 1
1 1081 . 4 1 1 A 93 93 VAL C C 93 177.900 178.250 -0.350 1
1 1082 . 4 1 1 A 93 93 VAL CA C 93 66.800 66.641 0.159 1
1 1083 . 4 1 1 A 93 93 VAL CB C 93 31.300 31.201 0.099 1
1 1086 . 4 1 1 A 93 93 VAL N N 93 119.900 118.490 1.410 1
1 1087 . 4 1 1 A 94 94 SER H H 94 7.990 8.107 -0.117 1
1 1088 . 4 1 1 A 94 94 SER HA H 94 4.230 4.466 -0.236 1
1 1091 . 4 1 1 A 94 94 SER C C 94 177.200 176.117 1.083 1
1 1092 . 4 1 1 A 94 94 SER CA C 94 61.600 62.063 -0.463 1
1 1093 . 4 1 1 A 94 94 SER CB C 94 62.700 62.786 -0.086 1
1 1094 . 4 1 1 A 94 94 SER N N 94 116.000 116.276 -0.276 1
1 1095 . 4 1 1 A 95 95 LYS H H 95 7.710 7.191 0.519 1
1 1096 . 4 1 1 A 95 95 LYS HA H 95 4.020 4.150 -0.130 1
1 1105 . 4 1 1 A 95 95 LYS C C 95 179.400 179.137 0.263 1
1 1106 . 4 1 1 A 95 95 LYS CA C 95 59.600 58.897 0.703 1
1 1107 . 4 1 1 A 95 95 LYS CB C 95 32.300 32.221 0.079 1
1 1111 . 4 1 1 A 95 95 LYS N N 95 121.400 121.524 -0.124 1
1 1112 . 4 1 1 A 96 96 LEU H H 96 8.270 8.062 0.208 1
1 1113 . 4 1 1 A 96 96 LEU HA H 96 4.040 3.944 0.096 1
1 1123 . 4 1 1 A 96 96 LEU C C 96 177.700 178.243 -0.543 1
1 1124 . 4 1 1 A 96 96 LEU CA C 96 58.600 58.150 0.450 1
1 1125 . 4 1 1 A 96 96 LEU CB C 96 41.000 41.735 -0.735 1
1 1129 . 4 1 1 A 96 96 LEU N N 96 124.800 121.333 3.467 1
1 1130 . 4 1 1 A 97 97 GLU H H 97 8.500 8.518 -0.018 1
1 1131 . 4 1 1 A 97 97 GLU HA H 97 3.760 4.046 -0.286 1
1 1136 . 4 1 1 A 97 97 GLU C C 97 179.100 178.978 0.122 1
1 1137 . 4 1 1 A 97 97 GLU CA C 97 59.900 58.954 0.946 1
1 1138 . 4 1 1 A 97 97 GLU CB C 97 28.700 28.966 -0.266 1
1 1140 . 4 1 1 A 97 97 GLU N N 97 119.000 117.372 1.628 1
1 1141 . 4 1 1 A 98 98 LEU H H 98 7.740 7.770 -0.030 1
1 1142 . 4 1 1 A 98 98 LEU HA H 98 4.110 4.067 0.043 1
1 1152 . 4 1 1 A 98 98 LEU C C 98 179.700 178.326 1.374 1
1 1153 . 4 1 1 A 98 98 LEU CA C 98 57.900 58.107 -0.207 1
1 1154 . 4 1 1 A 98 98 LEU CB C 98 41.800 41.299 0.501 1
1 1158 . 4 1 1 A 98 98 LEU N N 98 119.200 122.839 -3.639 1
1 1159 . 4 1 1 A 99 99 SER H H 99 8.290 8.142 0.148 1
1 1160 . 4 1 1 A 99 99 SER HA H 99 4.220 4.212 0.008 1
1 1163 . 4 1 1 A 99 99 SER C C 99 176.600 177.774 -1.174 1
1 1164 . 4 1 1 A 99 99 SER CA C 99 62.400 61.577 0.823 1
1 1165 . 4 1 1 A 99 99 SER CB C 99 63.200 62.461 0.739 1
1 1166 . 4 1 1 A 99 99 SER N N 99 116.300 115.124 1.176 1
1 1167 . 4 1 1 A 100 100 LEU H H 100 8.490 8.544 -0.054 1
1 1168 . 4 1 1 A 100 100 LEU HA H 100 3.960 3.976 -0.016 1
1 1178 . 4 1 1 A 100 100 LEU C C 100 179.300 179.275 0.025 1
1 1179 . 4 1 1 A 100 100 LEU CA C 100 57.700 57.921 -0.221 1
1 1180 . 4 1 1 A 100 100 LEU CB C 100 41.300 41.448 -0.148 1
1 1184 . 4 1 1 A 100 100 LEU N N 100 120.900 123.001 -2.101 1
1 1185 . 4 1 1 A 101 101 GLN H H 101 7.680 8.700 -1.020 1
1 1186 . 4 1 1 A 101 101 GLN HA H 101 4.100 3.978 0.122 1
1 1193 . 4 1 1 A 101 101 GLN C C 101 178.700 177.827 0.873 1
1 1194 . 4 1 1 A 101 101 GLN CA C 101 58.800 58.893 -0.093 1
1 1195 . 4 1 1 A 101 101 GLN CB C 101 27.900 28.005 -0.105 1
1 1197 . 4 1 1 A 101 101 GLN N N 101 119.100 117.845 1.255 1
1 1199 . 4 1 1 A 102 102 GLU H H 102 7.850 7.950 -0.100 1
1 1200 . 4 1 1 A 102 102 GLU HA H 102 4.050 4.106 -0.056 1
1 1205 . 4 1 1 A 102 102 GLU C C 102 179.100 178.957 0.143 1
1 1206 . 4 1 1 A 102 102 GLU CA C 102 58.400 59.276 -0.876 1
1 1207 . 4 1 1 A 102 102 GLU CB C 102 28.600 29.096 -0.496 1
1 1209 . 4 1 1 A 102 102 GLU N N 102 118.400 118.621 -0.221 1
1 1210 . 4 1 1 A 103 103 LEU H H 103 8.080 8.253 -0.173 1
1 1211 . 4 1 1 A 103 103 LEU HA H 103 4.020 3.991 0.029 1
1 1221 . 4 1 1 A 103 103 LEU C C 103 178.200 178.334 -0.134 1
1 1222 . 4 1 1 A 103 103 LEU CA C 103 57.000 58.264 -1.264 1
1 1223 . 4 1 1 A 103 103 LEU CB C 103 41.900 41.901 -0.001 1
1 1227 . 4 1 1 A 103 103 LEU N N 103 120.600 123.472 -2.872 1
1 1228 . 4 1 1 A 104 104 GLN H H 104 7.900 8.240 -0.340 1
1 1229 . 4 1 1 A 104 104 GLN HA H 104 4.090 4.092 -0.002 1
1 1236 . 4 1 1 A 104 104 GLN C C 104 177.300 176.992 0.308 1
1 1237 . 4 1 1 A 104 104 GLN CA C 104 58.100 58.302 -0.202 1
1 1238 . 4 1 1 A 104 104 GLN CB C 104 29.400 27.671 1.729 1
1 1240 . 4 1 1 A 104 104 GLN N N 104 117.700 116.753 0.947 1
1 1242 . 4 1 1 A 105 105 VAL H H 105 7.620 7.412 0.208 1
1 1243 . 4 1 1 A 105 105 VAL HA H 105 4.190 4.118 0.072 1
1 1251 . 4 1 1 A 105 105 VAL C C 105 176.800 176.757 0.043 1
1 1252 . 4 1 1 A 105 105 VAL CA C 105 62.600 63.879 -1.279 1
1 1253 . 4 1 1 A 105 105 VAL CB C 105 32.000 32.472 -0.472 1
1 1256 . 4 1 1 A 105 105 VAL N N 105 114.900 116.717 -1.817 1
1 1257 . 4 1 1 A 106 106 SER H H 106 7.900 8.067 -0.167 1
1 1258 . 4 1 1 A 106 106 SER HA H 106 4.460 4.578 -0.118 1
1 1261 . 4 1 1 A 106 106 SER C C 106 175.000 175.751 -0.751 1
1 1262 . 4 1 1 A 106 106 SER CA C 106 58.900 57.402 1.498 1
1 1263 . 4 1 1 A 106 106 SER CB C 106 63.900 63.105 0.795 1
1 1264 . 4 1 1 A 106 106 SER N N 106 116.900 116.899 0.001 1
1 1265 . 4 1 1 A 107 107 SER H H 107 8.230 7.539 0.691 1
1 1266 . 4 1 1 A 107 107 SER HA H 107 4.390 4.061 0.329 1
1 1269 . 4 1 1 A 107 107 SER C C 107 174.600 174.733 -0.133 1
1 1270 . 4 1 1 A 107 107 SER CA C 107 58.400 62.241 -3.841 1
1 1271 . 4 1 1 A 107 107 SER CB C 107 63.600 63.004 0.596 1
1 1272 . 4 1 1 A 107 107 SER N N 107 117.500 116.105 1.395 1
1 1273 . 4 1 1 A 108 108 ALA H H 108 8.080 7.692 0.388 1
1 1274 . 4 1 1 A 108 108 ALA HA H 108 4.280 3.865 0.415 1
1 1278 . 4 1 1 A 108 108 ALA C C 108 177.500 178.525 -1.025 1
1 1279 . 4 1 1 A 108 108 ALA CA C 108 52.700 54.976 -2.276 1
1 1280 . 4 1 1 A 108 108 ALA CB C 108 19.200 17.808 1.392 1
1 1281 . 4 1 1 A 108 108 ALA N N 108 124.900 121.595 3.305 1
1 1282 . 4 1 1 A 109 109 ALA H H 109 8.080 8.560 -0.480 1
1 1283 . 4 1 1 A 109 109 ALA HA H 109 4.280 4.098 0.182 1
1 1287 . 4 1 1 A 109 109 ALA C C 109 177.700 178.184 -0.484 1
1 1288 . 4 1 1 A 109 109 ALA CA C 109 52.400 53.665 -1.265 1
1 1289 . 4 1 1 A 109 109 ALA CB C 109 19.400 19.414 -0.014 1
1 1290 . 4 1 1 A 109 109 ALA N N 109 123.000 120.263 2.737 1
1 1291 . 4 1 1 A 110 110 ALA H H 110 8.300 8.004 0.296 1
1 1292 . 4 1 1 A 110 110 ALA HA H 110 4.280 3.913 0.367 1
1 1296 . 4 1 1 A 110 110 ALA C C 110 178.200 177.201 0.999 1
1 1297 . 4 1 1 A 110 110 ALA CA C 110 52.700 55.188 -2.488 1
1 1298 . 4 1 1 A 110 110 ALA CB C 110 19.200 17.704 1.496 1
1 1299 . 4 1 1 A 110 110 ALA N N 110 123.200 118.419 4.781 1
1 1300 . 4 1 1 A 111 111 GLY H H 111 8.300 8.408 -0.108 1
1 1301 . 4 1 1 A 111 111 GLY HA2 H 111 3.930 4.097 -0.167 1
1 1302 . 4 1 1 A 111 111 GLY HA3 H 111 3.940 4.097 -0.157 1
1 1303 . 4 1 1 A 111 111 GLY C C 111 173.700 172.215 1.485 1
1 1304 . 4 1 1 A 111 111 GLY CA C 111 45.100 45.568 -0.468 1
1 1305 . 4 1 1 A 111 111 GLY N N 111 108.000 103.510 4.490 1
1 1306 . 4 1 1 A 112 112 VAL H H 112 7.930 7.961 -0.031 1
1 1307 . 4 1 1 A 112 112 VAL HA H 112 4.420 4.583 -0.163 1
1 1315 . 4 1 1 A 112 112 VAL CA C 112 60.000 58.968 1.032 1
1 1316 . 4 1 1 A 112 112 VAL CB C 112 32.200 35.395 -3.195 1
1 1319 . 4 1 1 A 112 112 VAL N N 112 120.400 125.098 -4.698 1
1 1320 . 4 1 1 A 113 113 PRO HA H 113 4.370 4.287 0.083 1
1 1327 . 4 1 1 A 113 113 PRO C C 113 177.300 177.936 -0.636 1
1 1328 . 4 1 1 A 113 113 PRO CA C 113 63.900 63.880 0.020 1
1 1329 . 4 1 1 A 113 113 PRO CB C 113 31.800 31.266 0.534 1
1 1332 . 4 1 1 A 114 114 GLY H H 114 8.570 8.765 -0.195 1
1 1333 . 4 1 1 A 114 114 GLY HA2 H 114 3.880 3.956 -0.076 1
1 1334 . 4 1 1 A 114 114 GLY HA3 H 114 4.120 3.956 0.164 1
1 1335 . 4 1 1 A 114 114 GLY C C 114 174.900 175.238 -0.338 1
1 1336 . 4 1 1 A 114 114 GLY CA C 114 45.200 45.659 -0.459 1
1 1337 . 4 1 1 A 114 114 GLY N N 114 109.000 113.281 -4.281 1
1 1338 . 4 1 1 A 115 115 THR H H 115 7.900 7.395 0.505 1
1 1339 . 4 1 1 A 115 115 THR HA H 115 4.400 4.049 0.351 1
1 1344 . 4 1 1 A 115 115 THR C C 115 174.300 173.687 0.613 1
1 1345 . 4 1 1 A 115 115 THR CA C 115 61.700 64.572 -2.872 1
1 1346 . 4 1 1 A 115 115 THR CB C 115 69.700 69.702 -0.002 1
1 1348 . 4 1 1 A 115 115 THR N N 115 111.400 115.686 -4.286 1
1 1349 . 4 1 1 A 116 116 ASN H H 116 8.450 7.970 0.480 1
1 1350 . 4 1 1 A 116 116 ASN HA H 116 4.970 5.129 -0.159 1
1 1355 . 4 1 1 A 116 116 ASN CA C 116 51.500 49.122 2.378 1
1 1356 . 4 1 1 A 116 116 ASN CB C 116 38.900 40.117 -1.217 1
1 1357 . 4 1 1 A 116 116 ASN N N 116 123.100 116.637 6.463 1
1 1359 . 4 1 1 A 117 117 PRO HA H 117 4.370 4.352 0.018 1
1 1366 . 4 1 1 A 117 117 PRO C C 117 178.400 178.106 0.294 1
1 1367 . 4 1 1 A 117 117 PRO CA C 117 64.800 64.672 0.128 1
1 1368 . 4 1 1 A 117 117 PRO CB C 117 32.100 31.880 0.220 1
1 1371 . 4 1 1 A 118 118 VAL H H 118 7.750 7.611 0.139 1
1 1372 . 4 1 1 A 118 118 VAL HA H 118 3.810 3.750 0.060 1
1 1380 . 4 1 1 A 118 118 VAL C C 118 178.300 178.254 0.046 1
1 1381 . 4 1 1 A 118 118 VAL CA C 118 65.200 65.513 -0.313 1
1 1382 . 4 1 1 A 118 118 VAL CB C 118 31.500 31.628 -0.128 1
1 1385 . 4 1 1 A 118 118 VAL N N 118 118.300 116.272 2.028 1
1 1386 . 4 1 1 A 119 119 LEU H H 119 7.540 8.140 -0.600 1
1 1387 . 4 1 1 A 119 119 LEU HA H 119 4.030 3.865 0.165 1
1 1397 . 4 1 1 A 119 119 LEU C C 119 178.900 179.660 -0.760 1
1 1398 . 4 1 1 A 119 119 LEU CA C 119 57.800 58.160 -0.360 1
1 1399 . 4 1 1 A 119 119 LEU CB C 119 40.700 41.306 -0.606 1
1 1403 . 4 1 1 A 119 119 LEU N N 119 119.700 120.271 -0.571 1
1 1404 . 4 1 1 A 120 120 ASN H H 120 8.080 8.318 -0.238 1
1 1405 . 4 1 1 A 120 120 ASN HA H 120 4.420 4.513 -0.093 1
1 1410 . 4 1 1 A 120 120 ASN C C 120 178.100 178.617 -0.517 1
1 1411 . 4 1 1 A 120 120 ASN CA C 120 56.100 56.603 -0.503 1
1 1412 . 4 1 1 A 120 120 ASN CB C 120 37.800 37.709 0.091 1
1 1413 . 4 1 1 A 120 120 ASN N N 120 117.700 117.889 -0.189 1
1 1415 . 4 1 1 A 121 121 ASN H H 121 8.120 7.908 0.212 1
1 1416 . 4 1 1 A 121 121 ASN HA H 121 4.490 4.534 -0.044 1
1 1421 . 4 1 1 A 121 121 ASN C C 121 178.000 178.308 -0.308 1
1 1422 . 4 1 1 A 121 121 ASN CA C 121 56.100 56.534 -0.434 1
1 1423 . 4 1 1 A 121 121 ASN CB C 121 37.800 38.130 -0.330 1
1 1424 . 4 1 1 A 121 121 ASN N N 121 120.000 118.463 1.537 1
1 1426 . 4 1 1 A 122 122 LEU H H 122 8.180 8.413 -0.233 1
1 1427 . 4 1 1 A 122 122 LEU HA H 122 4.050 3.918 0.132 1
1 1437 . 4 1 1 A 122 122 LEU C C 122 173.800 178.915 -5.115 1
1 1438 . 4 1 1 A 122 122 LEU CA C 122 58.500 57.932 0.568 1
1 1439 . 4 1 1 A 122 122 LEU CB C 122 41.900 41.885 0.015 1
1 1443 . 4 1 1 A 122 122 LEU N N 122 122.600 120.819 1.781 1
1 1444 . 4 1 1 A 123 123 LEU H H 123 8.260 7.984 0.276 1
1 1445 . 4 1 1 A 123 123 LEU HA H 123 3.850 3.965 -0.115 1
1 1455 . 4 1 1 A 123 123 LEU C C 123 178.900 178.477 0.423 1
1 1456 . 4 1 1 A 123 123 LEU CA C 123 58.500 58.163 0.337 1
1 1457 . 4 1 1 A 123 123 LEU CB C 123 41.200 41.315 -0.115 1
1 1461 . 4 1 1 A 123 123 LEU N N 123 119.700 120.483 -0.783 1
1 1462 . 4 1 1 A 124 124 SER H H 124 7.950 7.925 0.025 1
1 1463 . 4 1 1 A 124 124 SER HA H 124 4.240 4.101 0.139 1
1 1466 . 4 1 1 A 124 124 SER C C 124 177.500 177.230 0.270 1
1 1467 . 4 1 1 A 124 124 SER CA C 124 61.600 61.877 -0.277 1
1 1468 . 4 1 1 A 124 124 SER CB C 124 62.600 62.861 -0.261 1
1 1469 . 4 1 1 A 124 124 SER N N 124 113.400 114.004 -0.604 1
1 1470 . 4 1 1 A 125 125 CYS H H 125 8.040 8.321 -0.281 1
1 1471 . 4 1 1 A 125 125 CYS HA H 125 4.350 4.125 0.225 1
1 1474 . 4 1 1 A 125 125 CYS C C 125 176.800 176.908 -0.108 1
1 1475 . 4 1 1 A 125 125 CYS CA C 125 62.600 63.880 -1.280 1
1 1476 . 4 1 1 A 125 125 CYS CB C 125 27.100 26.971 0.129 1
1 1477 . 4 1 1 A 125 125 CYS N N 125 119.800 119.716 0.084 1
1 1478 . 4 1 1 A 126 126 VAL H H 126 8.290 8.571 -0.281 1
1 1479 . 4 1 1 A 126 126 VAL HA H 126 3.430 3.431 -0.001 1
1 1487 . 4 1 1 A 126 126 VAL C C 126 177.800 177.844 -0.044 1
1 1488 . 4 1 1 A 126 126 VAL CA C 126 67.100 66.873 0.227 1
1 1489 . 4 1 1 A 126 126 VAL CB C 126 31.400 31.476 -0.076 1
1 1492 . 4 1 1 A 126 126 VAL N N 126 121.900 120.635 1.265 1
1 1493 . 4 1 1 A 127 127 GLN H H 127 8.200 8.128 0.072 1
1 1494 . 4 1 1 A 127 127 GLN HA H 127 3.970 3.930 0.040 1
1 1501 . 4 1 1 A 127 127 GLN C C 127 178.200 178.340 -0.140 1
1 1502 . 4 1 1 A 127 127 GLN CA C 127 58.700 58.864 -0.164 1
1 1503 . 4 1 1 A 127 127 GLN CB C 127 27.800 28.556 -0.756 1
1 1505 . 4 1 1 A 127 127 GLN N N 127 119.700 118.149 1.551 1
1 1507 . 4 1 1 A 128 128 GLU H H 128 7.880 8.063 -0.183 1
1 1508 . 4 1 1 A 128 128 GLU HA H 128 4.200 4.041 0.159 1
1 1513 . 4 1 1 A 128 128 GLU C C 128 178.400 178.729 -0.329 1
1 1514 . 4 1 1 A 128 128 GLU CA C 128 59.000 59.092 -0.092 1
1 1515 . 4 1 1 A 128 128 GLU CB C 128 28.400 29.479 -1.079 1
1 1517 . 4 1 1 A 128 128 GLU N N 128 119.800 119.714 0.086 1
1 1518 . 4 1 1 A 129 129 ILE H H 129 8.000 8.402 -0.402 1
1 1519 . 4 1 1 A 129 129 ILE HA H 129 3.460 3.618 -0.158 1
1 1529 . 4 1 1 A 129 129 ILE C C 129 176.800 177.945 -1.145 1
1 1530 . 4 1 1 A 129 129 ILE CA C 129 66.100 65.533 0.567 1
1 1531 . 4 1 1 A 129 129 ILE CB C 129 38.200 37.396 0.804 1
1 1535 . 4 1 1 A 129 129 ILE N N 129 119.500 120.172 -0.672 1
1 1536 . 4 1 1 A 130 130 SER H H 130 8.040 8.155 -0.115 1
1 1537 . 4 1 1 A 130 130 SER HA H 130 3.780 4.060 -0.280 1
1 1540 . 4 1 1 A 130 130 SER C C 130 176.200 175.758 0.442 1
1 1541 . 4 1 1 A 130 130 SER CA C 130 62.100 62.045 0.055 1
1 1542 . 4 1 1 A 130 130 SER CB C 130 62.600 62.887 -0.287 1
1 1543 . 4 1 1 A 130 130 SER N N 130 112.800 115.967 -3.167 1
1 1544 . 4 1 1 A 131 131 ASP H H 131 8.270 8.409 -0.139 1
1 1545 . 4 1 1 A 131 131 ASP HA H 131 4.310 4.577 -0.267 1
1 1548 . 4 1 1 A 131 131 ASP C C 131 179.200 178.576 0.624 1
1 1549 . 4 1 1 A 131 131 ASP CA C 131 56.800 57.820 -1.020 1
1 1550 . 4 1 1 A 131 131 ASP CB C 131 40.900 41.638 -0.738 1
1 1551 . 4 1 1 A 131 131 ASP N N 131 119.600 122.397 -2.797 1
1 1552 . 4 1 1 A 132 132 VAL H H 132 8.470 8.127 0.343 1
1 1553 . 4 1 1 A 132 132 VAL HA H 132 3.520 3.700 -0.180 1
1 1561 . 4 1 1 A 132 132 VAL C C 132 178.700 178.723 -0.023 1
1 1562 . 4 1 1 A 132 132 VAL CA C 132 66.500 66.759 -0.259 1
1 1563 . 4 1 1 A 132 132 VAL CB C 132 31.500 31.689 -0.189 1
1 1566 . 4 1 1 A 132 132 VAL N N 132 118.100 118.985 -0.885 1
1 1567 . 4 1 1 A 133 133 VAL H H 133 8.140 8.287 -0.147 1
1 1568 . 4 1 1 A 133 133 VAL HA H 133 3.770 3.697 0.073 1
1 1576 . 4 1 1 A 133 133 VAL C C 133 176.500 178.460 -1.960 1
1 1577 . 4 1 1 A 133 133 VAL CA C 133 65.100 66.861 -1.761 1
1 1578 . 4 1 1 A 133 133 VAL CB C 133 31.600 31.335 0.265 1
1 1581 . 4 1 1 A 133 133 VAL N N 133 117.000 120.650 -3.650 1
1 1582 . 4 1 1 A 134 134 GLN H H 134 7.490 8.082 -0.592 1
1 1583 . 4 1 1 A 134 134 GLN HA H 134 4.350 4.292 0.058 1
1 1590 . 4 1 1 A 134 134 GLN C C 134 175.400 176.665 -1.265 1
1 1591 . 4 1 1 A 134 134 GLN CA C 134 56.700 57.682 -0.982 1
1 1592 . 4 1 1 A 134 134 GLN CB C 134 30.500 28.410 2.090 1
1 1594 . 4 1 1 A 134 134 GLN N N 134 116.300 118.932 -2.632 1
1 1 . 5 1 1 A 2 2 GLY HA2 H 2 3.890 4.031 -0.141 1
1 2 . 5 1 1 A 2 2 GLY HA3 H 2 3.890 4.176 -0.286 1
1 3 . 5 1 1 A 2 2 GLY C C 2 174.200 172.259 1.941 1
1 4 . 5 1 1 A 2 2 GLY CA C 2 44.700 45.447 -0.747 1
1 5 . 5 1 1 A 3 3 HIS H H 3 8.380 8.439 -0.059 1
1 6 . 5 1 1 A 3 3 HIS HA H 3 4.610 4.671 -0.061 1
1 9 . 5 1 1 A 3 3 HIS C C 3 174.500 174.693 -0.193 1
1 10 . 5 1 1 A 3 3 HIS CA C 3 55.200 56.366 -1.166 1
1 11 . 5 1 1 A 3 3 HIS CB C 3 28.800 29.372 -0.572 1
1 12 . 5 1 1 A 3 3 HIS N N 3 117.600 119.648 -2.048 1
1 13 . 5 1 1 A 4 4 HIS H H 4 8.520 9.032 -0.512 1
1 14 . 5 1 1 A 4 4 HIS HA H 4 4.640 4.817 -0.177 1
1 17 . 5 1 1 A 4 4 HIS C C 4 174.200 175.429 -1.229 1
1 18 . 5 1 1 A 4 4 HIS CA C 4 55.100 53.837 1.263 1
1 19 . 5 1 1 A 4 4 HIS CB C 4 28.900 32.477 -3.577 1
1 20 . 5 1 1 A 4 4 HIS N N 4 119.000 121.706 -2.706 1
1 21 . 5 1 1 A 5 5 HIS H H 5 8.530 8.808 -0.278 1
1 22 . 5 1 1 A 5 5 HIS HA H 5 4.410 4.395 0.015 1
1 25 . 5 1 1 A 5 5 HIS CA C 5 54.900 57.861 -2.961 1
1 26 . 5 1 1 A 5 5 HIS CB C 5 27.300 29.788 -2.488 1
1 27 . 5 1 1 A 5 5 HIS N N 5 121.600 124.277 -2.677 1
1 28 . 5 1 1 A 6 6 HIS HA H 6 4.640 4.819 -0.179 1
1 31 . 5 1 1 A 6 6 HIS C C 6 174.100 175.919 -1.819 1
1 32 . 5 1 1 A 6 6 HIS CA C 6 55.100 55.532 -0.432 1
1 33 . 5 1 1 A 6 6 HIS CB C 6 29.100 30.309 -1.209 1
1 34 . 5 1 1 A 7 7 HIS H H 7 8.690 7.869 0.821 1
1 35 . 5 1 1 A 7 7 HIS HA H 7 4.650 4.539 0.111 1
1 38 . 5 1 1 A 7 7 HIS C C 7 174.200 175.186 -0.986 1
1 39 . 5 1 1 A 7 7 HIS CA C 7 55.200 56.369 -1.169 1
1 40 . 5 1 1 A 7 7 HIS CB C 7 29.300 29.929 -0.629 1
1 41 . 5 1 1 A 7 7 HIS N N 7 121.400 116.456 4.944 1
1 42 . 5 1 1 A 8 8 HIS H H 8 8.660 7.782 0.878 1
1 43 . 5 1 1 A 8 8 HIS HA H 8 4.700 4.764 -0.064 1
1 46 . 5 1 1 A 8 8 HIS C C 8 174.200 173.664 0.536 1
1 47 . 5 1 1 A 8 8 HIS CA C 8 55.000 54.547 0.453 1
1 48 . 5 1 1 A 8 8 HIS CB C 8 29.300 29.733 -0.433 1
1 49 . 5 1 1 A 8 8 HIS N N 8 120.400 121.089 -0.689 1
1 50 . 5 1 1 A 9 9 SER H H 9 8.490 8.288 0.202 1
1 51 . 5 1 1 A 9 9 SER HA H 9 4.390 4.527 -0.137 1
1 54 . 5 1 1 A 9 9 SER C C 9 174.100 173.614 0.486 1
1 55 . 5 1 1 A 9 9 SER CA C 9 58.300 56.962 1.338 1
1 56 . 5 1 1 A 9 9 SER CB C 9 63.700 64.059 -0.359 1
1 57 . 5 1 1 A 9 9 SER N N 9 118.100 124.123 -6.023 1
1 58 . 5 1 1 A 10 10 HIS H H 10 8.710 8.159 0.551 1
1 59 . 5 1 1 A 10 10 HIS HA H 10 4.690 4.357 0.333 1
1 63 . 5 1 1 A 10 10 HIS C C 10 174.200 174.823 -0.623 1
1 64 . 5 1 1 A 10 10 HIS CA C 10 55.200 55.502 -0.302 1
1 65 . 5 1 1 A 10 10 HIS CB C 10 28.800 30.608 -1.808 1
1 66 . 5 1 1 A 10 10 HIS N N 10 120.700 124.490 -3.790 1
1 67 . 5 1 1 A 11 11 MET H H 11 8.410 8.764 -0.354 1
1 68 . 5 1 1 A 11 11 MET HA H 11 4.420 4.740 -0.320 1
1 76 . 5 1 1 A 11 11 MET C C 11 175.800 177.213 -1.413 1
1 77 . 5 1 1 A 11 11 MET CA C 11 55.100 54.382 0.718 1
1 78 . 5 1 1 A 11 11 MET CB C 11 32.800 31.920 0.880 1
1 81 . 5 1 1 A 11 11 MET N N 11 122.300 120.652 1.648 1
1 82 . 5 1 1 A 12 12 ALA H H 12 8.440 8.414 0.026 1
1 83 . 5 1 1 A 12 12 ALA HA H 12 4.280 4.376 -0.096 1
1 87 . 5 1 1 A 12 12 ALA C C 12 177.400 177.559 -0.159 1
1 88 . 5 1 1 A 12 12 ALA CA C 12 52.400 51.674 0.726 1
1 89 . 5 1 1 A 12 12 ALA CB C 12 18.800 20.871 -2.071 1
1 90 . 5 1 1 A 12 12 ALA N N 12 125.900 125.836 0.064 1
1 91 . 5 1 1 A 13 13 ASN H H 13 8.440 8.666 -0.226 1
1 92 . 5 1 1 A 13 13 ASN HA H 13 4.660 4.276 0.384 1
1 97 . 5 1 1 A 13 13 ASN C C 13 175.900 176.247 -0.347 1
1 98 . 5 1 1 A 13 13 ASN CA C 13 53.200 55.165 -1.965 1
1 99 . 5 1 1 A 13 13 ASN CB C 13 38.800 37.941 0.859 1
1 100 . 5 1 1 A 13 13 ASN N N 13 118.300 117.350 0.950 1
1 102 . 5 1 1 A 14 14 GLY H H 14 8.370 8.924 -0.554 1
1 103 . 5 1 1 A 14 14 GLY HA2 H 14 3.920 4.009 -0.089 1
1 104 . 5 1 1 A 14 14 GLY HA3 H 14 3.920 4.009 -0.089 1
1 105 . 5 1 1 A 14 14 GLY C C 14 174.000 174.710 -0.710 1
1 106 . 5 1 1 A 14 14 GLY CA C 14 45.200 44.984 0.216 1
1 107 . 5 1 1 A 14 14 GLY N N 14 109.600 111.878 -2.278 1
1 108 . 5 1 1 A 15 15 ALA H H 15 8.140 7.488 0.652 1
1 109 . 5 1 1 A 15 15 ALA HA H 15 4.280 4.463 -0.183 1
1 113 . 5 1 1 A 15 15 ALA C C 15 177.300 177.949 -0.649 1
1 114 . 5 1 1 A 15 15 ALA CA C 15 52.500 51.659 0.841 1
1 115 . 5 1 1 A 15 15 ALA CB C 15 19.100 19.884 -0.784 1
1 116 . 5 1 1 A 15 15 ALA N N 15 123.800 123.909 -0.109 1
1 117 . 5 1 1 A 16 16 ALA H H 16 8.030 8.700 -0.670 1
1 118 . 5 1 1 A 16 16 ALA HA H 16 4.280 4.072 0.208 1
1 122 . 5 1 1 A 16 16 ALA C C 16 178.400 177.733 0.667 1
1 123 . 5 1 1 A 16 16 ALA CA C 16 52.600 53.893 -1.293 1
1 124 . 5 1 1 A 16 16 ALA CB C 16 19.100 18.108 0.992 1
1 125 . 5 1 1 A 16 16 ALA N N 16 122.300 119.965 2.335 1
1 126 . 5 1 1 A 17 17 GLY H H 17 8.320 8.044 0.276 1
1 127 . 5 1 1 A 17 17 GLY HA2 H 17 3.960 4.000 -0.040 1
1 128 . 5 1 1 A 17 17 GLY HA3 H 17 3.960 4.000 -0.040 1
1 129 . 5 1 1 A 17 17 GLY C C 17 174.500 175.679 -1.179 1
1 130 . 5 1 1 A 17 17 GLY CA C 17 45.200 45.434 -0.234 1
1 131 . 5 1 1 A 17 17 GLY N N 17 107.800 105.627 2.173 1
1 132 . 5 1 1 A 18 18 THR H H 18 7.970 7.733 0.237 1
1 133 . 5 1 1 A 18 18 THR HA H 18 4.290 4.009 0.281 1
1 138 . 5 1 1 A 18 18 THR C C 18 174.600 176.852 -2.252 1
1 139 . 5 1 1 A 18 18 THR CA C 18 62.000 66.468 -4.468 1
1 140 . 5 1 1 A 18 18 THR CB C 18 69.700 68.639 1.061 1
1 142 . 5 1 1 A 18 18 THR N N 18 113.800 117.451 -3.651 1
1 143 . 5 1 1 A 19 19 LYS H H 19 8.350 8.285 0.065 1
1 144 . 5 1 1 A 19 19 LYS HA H 19 4.270 4.093 0.177 1
1 153 . 5 1 1 A 19 19 LYS C C 19 176.600 177.825 -1.225 1
1 154 . 5 1 1 A 19 19 LYS CA C 19 56.500 58.924 -2.424 1
1 155 . 5 1 1 A 19 19 LYS CB C 19 32.800 32.152 0.648 1
1 159 . 5 1 1 A 19 19 LYS N N 19 124.000 119.796 4.204 1
1 160 . 5 1 1 A 20 20 VAL H H 20 8.060 7.704 0.356 1
1 161 . 5 1 1 A 20 20 VAL HA H 20 3.990 4.177 -0.187 1
1 169 . 5 1 1 A 20 20 VAL C C 20 175.900 176.816 -0.916 1
1 170 . 5 1 1 A 20 20 VAL CA C 20 62.400 62.499 -0.099 1
1 171 . 5 1 1 A 20 20 VAL CB C 20 32.600 32.373 0.227 1
1 174 . 5 1 1 A 20 20 VAL N N 20 121.700 118.206 3.494 1
1 175 . 5 1 1 A 21 21 ALA H H 21 8.310 7.625 0.685 1
1 176 . 5 1 1 A 21 21 ALA HA H 21 4.290 4.306 -0.016 1
1 180 . 5 1 1 A 21 21 ALA C C 21 177.600 179.948 -2.348 1
1 181 . 5 1 1 A 21 21 ALA CA C 21 52.400 54.092 -1.692 1
1 182 . 5 1 1 A 21 21 ALA CB C 21 19.000 19.010 -0.010 1
1 183 . 5 1 1 A 21 21 ALA N N 21 127.700 123.695 4.005 1
1 184 . 5 1 1 A 22 22 LEU H H 22 8.150 7.718 0.432 1
1 185 . 5 1 1 A 22 22 LEU HA H 22 4.280 4.107 0.173 1
1 195 . 5 1 1 A 22 22 LEU C C 22 177.400 176.504 0.896 1
1 196 . 5 1 1 A 22 22 LEU CA C 22 55.200 57.135 -1.935 1
1 197 . 5 1 1 A 22 22 LEU CB C 22 42.200 42.187 0.013 1
1 201 . 5 1 1 A 22 22 LEU N N 22 121.800 119.030 2.770 1
1 202 . 5 1 1 A 23 23 ARG H H 23 8.240 7.794 0.446 1
1 203 . 5 1 1 A 23 23 ARG HA H 23 4.290 4.017 0.273 1
1 211 . 5 1 1 A 23 23 ARG C C 23 176.300 175.846 0.454 1
1 212 . 5 1 1 A 23 23 ARG CA C 23 56.000 57.372 -1.372 1
1 213 . 5 1 1 A 23 23 ARG CB C 23 30.600 26.963 3.637 1
1 216 . 5 1 1 A 23 23 ARG N N 23 122.000 115.647 6.353 1
1 218 . 5 1 1 A 24 24 LYS H H 24 8.370 8.016 0.354 1
1 219 . 5 1 1 A 24 24 LYS HA H 24 4.330 4.269 0.061 1
1 228 . 5 1 1 A 24 24 LYS C C 24 176.800 176.603 0.197 1
1 229 . 5 1 1 A 24 24 LYS CA C 24 56.400 57.606 -1.206 1
1 230 . 5 1 1 A 24 24 LYS CB C 24 32.700 33.052 -0.352 1
1 234 . 5 1 1 A 24 24 LYS N N 24 122.900 117.904 4.996 1
1 235 . 5 1 1 A 25 25 THR H H 25 8.100 7.533 0.567 1
1 236 . 5 1 1 A 25 25 THR HA H 25 4.290 4.732 -0.442 1
1 241 . 5 1 1 A 25 25 THR C C 25 174.600 174.608 -0.008 1
1 242 . 5 1 1 A 25 25 THR CA C 25 61.500 59.966 1.534 1
1 243 . 5 1 1 A 25 25 THR CB C 25 69.800 70.658 -0.858 1
1 245 . 5 1 1 A 25 25 THR N N 25 115.500 110.384 5.116 1
1 246 . 5 1 1 A 26 26 LYS H H 26 8.370 8.735 -0.365 1
1 247 . 5 1 1 A 26 26 LYS HA H 26 4.270 4.275 -0.005 1
1 256 . 5 1 1 A 26 26 LYS C C 26 176.600 177.898 -1.298 1
1 257 . 5 1 1 A 26 26 LYS CA C 26 56.600 56.690 -0.090 1
1 258 . 5 1 1 A 26 26 LYS CB C 26 32.700 32.417 0.283 1
1 262 . 5 1 1 A 26 26 LYS N N 26 123.700 124.008 -0.308 1
1 263 . 5 1 1 A 27 27 GLN H H 27 8.390 8.966 -0.576 1
1 264 . 5 1 1 A 27 27 GLN HA H 27 4.240 4.458 -0.218 1
1 271 . 5 1 1 A 27 27 GLN C C 27 175.900 176.252 -0.352 1
1 272 . 5 1 1 A 27 27 GLN CA C 27 56.100 56.706 -0.606 1
1 273 . 5 1 1 A 27 27 GLN CB C 27 29.300 29.663 -0.363 1
1 275 . 5 1 1 A 27 27 GLN N N 27 121.700 121.955 -0.255 1
1 277 . 5 1 1 A 28 28 ALA H H 28 8.330 7.707 0.623 1
1 278 . 5 1 1 A 28 28 ALA HA H 28 4.240 4.480 -0.240 1
1 282 . 5 1 1 A 28 28 ALA C C 28 177.700 177.228 0.472 1
1 283 . 5 1 1 A 28 28 ALA CA C 28 52.500 51.260 1.240 1
1 284 . 5 1 1 A 28 28 ALA CB C 28 19.100 22.307 -3.207 1
1 285 . 5 1 1 A 28 28 ALA N N 28 125.400 119.591 5.809 1
1 286 . 5 1 1 A 29 29 ALA H H 29 8.250 8.862 -0.612 1
1 287 . 5 1 1 A 29 29 ALA HA H 29 4.230 3.971 0.259 1
1 291 . 5 1 1 A 29 29 ALA C C 29 178.000 179.597 -1.597 1
1 292 . 5 1 1 A 29 29 ALA CA C 29 52.500 55.162 -2.662 1
1 293 . 5 1 1 A 29 29 ALA CB C 29 19.100 18.395 0.705 1
1 294 . 5 1 1 A 29 29 ALA N N 29 123.000 123.349 -0.349 1
1 295 . 5 1 1 A 30 30 GLU H H 30 8.260 8.321 -0.061 1
1 296 . 5 1 1 A 30 30 GLU HA H 30 4.220 4.041 0.179 1
1 301 . 5 1 1 A 30 30 GLU C C 30 176.500 178.449 -1.949 1
1 302 . 5 1 1 A 30 30 GLU CA C 30 56.400 59.546 -3.146 1
1 303 . 5 1 1 A 30 30 GLU CB C 30 29.500 29.381 0.119 1
1 305 . 5 1 1 A 30 30 GLU N N 30 119.700 118.256 1.444 1
1 306 . 5 1 1 A 31 31 LYS H H 31 8.230 7.383 0.847 1
1 307 . 5 1 1 A 31 31 LYS HA H 31 4.280 4.316 -0.036 1
1 316 . 5 1 1 A 31 31 LYS C C 31 176.500 177.096 -0.596 1
1 317 . 5 1 1 A 31 31 LYS CA C 31 56.400 57.203 -0.803 1
1 318 . 5 1 1 A 31 31 LYS CB C 31 32.800 33.433 -0.633 1
1 322 . 5 1 1 A 31 31 LYS N N 31 122.700 116.898 5.802 1
1 323 . 5 1 1 A 32 32 ILE H H 32 8.140 7.709 0.431 1
1 324 . 5 1 1 A 32 32 ILE HA H 32 4.110 4.110 0.000 1
1 334 . 5 1 1 A 32 32 ILE C C 32 176.400 177.855 -1.455 1
1 335 . 5 1 1 A 32 32 ILE CA C 32 61.200 61.924 -0.724 1
1 336 . 5 1 1 A 32 32 ILE CB C 32 38.600 36.931 1.669 1
1 340 . 5 1 1 A 32 32 ILE N N 32 122.300 121.009 1.291 1
1 341 . 5 1 1 A 33 33 SER H H 33 8.230 8.949 -0.719 1
1 342 . 5 1 1 A 33 33 SER HA H 33 4.400 3.976 0.424 1
1 345 . 5 1 1 A 33 33 SER C C 33 174.800 176.191 -1.391 1
1 346 . 5 1 1 A 33 33 SER CA C 33 58.300 61.918 -3.618 1
1 347 . 5 1 1 A 33 33 SER CB C 33 63.700 62.466 1.234 1
1 348 . 5 1 1 A 33 33 SER N N 33 119.600 123.318 -3.718 1
1 349 . 5 1 1 A 34 34 ALA H H 34 8.430 8.210 0.220 1
1 350 . 5 1 1 A 34 34 ALA HA H 34 4.220 4.009 0.211 1
1 354 . 5 1 1 A 34 34 ALA C C 34 179.500 179.392 0.108 1
1 355 . 5 1 1 A 34 34 ALA CA C 34 53.500 55.235 -1.735 1
1 356 . 5 1 1 A 34 34 ALA CB C 34 18.800 18.520 0.280 1
1 357 . 5 1 1 A 34 34 ALA N N 34 126.000 123.379 2.621 1
1 358 . 5 1 1 A 35 35 ASP H H 35 8.380 7.766 0.614 1
1 359 . 5 1 1 A 35 35 ASP HA H 35 4.520 4.312 0.208 1
1 362 . 5 1 1 A 35 35 ASP C C 35 176.500 178.623 -2.123 1
1 363 . 5 1 1 A 35 35 ASP CA C 35 54.800 56.687 -1.887 1
1 364 . 5 1 1 A 35 35 ASP CB C 35 40.200 40.728 -0.528 1
1 365 . 5 1 1 A 35 35 ASP N N 35 118.200 118.178 0.022 1
1 366 . 5 1 1 A 36 36 LYS H H 36 8.000 7.849 0.151 1
1 367 . 5 1 1 A 36 36 LYS HA H 36 4.270 4.074 0.196 1
1 376 . 5 1 1 A 36 36 LYS C C 36 177.000 177.028 -0.028 1
1 377 . 5 1 1 A 36 36 LYS CA C 36 56.800 58.926 -2.126 1
1 378 . 5 1 1 A 36 36 LYS CB C 36 32.900 31.731 1.169 1
1 382 . 5 1 1 A 36 36 LYS N N 36 120.900 118.463 2.437 1
1 383 . 5 1 1 A 37 37 ILE H H 37 7.970 7.648 0.322 1
1 384 . 5 1 1 A 37 37 ILE HA H 37 4.020 4.091 -0.071 1
1 394 . 5 1 1 A 37 37 ILE C C 37 176.100 174.994 1.106 1
1 395 . 5 1 1 A 37 37 ILE CA C 37 61.300 61.212 0.088 1
1 396 . 5 1 1 A 37 37 ILE CB C 37 38.100 36.775 1.325 1
1 400 . 5 1 1 A 37 37 ILE N N 37 121.800 120.883 0.917 1
1 401 . 5 1 1 A 38 38 SER H H 38 7.980 8.701 -0.721 1
1 402 . 5 1 1 A 38 38 SER HA H 38 4.540 4.588 -0.048 1
1 405 . 5 1 1 A 38 38 SER C C 38 174.700 175.462 -0.762 1
1 406 . 5 1 1 A 38 38 SER CA C 38 58.200 58.324 -0.124 1
1 407 . 5 1 1 A 38 38 SER CB C 38 64.400 64.189 0.211 1
1 408 . 5 1 1 A 38 38 SER N N 38 119.000 124.118 -5.118 1
1 409 . 5 1 1 A 39 39 LYS H H 39 8.690 9.003 -0.313 1
1 410 . 5 1 1 A 39 39 LYS HA H 39 3.400 3.817 -0.417 1
1 419 . 5 1 1 A 39 39 LYS C C 39 177.400 178.153 -0.753 1
1 420 . 5 1 1 A 39 39 LYS CA C 39 59.800 60.506 -0.706 1
1 421 . 5 1 1 A 39 39 LYS CB C 39 32.400 32.309 0.091 1
1 425 . 5 1 1 A 39 39 LYS N N 39 124.200 125.296 -1.096 1
1 426 . 5 1 1 A 40 40 GLU H H 40 8.280 8.377 -0.097 1
1 427 . 5 1 1 A 40 40 GLU HA H 40 3.840 4.097 -0.257 1
1 432 . 5 1 1 A 40 40 GLU C C 40 178.400 178.839 -0.439 1
1 433 . 5 1 1 A 40 40 GLU CA C 40 59.400 59.240 0.160 1
1 434 . 5 1 1 A 40 40 GLU CB C 40 28.300 29.508 -1.208 1
1 436 . 5 1 1 A 40 40 GLU N N 40 116.300 117.392 -1.092 1
1 437 . 5 1 1 A 41 41 ALA H H 41 7.890 7.880 0.010 1
1 438 . 5 1 1 A 41 41 ALA HA H 41 3.910 4.133 -0.223 1
1 442 . 5 1 1 A 41 41 ALA C C 41 179.900 180.171 -0.271 1
1 443 . 5 1 1 A 41 41 ALA CA C 41 54.700 55.311 -0.611 1
1 444 . 5 1 1 A 41 41 ALA CB C 41 17.900 18.327 -0.427 1
1 445 . 5 1 1 A 41 41 ALA N N 41 122.300 122.396 -0.096 1
1 446 . 5 1 1 A 42 42 LEU H H 42 7.490 7.968 -0.478 1
1 447 . 5 1 1 A 42 42 LEU HA H 42 3.480 4.074 -0.594 1
1 457 . 5 1 1 A 42 42 LEU C C 42 178.900 178.624 0.276 1
1 458 . 5 1 1 A 42 42 LEU CA C 42 59.800 57.892 1.908 1
1 459 . 5 1 1 A 42 42 LEU CB C 42 42.300 41.535 0.765 1
1 463 . 5 1 1 A 42 42 LEU N N 42 121.000 119.354 1.646 1
1 464 . 5 1 1 A 43 43 LEU H H 43 8.290 8.083 0.207 1
1 465 . 5 1 1 A 43 43 LEU HA H 43 3.780 3.860 -0.080 1
1 475 . 5 1 1 A 43 43 LEU C C 43 179.400 179.276 0.124 1
1 476 . 5 1 1 A 43 43 LEU CA C 43 57.600 57.991 -0.391 1
1 477 . 5 1 1 A 43 43 LEU CB C 43 40.900 41.312 -0.412 1
1 481 . 5 1 1 A 43 43 LEU N N 43 119.200 118.162 1.038 1
1 482 . 5 1 1 A 44 44 GLU H H 44 8.330 8.267 0.063 1
1 483 . 5 1 1 A 44 44 GLU HA H 44 4.050 4.009 0.041 1
1 488 . 5 1 1 A 44 44 GLU C C 44 178.600 179.491 -0.891 1
1 489 . 5 1 1 A 44 44 GLU CA C 44 58.900 59.144 -0.244 1
1 490 . 5 1 1 A 44 44 GLU CB C 44 28.300 29.825 -1.525 1
1 492 . 5 1 1 A 44 44 GLU N N 44 119.600 118.282 1.318 1
1 493 . 5 1 1 A 45 45 CYS H H 45 7.690 8.087 -0.397 1
1 494 . 5 1 1 A 45 45 CYS HA H 45 4.120 4.024 0.096 1
1 497 . 5 1 1 A 45 45 CYS C C 45 176.100 176.963 -0.863 1
1 498 . 5 1 1 A 45 45 CYS CA C 45 62.500 62.956 -0.456 1
1 499 . 5 1 1 A 45 45 CYS CB C 45 26.200 26.389 -0.189 1
1 500 . 5 1 1 A 45 45 CYS N N 45 120.900 118.750 2.150 1
1 501 . 5 1 1 A 46 46 ALA H H 46 8.540 7.846 0.694 1
1 502 . 5 1 1 A 46 46 ALA HA H 46 3.900 4.004 -0.104 1
1 506 . 5 1 1 A 46 46 ALA C C 46 179.200 179.074 0.126 1
1 507 . 5 1 1 A 46 46 ALA CA C 46 55.500 55.229 0.271 1
1 508 . 5 1 1 A 46 46 ALA CB C 46 16.800 18.339 -1.539 1
1 509 . 5 1 1 A 46 46 ALA N N 46 121.500 122.034 -0.534 1
1 510 . 5 1 1 A 47 47 ASP H H 47 8.460 8.155 0.305 1
1 511 . 5 1 1 A 47 47 ASP HA H 47 4.340 4.341 -0.001 1
1 514 . 5 1 1 A 47 47 ASP C C 47 178.800 178.670 0.130 1
1 515 . 5 1 1 A 47 47 ASP CA C 47 56.600 57.169 -0.569 1
1 516 . 5 1 1 A 47 47 ASP CB C 47 39.800 42.141 -2.341 1
1 517 . 5 1 1 A 47 47 ASP N N 47 119.000 118.463 0.537 1
1 518 . 5 1 1 A 48 48 LEU H H 48 8.040 7.685 0.355 1
1 519 . 5 1 1 A 48 48 LEU HA H 48 4.110 3.860 0.250 1
1 529 . 5 1 1 A 48 48 LEU C C 48 180.000 179.100 0.900 1
1 530 . 5 1 1 A 48 48 LEU CA C 48 58.000 57.903 0.097 1
1 531 . 5 1 1 A 48 48 LEU CB C 48 41.700 41.732 -0.032 1
1 535 . 5 1 1 A 48 48 LEU N N 48 123.000 119.373 3.627 1
1 536 . 5 1 1 A 49 49 LEU H H 49 8.300 7.871 0.429 1
1 537 . 5 1 1 A 49 49 LEU HA H 49 4.110 3.977 0.133 1
1 547 . 5 1 1 A 49 49 LEU C C 49 177.200 179.029 -1.829 1
1 548 . 5 1 1 A 49 49 LEU CA C 49 57.600 57.790 -0.190 1
1 549 . 5 1 1 A 49 49 LEU CB C 49 41.200 41.309 -0.109 1
1 553 . 5 1 1 A 49 49 LEU N N 49 120.900 118.224 2.676 1
1 554 . 5 1 1 A 50 50 SER H H 50 8.660 7.864 0.796 1
1 555 . 5 1 1 A 50 50 SER HA H 50 4.000 4.059 -0.059 1
1 558 . 5 1 1 A 50 50 SER C C 50 176.800 177.320 -0.520 1
1 559 . 5 1 1 A 50 50 SER CA C 50 62.500 61.698 0.802 1
1 560 . 5 1 1 A 50 50 SER CB C 50 62.600 62.958 -0.358 1
1 561 . 5 1 1 A 50 50 SER N N 50 113.300 114.712 -1.412 1
1 562 . 5 1 1 A 51 51 SER H H 51 7.980 8.283 -0.303 1
1 563 . 5 1 1 A 51 51 SER HA H 51 4.220 4.217 0.003 1
1 566 . 5 1 1 A 51 51 SER C C 51 176.300 177.160 -0.860 1
1 567 . 5 1 1 A 51 51 SER CA C 51 61.200 61.571 -0.371 1
1 568 . 5 1 1 A 51 51 SER CB C 51 62.700 62.847 -0.147 1
1 569 . 5 1 1 A 51 51 SER N N 51 115.900 115.284 0.616 1
1 570 . 5 1 1 A 52 52 ALA H H 52 8.030 8.183 -0.153 1
1 571 . 5 1 1 A 52 52 ALA HA H 52 4.130 4.205 -0.075 1
1 575 . 5 1 1 A 52 52 ALA C C 52 178.500 179.590 -1.090 1
1 576 . 5 1 1 A 52 52 ALA CA C 52 54.500 54.941 -0.441 1
1 577 . 5 1 1 A 52 52 ALA CB C 52 18.000 18.249 -0.249 1
1 578 . 5 1 1 A 52 52 ALA N N 52 125.400 123.113 2.287 1
1 579 . 5 1 1 A 53 53 LEU H H 53 7.710 8.055 -0.345 1
1 580 . 5 1 1 A 53 53 LEU HA H 53 4.180 4.168 0.012 1
1 590 . 5 1 1 A 53 53 LEU C C 53 177.700 177.829 -0.129 1
1 591 . 5 1 1 A 53 53 LEU CA C 53 56.500 56.327 0.173 1
1 592 . 5 1 1 A 53 53 LEU CB C 53 42.400 42.141 0.259 1
1 596 . 5 1 1 A 53 53 LEU N N 53 113.800 117.750 -3.950 1
1 597 . 5 1 1 A 54 54 THR H H 54 7.550 7.578 -0.028 1
1 598 . 5 1 1 A 54 54 THR HA H 54 4.420 4.498 -0.078 1
1 603 . 5 1 1 A 54 54 THR C C 54 174.100 173.290 0.810 1
1 604 . 5 1 1 A 54 54 THR CA C 54 61.600 61.963 -0.363 1
1 605 . 5 1 1 A 54 54 THR CB C 54 69.300 69.278 0.022 1
1 607 . 5 1 1 A 54 54 THR N N 54 107.700 105.800 1.900 1
1 608 . 5 1 1 A 55 55 GLU H H 55 7.750 7.738 0.012 1
1 609 . 5 1 1 A 55 55 GLU HA H 55 4.760 4.913 -0.153 1
1 614 . 5 1 1 A 55 55 GLU CA C 55 53.400 54.021 -0.621 1
1 615 . 5 1 1 A 55 55 GLU CB C 55 30.100 32.617 -2.517 1
1 617 . 5 1 1 A 55 55 GLU N N 55 122.800 118.969 3.831 1
1 618 . 5 1 1 A 56 56 PRO HA H 56 4.670 4.739 -0.069 1
1 625 . 5 1 1 A 56 56 PRO C C 56 176.200 176.429 -0.229 1
1 626 . 5 1 1 A 56 56 PRO CA C 56 62.900 62.959 -0.059 1
1 627 . 5 1 1 A 56 56 PRO CB C 56 29.200 31.658 -2.458 1
1 630 . 5 1 1 A 57 57 VAL H H 57 8.010 8.371 -0.361 1
1 631 . 5 1 1 A 57 57 VAL HA H 57 4.590 4.943 -0.353 1
1 639 . 5 1 1 A 57 57 VAL CA C 57 58.600 58.273 0.327 1
1 640 . 5 1 1 A 57 57 VAL CB C 57 32.800 34.846 -2.046 1
1 643 . 5 1 1 A 57 57 VAL N N 57 121.400 117.384 4.016 1
1 644 . 5 1 1 A 58 58 PRO HA H 58 4.450 4.974 -0.524 1
1 651 . 5 1 1 A 58 58 PRO C C 58 177.500 177.937 -0.437 1
1 652 . 5 1 1 A 58 58 PRO CA C 58 62.600 62.915 -0.315 1
1 653 . 5 1 1 A 58 58 PRO CB C 58 32.200 32.167 0.033 1
1 656 . 5 1 1 A 59 59 ASN H H 59 8.890 9.203 -0.313 1
1 657 . 5 1 1 A 59 59 ASN HA H 59 4.330 4.455 -0.125 1
1 662 . 5 1 1 A 59 59 ASN C C 59 177.600 177.022 0.578 1
1 663 . 5 1 1 A 59 59 ASN CA C 59 56.300 56.078 0.222 1
1 664 . 5 1 1 A 59 59 ASN CB C 59 38.400 38.196 0.204 1
1 665 . 5 1 1 A 59 59 ASN N N 59 122.200 123.750 -1.550 1
1 667 . 5 1 1 A 60 60 SER H H 60 8.660 8.320 0.340 1
1 668 . 5 1 1 A 60 60 SER HA H 60 4.010 4.122 -0.112 1
1 671 . 5 1 1 A 60 60 SER C C 60 176.200 176.153 0.047 1
1 672 . 5 1 1 A 60 60 SER CA C 60 60.800 61.273 -0.473 1
1 673 . 5 1 1 A 60 60 SER CB C 60 61.500 62.809 -1.309 1
1 674 . 5 1 1 A 60 60 SER N N 60 113.200 115.455 -2.255 1
1 675 . 5 1 1 A 61 61 GLN H H 61 7.420 8.096 -0.676 1
1 676 . 5 1 1 A 61 61 GLN HA H 61 4.280 4.011 0.269 1
1 683 . 5 1 1 A 61 61 GLN C C 61 178.600 178.371 0.229 1
1 684 . 5 1 1 A 61 61 GLN CA C 61 57.900 59.072 -1.172 1
1 685 . 5 1 1 A 61 61 GLN CB C 61 28.600 27.975 0.625 1
1 687 . 5 1 1 A 61 61 GLN N N 61 122.200 121.304 0.896 1
1 689 . 5 1 1 A 62 62 LEU H H 62 7.430 7.823 -0.393 1
1 690 . 5 1 1 A 62 62 LEU HA H 62 3.850 4.045 -0.195 1
1 700 . 5 1 1 A 62 62 LEU C C 62 178.800 179.223 -0.423 1
1 701 . 5 1 1 A 62 62 LEU CA C 62 57.900 58.077 -0.177 1
1 702 . 5 1 1 A 62 62 LEU CB C 62 42.100 41.934 0.166 1
1 706 . 5 1 1 A 62 62 LEU N N 62 120.600 119.969 0.631 1
1 707 . 5 1 1 A 63 63 VAL H H 63 8.200 8.109 0.091 1
1 708 . 5 1 1 A 63 63 VAL HA H 63 3.370 3.506 -0.136 1
1 716 . 5 1 1 A 63 63 VAL C C 63 178.000 177.917 0.083 1
1 717 . 5 1 1 A 63 63 VAL CA C 63 66.600 67.023 -0.423 1
1 718 . 5 1 1 A 63 63 VAL CB C 63 31.700 31.427 0.273 1
1 721 . 5 1 1 A 63 63 VAL N N 63 118.200 118.001 0.199 1
1 722 . 5 1 1 A 64 64 ASP H H 64 7.960 8.465 -0.505 1
1 723 . 5 1 1 A 64 64 ASP HA H 64 4.460 4.284 0.176 1
1 726 . 5 1 1 A 64 64 ASP C C 64 178.100 178.614 -0.514 1
1 727 . 5 1 1 A 64 64 ASP CA C 64 57.700 57.539 0.161 1
1 728 . 5 1 1 A 64 64 ASP CB C 64 39.800 41.122 -1.322 1
1 729 . 5 1 1 A 64 64 ASP N N 64 120.200 120.141 0.059 1
1 730 . 5 1 1 A 65 65 THR H H 65 8.380 8.405 -0.025 1
1 731 . 5 1 1 A 65 65 THR HA H 65 3.970 4.045 -0.075 1
1 736 . 5 1 1 A 65 65 THR C C 65 176.500 177.192 -0.692 1
1 737 . 5 1 1 A 65 65 THR CA C 65 66.500 66.921 -0.421 1
1 738 . 5 1 1 A 65 65 THR CB C 65 67.800 67.399 0.401 1
1 740 . 5 1 1 A 65 65 THR N N 65 118.100 116.624 1.476 1
1 741 . 5 1 1 A 66 66 GLY H H 66 8.900 8.114 0.786 1
1 742 . 5 1 1 A 66 66 GLY HA2 H 66 3.630 3.759 -0.129 1
1 743 . 5 1 1 A 66 66 GLY HA3 H 66 3.630 3.776 -0.146 1
1 744 . 5 1 1 A 66 66 GLY C C 66 174.200 175.731 -1.531 1
1 745 . 5 1 1 A 66 66 GLY CA C 66 47.500 47.021 0.479 1
1 746 . 5 1 1 A 66 66 GLY N N 66 110.500 107.993 2.507 1
1 747 . 5 1 1 A 67 67 HIS H H 67 8.650 8.129 0.521 1
1 748 . 5 1 1 A 67 67 HIS HA H 67 4.220 4.142 0.078 1
1 752 . 5 1 1 A 67 67 HIS C C 67 176.900 177.449 -0.549 1
1 753 . 5 1 1 A 67 67 HIS CA C 67 59.000 59.342 -0.342 1
1 754 . 5 1 1 A 67 67 HIS CB C 67 27.800 29.666 -1.866 1
1 756 . 5 1 1 A 67 67 HIS N N 67 120.100 122.142 -2.042 1
1 757 . 5 1 1 A 68 68 GLN H H 68 7.860 7.889 -0.029 1
1 758 . 5 1 1 A 68 68 GLN HA H 68 3.990 4.059 -0.069 1
1 765 . 5 1 1 A 68 68 GLN C C 68 177.800 178.316 -0.516 1
1 766 . 5 1 1 A 68 68 GLN CA C 68 58.800 58.610 0.190 1
1 767 . 5 1 1 A 68 68 GLN CB C 68 28.200 28.122 0.078 1
1 769 . 5 1 1 A 68 68 GLN N N 68 121.400 117.136 4.264 1
1 771 . 5 1 1 A 69 69 LEU H H 69 8.300 7.550 0.750 1
1 772 . 5 1 1 A 69 69 LEU HA H 69 4.330 4.007 0.323 1
1 782 . 5 1 1 A 69 69 LEU C C 69 179.300 179.362 -0.062 1
1 783 . 5 1 1 A 69 69 LEU CA C 69 58.200 58.215 -0.015 1
1 784 . 5 1 1 A 69 69 LEU CB C 69 40.500 41.357 -0.857 1
1 788 . 5 1 1 A 69 69 LEU N N 69 120.300 121.708 -1.408 1
1 789 . 5 1 1 A 70 70 LEU H H 70 8.460 7.847 0.613 1
1 790 . 5 1 1 A 70 70 LEU HA H 70 3.880 3.950 -0.070 1
1 800 . 5 1 1 A 70 70 LEU C C 70 179.100 179.260 -0.160 1
1 801 . 5 1 1 A 70 70 LEU CA C 70 58.300 57.951 0.349 1
1 802 . 5 1 1 A 70 70 LEU CB C 70 41.500 41.196 0.304 1
1 806 . 5 1 1 A 70 70 LEU N N 70 121.200 118.929 2.271 1
1 807 . 5 1 1 A 71 71 ASP H H 71 8.140 8.058 0.082 1
1 808 . 5 1 1 A 71 71 ASP HA H 71 4.420 4.334 0.086 1
1 811 . 5 1 1 A 71 71 ASP C C 71 180.000 178.314 1.686 1
1 812 . 5 1 1 A 71 71 ASP CA C 71 57.300 57.405 -0.105 1
1 813 . 5 1 1 A 71 71 ASP CB C 71 39.300 41.283 -1.983 1
1 814 . 5 1 1 A 71 71 ASP N N 71 121.100 119.661 1.439 1
1 815 . 5 1 1 A 72 72 TYR H H 72 8.320 8.120 0.200 1
1 816 . 5 1 1 A 72 72 TYR HA H 72 4.550 4.460 0.090 1
1 823 . 5 1 1 A 72 72 TYR C C 72 179.100 178.257 0.843 1
1 824 . 5 1 1 A 72 72 TYR CA C 72 60.500 60.393 0.107 1
1 825 . 5 1 1 A 72 72 TYR CB C 72 37.600 37.290 0.310 1
1 828 . 5 1 1 A 72 72 TYR N N 72 120.300 117.831 2.469 1
1 829 . 5 1 1 A 73 73 CYS H H 73 8.850 8.723 0.127 1
1 830 . 5 1 1 A 73 73 CYS HA H 73 4.380 4.599 -0.219 1
1 834 . 5 1 1 A 73 73 CYS C C 73 177.300 177.095 0.205 1
1 835 . 5 1 1 A 73 73 CYS CA C 73 64.400 63.593 0.807 1
1 836 . 5 1 1 A 73 73 CYS CB C 73 27.600 27.799 -0.199 1
1 837 . 5 1 1 A 73 73 CYS N N 73 116.800 118.974 -2.174 1
1 838 . 5 1 1 A 74 74 SER H H 74 8.410 8.665 -0.255 1
1 839 . 5 1 1 A 74 74 SER HA H 74 4.290 4.226 0.064 1
1 842 . 5 1 1 A 74 74 SER C C 74 176.300 177.012 -0.712 1
1 843 . 5 1 1 A 74 74 SER CA C 74 61.400 61.374 0.026 1
1 844 . 5 1 1 A 74 74 SER CB C 74 62.600 62.405 0.195 1
1 845 . 5 1 1 A 74 74 SER N N 74 115.900 116.961 -1.061 1
1 846 . 5 1 1 A 75 75 GLY H H 75 7.790 8.412 -0.622 1
1 847 . 5 1 1 A 75 75 GLY HA2 H 75 4.320 3.605 0.715 1
1 848 . 5 1 1 A 75 75 GLY HA3 H 75 3.900 3.607 0.293 1
1 849 . 5 1 1 A 75 75 GLY C C 75 174.600 175.283 -0.683 1
1 850 . 5 1 1 A 75 75 GLY CA C 75 45.600 47.261 -1.661 1
1 851 . 5 1 1 A 75 75 GLY N N 75 107.500 109.816 -2.316 1
1 852 . 5 1 1 A 76 76 TYR H H 76 8.040 8.146 -0.106 1
1 853 . 5 1 1 A 76 76 TYR HA H 76 4.310 3.951 0.359 1
1 860 . 5 1 1 A 76 76 TYR C C 76 176.200 177.494 -1.294 1
1 861 . 5 1 1 A 76 76 TYR CA C 76 60.000 61.035 -1.035 1
1 862 . 5 1 1 A 76 76 TYR CB C 76 40.700 38.514 2.186 1
1 865 . 5 1 1 A 76 76 TYR N N 76 121.900 123.302 -1.402 1
1 866 . 5 1 1 A 77 77 VAL H H 77 7.540 8.018 -0.478 1
1 867 . 5 1 1 A 77 77 VAL HA H 77 3.450 3.253 0.197 1
1 875 . 5 1 1 A 77 77 VAL C C 77 175.500 176.962 -1.462 1
1 876 . 5 1 1 A 77 77 VAL CA C 77 65.500 64.298 1.202 1
1 877 . 5 1 1 A 77 77 VAL CB C 77 31.600 30.894 0.706 1
1 880 . 5 1 1 A 77 77 VAL N N 77 116.600 119.201 -2.601 1
1 881 . 5 1 1 A 78 78 ASP H H 78 7.580 7.685 -0.105 1
1 882 . 5 1 1 A 78 78 ASP HA H 78 4.380 4.347 0.033 1
1 885 . 5 1 1 A 78 78 ASP C C 78 177.000 177.091 -0.091 1
1 886 . 5 1 1 A 78 78 ASP CA C 78 55.800 56.397 -0.597 1
1 887 . 5 1 1 A 78 78 ASP CB C 78 39.900 40.732 -0.832 1
1 888 . 5 1 1 A 78 78 ASP N N 78 116.400 120.650 -4.250 1
1 889 . 5 1 1 A 79 79 CYS H H 79 8.040 7.615 0.425 1
1 890 . 5 1 1 A 79 79 CYS HA H 79 4.110 4.472 -0.362 1
1 893 . 5 1 1 A 79 79 CYS C C 79 174.200 173.480 0.720 1
1 894 . 5 1 1 A 79 79 CYS CA C 79 58.600 58.002 0.598 1
1 895 . 5 1 1 A 79 79 CYS CB C 79 27.200 27.803 -0.603 1
1 896 . 5 1 1 A 79 79 CYS N N 79 117.000 115.326 1.674 1
1 897 . 5 1 1 A 80 80 ILE H H 80 6.960 7.232 -0.272 1
1 898 . 5 1 1 A 80 80 ILE HA H 80 4.120 4.189 -0.069 1
1 908 . 5 1 1 A 80 80 ILE CA C 80 58.700 58.008 0.692 1
1 909 . 5 1 1 A 80 80 ILE CB C 80 38.500 37.510 0.990 1
1 913 . 5 1 1 A 80 80 ILE N N 80 123.200 122.433 0.767 1
1 914 . 5 1 1 A 81 81 PRO HA H 81 4.340 4.423 -0.083 1
1 921 . 5 1 1 A 81 81 PRO C C 81 178.000 176.419 1.581 1
1 922 . 5 1 1 A 81 81 PRO CA C 81 64.700 64.655 0.045 1
1 923 . 5 1 1 A 81 81 PRO CB C 81 32.600 32.016 0.584 1
1 926 . 5 1 1 A 82 82 GLN H H 82 7.560 8.052 -0.492 1
1 927 . 5 1 1 A 82 82 GLN HA H 82 4.600 4.484 0.116 1
1 934 . 5 1 1 A 82 82 GLN C C 82 177.400 175.884 1.516 1
1 935 . 5 1 1 A 82 82 GLN CA C 82 55.600 55.830 -0.230 1
1 936 . 5 1 1 A 82 82 GLN CB C 82 28.800 29.132 -0.332 1
1 938 . 5 1 1 A 82 82 GLN N N 82 115.900 117.994 -2.094 1
1 940 . 5 1 1 A 83 83 THR H H 83 8.880 8.449 0.431 1
1 941 . 5 1 1 A 83 83 THR HA H 83 3.750 3.960 -0.210 1
1 946 . 5 1 1 A 83 83 THR C C 83 176.300 176.360 -0.060 1
1 947 . 5 1 1 A 83 83 THR CA C 83 66.500 66.341 0.159 1
1 948 . 5 1 1 A 83 83 THR CB C 83 68.700 68.782 -0.082 1
1 950 . 5 1 1 A 83 83 THR N N 83 122.700 119.852 2.848 1
1 951 . 5 1 1 A 84 84 ARG H H 84 8.990 8.194 0.796 1
1 952 . 5 1 1 A 84 84 ARG HA H 84 4.250 4.044 0.206 1
1 960 . 5 1 1 A 84 84 ARG C C 84 178.900 179.027 -0.127 1
1 961 . 5 1 1 A 84 84 ARG CA C 84 59.100 59.650 -0.550 1
1 962 . 5 1 1 A 84 84 ARG CB C 84 29.300 30.221 -0.921 1
1 965 . 5 1 1 A 84 84 ARG N N 84 120.100 121.331 -1.231 1
1 967 . 5 1 1 A 85 85 ASN H H 85 7.270 8.394 -1.124 1
1 968 . 5 1 1 A 85 85 ASN HA H 85 4.810 4.673 0.137 1
1 973 . 5 1 1 A 85 85 ASN C C 85 176.800 177.730 -0.930 1
1 974 . 5 1 1 A 85 85 ASN CA C 85 54.800 56.224 -1.424 1
1 975 . 5 1 1 A 85 85 ASN CB C 85 37.600 38.192 -0.592 1
1 976 . 5 1 1 A 85 85 ASN N N 85 117.400 118.088 -0.688 1
1 978 . 5 1 1 A 86 86 LYS H H 86 8.340 8.142 0.198 1
1 979 . 5 1 1 A 86 86 LYS HA H 86 3.890 4.096 -0.206 1
1 988 . 5 1 1 A 86 86 LYS C C 86 178.600 179.072 -0.472 1
1 989 . 5 1 1 A 86 86 LYS CA C 86 60.800 59.083 1.717 1
1 990 . 5 1 1 A 86 86 LYS CB C 86 32.700 32.125 0.575 1
1 994 . 5 1 1 A 86 86 LYS N N 86 124.200 120.922 3.278 1
1 995 . 5 1 1 A 87 87 PHE H H 87 8.120 8.906 -0.786 1
1 996 . 5 1 1 A 87 87 PHE HA H 87 4.260 4.200 0.060 1
1 1004 . 5 1 1 A 87 87 PHE C C 87 178.100 177.367 0.733 1
1 1005 . 5 1 1 A 87 87 PHE CA C 87 61.300 61.686 -0.386 1
1 1006 . 5 1 1 A 87 87 PHE CB C 87 38.200 39.222 -1.022 1
1 1010 . 5 1 1 A 87 87 PHE N N 87 118.300 121.125 -2.825 1
1 1011 . 5 1 1 A 88 88 ALA H H 88 7.860 8.118 -0.258 1
1 1012 . 5 1 1 A 88 88 ALA HA H 88 4.200 4.245 -0.045 1
1 1016 . 5 1 1 A 88 88 ALA C C 88 180.600 179.654 0.946 1
1 1017 . 5 1 1 A 88 88 ALA CA C 88 54.900 55.169 -0.269 1
1 1018 . 5 1 1 A 88 88 ALA CB C 88 18.100 17.710 0.390 1
1 1019 . 5 1 1 A 88 88 ALA N N 88 121.700 120.896 0.804 1
1 1020 . 5 1 1 A 89 89 PHE H H 89 8.690 8.382 0.308 1
1 1021 . 5 1 1 A 89 89 PHE HA H 89 4.080 4.122 -0.042 1
1 1029 . 5 1 1 A 89 89 PHE C C 89 176.300 177.660 -1.360 1
1 1030 . 5 1 1 A 89 89 PHE CA C 89 62.000 61.303 0.697 1
1 1031 . 5 1 1 A 89 89 PHE CB C 89 39.800 39.294 0.506 1
1 1035 . 5 1 1 A 89 89 PHE N N 89 120.100 120.079 0.021 1
1 1036 . 5 1 1 A 90 90 ARG H H 90 8.560 8.341 0.219 1
1 1037 . 5 1 1 A 90 90 ARG HA H 90 3.790 3.960 -0.170 1
1 1045 . 5 1 1 A 90 90 ARG C C 90 179.600 178.487 1.113 1
1 1046 . 5 1 1 A 90 90 ARG CA C 90 60.000 59.663 0.337 1
1 1047 . 5 1 1 A 90 90 ARG CB C 90 30.000 30.246 -0.246 1
1 1050 . 5 1 1 A 90 90 ARG N N 90 118.000 118.318 -0.318 1
1 1052 . 5 1 1 A 91 91 GLU H H 91 8.120 8.167 -0.047 1
1 1053 . 5 1 1 A 91 91 GLU HA H 91 3.980 3.929 0.051 1
1 1058 . 5 1 1 A 91 91 GLU C C 91 178.400 179.067 -0.667 1
1 1059 . 5 1 1 A 91 91 GLU CA C 91 58.900 59.341 -0.441 1
1 1060 . 5 1 1 A 91 91 GLU CB C 91 28.800 29.001 -0.201 1
1 1062 . 5 1 1 A 91 91 GLU N N 91 119.300 118.216 1.084 1
1 1063 . 5 1 1 A 92 92 ALA H H 92 7.820 7.961 -0.141 1
1 1064 . 5 1 1 A 92 92 ALA HA H 92 4.050 3.952 0.098 1
1 1068 . 5 1 1 A 92 92 ALA C C 92 179.800 179.977 -0.177 1
1 1069 . 5 1 1 A 92 92 ALA CA C 92 55.000 55.171 -0.171 1
1 1070 . 5 1 1 A 92 92 ALA CB C 92 18.000 18.085 -0.085 1
1 1071 . 5 1 1 A 92 92 ALA N N 92 123.400 122.069 1.331 1
1 1072 . 5 1 1 A 93 93 VAL H H 93 8.430 8.018 0.412 1
1 1073 . 5 1 1 A 93 93 VAL HA H 93 3.250 3.351 -0.101 1
1 1081 . 5 1 1 A 93 93 VAL C C 93 177.900 178.171 -0.271 1
1 1082 . 5 1 1 A 93 93 VAL CA C 93 66.800 66.881 -0.081 1
1 1083 . 5 1 1 A 93 93 VAL CB C 93 31.300 31.514 -0.214 1
1 1086 . 5 1 1 A 93 93 VAL N N 93 119.900 118.388 1.512 1
1 1087 . 5 1 1 A 94 94 SER H H 94 7.990 8.277 -0.287 1
1 1088 . 5 1 1 A 94 94 SER HA H 94 4.230 4.113 0.117 1
1 1091 . 5 1 1 A 94 94 SER C C 94 177.200 176.348 0.852 1
1 1092 . 5 1 1 A 94 94 SER CA C 94 61.600 62.342 -0.742 1
1 1093 . 5 1 1 A 94 94 SER CB C 94 62.700 62.775 -0.075 1
1 1094 . 5 1 1 A 94 94 SER N N 94 116.000 115.914 0.086 1
1 1095 . 5 1 1 A 95 95 LYS H H 95 7.710 7.495 0.215 1
1 1096 . 5 1 1 A 95 95 LYS HA H 95 4.020 4.120 -0.100 1
1 1105 . 5 1 1 A 95 95 LYS C C 95 179.400 178.959 0.441 1
1 1106 . 5 1 1 A 95 95 LYS CA C 95 59.600 59.071 0.529 1
1 1107 . 5 1 1 A 95 95 LYS CB C 95 32.300 32.364 -0.064 1
1 1111 . 5 1 1 A 95 95 LYS N N 95 121.400 122.214 -0.814 1
1 1112 . 5 1 1 A 96 96 LEU H H 96 8.270 8.015 0.255 1
1 1113 . 5 1 1 A 96 96 LEU HA H 96 4.040 3.947 0.093 1
1 1123 . 5 1 1 A 96 96 LEU C C 96 177.700 178.265 -0.565 1
1 1124 . 5 1 1 A 96 96 LEU CA C 96 58.600 58.222 0.378 1
1 1125 . 5 1 1 A 96 96 LEU CB C 96 41.000 41.715 -0.715 1
1 1129 . 5 1 1 A 96 96 LEU N N 96 124.800 121.186 3.614 1
1 1130 . 5 1 1 A 97 97 GLU H H 97 8.500 8.405 0.095 1
1 1131 . 5 1 1 A 97 97 GLU HA H 97 3.760 4.083 -0.323 1
1 1136 . 5 1 1 A 97 97 GLU C C 97 179.100 179.129 -0.029 1
1 1137 . 5 1 1 A 97 97 GLU CA C 97 59.900 58.954 0.946 1
1 1138 . 5 1 1 A 97 97 GLU CB C 97 28.700 29.398 -0.698 1
1 1140 . 5 1 1 A 97 97 GLU N N 97 119.000 117.354 1.646 1
1 1141 . 5 1 1 A 98 98 LEU H H 98 7.740 7.955 -0.215 1
1 1142 . 5 1 1 A 98 98 LEU HA H 98 4.110 3.993 0.117 1
1 1152 . 5 1 1 A 98 98 LEU C C 98 179.700 179.089 0.611 1
1 1153 . 5 1 1 A 98 98 LEU CA C 98 57.900 57.805 0.095 1
1 1154 . 5 1 1 A 98 98 LEU CB C 98 41.800 41.518 0.282 1
1 1158 . 5 1 1 A 98 98 LEU N N 98 119.200 121.577 -2.377 1
1 1159 . 5 1 1 A 99 99 SER H H 99 8.290 8.033 0.257 1
1 1160 . 5 1 1 A 99 99 SER HA H 99 4.220 4.472 -0.252 1
1 1163 . 5 1 1 A 99 99 SER C C 99 176.600 176.765 -0.165 1
1 1164 . 5 1 1 A 99 99 SER CA C 99 62.400 62.406 -0.006 1
1 1165 . 5 1 1 A 99 99 SER CB C 99 63.200 62.749 0.451 1
1 1166 . 5 1 1 A 99 99 SER N N 99 116.300 113.590 2.710 1
1 1167 . 5 1 1 A 100 100 LEU H H 100 8.490 8.230 0.260 1
1 1168 . 5 1 1 A 100 100 LEU HA H 100 3.960 4.003 -0.043 1
1 1178 . 5 1 1 A 100 100 LEU C C 100 179.300 179.482 -0.182 1
1 1179 . 5 1 1 A 100 100 LEU CA C 100 57.700 57.986 -0.286 1
1 1180 . 5 1 1 A 100 100 LEU CB C 100 41.300 41.134 0.166 1
1 1184 . 5 1 1 A 100 100 LEU N N 100 120.900 122.587 -1.687 1
1 1185 . 5 1 1 A 101 101 GLN H H 101 7.680 8.567 -0.887 1
1 1186 . 5 1 1 A 101 101 GLN HA H 101 4.100 3.987 0.113 1
1 1193 . 5 1 1 A 101 101 GLN C C 101 178.700 177.809 0.891 1
1 1194 . 5 1 1 A 101 101 GLN CA C 101 58.800 58.899 -0.099 1
1 1195 . 5 1 1 A 101 101 GLN CB C 101 27.900 27.822 0.078 1
1 1197 . 5 1 1 A 101 101 GLN N N 101 119.100 118.226 0.874 1
1 1199 . 5 1 1 A 102 102 GLU H H 102 7.850 8.240 -0.390 1
1 1200 . 5 1 1 A 102 102 GLU HA H 102 4.050 4.109 -0.059 1
1 1205 . 5 1 1 A 102 102 GLU C C 102 179.100 178.940 0.160 1
1 1206 . 5 1 1 A 102 102 GLU CA C 102 58.400 59.295 -0.895 1
1 1207 . 5 1 1 A 102 102 GLU CB C 102 28.600 29.064 -0.464 1
1 1209 . 5 1 1 A 102 102 GLU N N 102 118.400 118.912 -0.512 1
1 1210 . 5 1 1 A 103 103 LEU H H 103 8.080 8.321 -0.241 1
1 1211 . 5 1 1 A 103 103 LEU HA H 103 4.020 3.983 0.037 1
1 1221 . 5 1 1 A 103 103 LEU C C 103 178.200 178.216 -0.016 1
1 1222 . 5 1 1 A 103 103 LEU CA C 103 57.000 58.611 -1.611 1
1 1223 . 5 1 1 A 103 103 LEU CB C 103 41.900 41.768 0.132 1
1 1227 . 5 1 1 A 103 103 LEU N N 103 120.600 123.328 -2.728 1
1 1228 . 5 1 1 A 104 104 GLN H H 104 7.900 8.259 -0.359 1
1 1229 . 5 1 1 A 104 104 GLN HA H 104 4.090 4.118 -0.028 1
1 1236 . 5 1 1 A 104 104 GLN C C 104 177.300 176.904 0.396 1
1 1237 . 5 1 1 A 104 104 GLN CA C 104 58.100 58.159 -0.059 1
1 1238 . 5 1 1 A 104 104 GLN CB C 104 29.400 27.836 1.564 1
1 1240 . 5 1 1 A 104 104 GLN N N 104 117.700 116.759 0.941 1
1 1242 . 5 1 1 A 105 105 VAL H H 105 7.620 7.389 0.231 1
1 1243 . 5 1 1 A 105 105 VAL HA H 105 4.190 4.191 -0.001 1
1 1251 . 5 1 1 A 105 105 VAL C C 105 176.800 177.217 -0.417 1
1 1252 . 5 1 1 A 105 105 VAL CA C 105 62.600 62.573 0.027 1
1 1253 . 5 1 1 A 105 105 VAL CB C 105 32.000 32.774 -0.774 1
1 1256 . 5 1 1 A 105 105 VAL N N 105 114.900 116.263 -1.363 1
1 1257 . 5 1 1 A 106 106 SER H H 106 7.900 7.967 -0.067 1
1 1258 . 5 1 1 A 106 106 SER HA H 106 4.460 4.576 -0.116 1
1 1261 . 5 1 1 A 106 106 SER C C 106 175.000 175.536 -0.536 1
1 1262 . 5 1 1 A 106 106 SER CA C 106 58.900 58.724 0.176 1
1 1263 . 5 1 1 A 106 106 SER CB C 106 63.900 64.010 -0.110 1
1 1264 . 5 1 1 A 106 106 SER N N 106 116.900 117.831 -0.931 1
1 1265 . 5 1 1 A 107 107 SER H H 107 8.230 7.851 0.379 1
1 1266 . 5 1 1 A 107 107 SER HA H 107 4.390 4.371 0.019 1
1 1269 . 5 1 1 A 107 107 SER C C 107 174.600 175.109 -0.509 1
1 1270 . 5 1 1 A 107 107 SER CA C 107 58.400 60.516 -2.116 1
1 1271 . 5 1 1 A 107 107 SER CB C 107 63.600 63.723 -0.123 1
1 1272 . 5 1 1 A 107 107 SER N N 107 117.500 114.332 3.168 1
1 1273 . 5 1 1 A 108 108 ALA H H 108 8.080 7.923 0.157 1
1 1274 . 5 1 1 A 108 108 ALA HA H 108 4.280 3.990 0.290 1
1 1278 . 5 1 1 A 108 108 ALA C C 108 177.500 175.855 1.645 1
1 1279 . 5 1 1 A 108 108 ALA CA C 108 52.700 53.568 -0.868 1
1 1280 . 5 1 1 A 108 108 ALA CB C 108 19.200 18.050 1.150 1
1 1281 . 5 1 1 A 108 108 ALA N N 108 124.900 120.782 4.118 1
1 1282 . 5 1 1 A 109 109 ALA H H 109 8.080 7.593 0.487 1
1 1283 . 5 1 1 A 109 109 ALA HA H 109 4.280 4.572 -0.292 1
1 1287 . 5 1 1 A 109 109 ALA C C 109 177.700 177.306 0.394 1
1 1288 . 5 1 1 A 109 109 ALA CA C 109 52.400 50.789 1.611 1
1 1289 . 5 1 1 A 109 109 ALA CB C 109 19.400 21.250 -1.850 1
1 1290 . 5 1 1 A 109 109 ALA N N 109 123.000 119.360 3.640 1
1 1291 . 5 1 1 A 110 110 ALA H H 110 8.300 8.668 -0.368 1
1 1292 . 5 1 1 A 110 110 ALA HA H 110 4.280 4.281 -0.001 1
1 1296 . 5 1 1 A 110 110 ALA C C 110 178.200 178.844 -0.644 1
1 1297 . 5 1 1 A 110 110 ALA CA C 110 52.700 54.683 -1.983 1
1 1298 . 5 1 1 A 110 110 ALA CB C 110 19.200 18.985 0.215 1
1 1299 . 5 1 1 A 110 110 ALA N N 110 123.200 122.382 0.818 1
1 1300 . 5 1 1 A 111 111 GLY H H 111 8.300 7.573 0.727 1
1 1301 . 5 1 1 A 111 111 GLY HA2 H 111 3.930 4.073 -0.143 1
1 1302 . 5 1 1 A 111 111 GLY HA3 H 111 3.940 4.073 -0.133 1
1 1303 . 5 1 1 A 111 111 GLY C C 111 173.700 173.433 0.267 1
1 1304 . 5 1 1 A 111 111 GLY CA C 111 45.100 45.775 -0.675 1
1 1305 . 5 1 1 A 111 111 GLY N N 111 108.000 102.634 5.366 1
1 1306 . 5 1 1 A 112 112 VAL H H 112 7.930 7.528 0.402 1
1 1307 . 5 1 1 A 112 112 VAL HA H 112 4.420 4.362 0.058 1
1 1315 . 5 1 1 A 112 112 VAL CA C 112 60.000 59.417 0.583 1
1 1316 . 5 1 1 A 112 112 VAL CB C 112 32.200 32.409 -0.209 1
1 1319 . 5 1 1 A 112 112 VAL N N 112 120.400 120.480 -0.080 1
1 1320 . 5 1 1 A 113 113 PRO HA H 113 4.370 4.278 0.092 1
1 1327 . 5 1 1 A 113 113 PRO C C 113 177.300 178.044 -0.744 1
1 1328 . 5 1 1 A 113 113 PRO CA C 113 63.900 63.938 -0.038 1
1 1329 . 5 1 1 A 113 113 PRO CB C 113 31.800 31.281 0.519 1
1 1332 . 5 1 1 A 114 114 GLY H H 114 8.570 8.820 -0.250 1
1 1333 . 5 1 1 A 114 114 GLY HA2 H 114 3.880 3.989 -0.109 1
1 1334 . 5 1 1 A 114 114 GLY HA3 H 114 4.120 3.989 0.131 1
1 1335 . 5 1 1 A 114 114 GLY C C 114 174.900 175.219 -0.319 1
1 1336 . 5 1 1 A 114 114 GLY CA C 114 45.200 46.026 -0.826 1
1 1337 . 5 1 1 A 114 114 GLY N N 114 109.000 113.165 -4.165 1
1 1338 . 5 1 1 A 115 115 THR H H 115 7.900 7.440 0.460 1
1 1339 . 5 1 1 A 115 115 THR HA H 115 4.400 4.015 0.385 1
1 1344 . 5 1 1 A 115 115 THR C C 115 174.300 173.940 0.360 1
1 1345 . 5 1 1 A 115 115 THR CA C 115 61.700 64.633 -2.933 1
1 1346 . 5 1 1 A 115 115 THR CB C 115 69.700 69.688 0.012 1
1 1348 . 5 1 1 A 115 115 THR N N 115 111.400 115.666 -4.266 1
1 1349 . 5 1 1 A 116 116 ASN H H 116 8.450 7.781 0.669 1
1 1350 . 5 1 1 A 116 116 ASN HA H 116 4.970 5.185 -0.215 1
1 1355 . 5 1 1 A 116 116 ASN CA C 116 51.500 50.400 1.100 1
1 1356 . 5 1 1 A 116 116 ASN CB C 116 38.900 40.659 -1.759 1
1 1357 . 5 1 1 A 116 116 ASN N N 116 123.100 114.297 8.803 1
1 1359 . 5 1 1 A 117 117 PRO HA H 117 4.370 4.295 0.075 1
1 1366 . 5 1 1 A 117 117 PRO C C 117 178.400 177.762 0.638 1
1 1367 . 5 1 1 A 117 117 PRO CA C 117 64.800 64.541 0.259 1
1 1368 . 5 1 1 A 117 117 PRO CB C 117 32.100 32.000 0.100 1
1 1371 . 5 1 1 A 118 118 VAL H H 118 7.750 7.518 0.232 1
1 1372 . 5 1 1 A 118 118 VAL HA H 118 3.810 3.763 0.047 1
1 1380 . 5 1 1 A 118 118 VAL C C 118 178.300 178.024 0.276 1
1 1381 . 5 1 1 A 118 118 VAL CA C 118 65.200 65.482 -0.282 1
1 1382 . 5 1 1 A 118 118 VAL CB C 118 31.500 31.459 0.041 1
1 1385 . 5 1 1 A 118 118 VAL N N 118 118.300 116.390 1.910 1
1 1386 . 5 1 1 A 119 119 LEU H H 119 7.540 8.023 -0.483 1
1 1387 . 5 1 1 A 119 119 LEU HA H 119 4.030 3.858 0.172 1
1 1397 . 5 1 1 A 119 119 LEU C C 119 178.900 179.194 -0.294 1
1 1398 . 5 1 1 A 119 119 LEU CA C 119 57.800 58.132 -0.332 1
1 1399 . 5 1 1 A 119 119 LEU CB C 119 40.700 41.078 -0.378 1
1 1403 . 5 1 1 A 119 119 LEU N N 119 119.700 120.722 -1.022 1
1 1404 . 5 1 1 A 120 120 ASN H H 120 8.080 8.330 -0.250 1
1 1405 . 5 1 1 A 120 120 ASN HA H 120 4.420 4.414 0.006 1
1 1410 . 5 1 1 A 120 120 ASN C C 120 178.100 177.653 0.447 1
1 1411 . 5 1 1 A 120 120 ASN CA C 120 56.100 56.743 -0.643 1
1 1412 . 5 1 1 A 120 120 ASN CB C 120 37.800 38.686 -0.886 1
1 1413 . 5 1 1 A 120 120 ASN N N 120 117.700 117.879 -0.179 1
1 1415 . 5 1 1 A 121 121 ASN H H 121 8.120 8.006 0.114 1
1 1416 . 5 1 1 A 121 121 ASN HA H 121 4.490 4.570 -0.080 1
1 1421 . 5 1 1 A 121 121 ASN C C 121 178.000 178.292 -0.292 1
1 1422 . 5 1 1 A 121 121 ASN CA C 121 56.100 56.584 -0.484 1
1 1423 . 5 1 1 A 121 121 ASN CB C 121 37.800 38.197 -0.397 1
1 1424 . 5 1 1 A 121 121 ASN N N 121 120.000 116.723 3.277 1
1 1426 . 5 1 1 A 122 122 LEU H H 122 8.180 8.393 -0.213 1
1 1427 . 5 1 1 A 122 122 LEU HA H 122 4.050 3.939 0.111 1
1 1437 . 5 1 1 A 122 122 LEU C C 122 173.800 178.960 -5.160 1
1 1438 . 5 1 1 A 122 122 LEU CA C 122 58.500 57.889 0.611 1
1 1439 . 5 1 1 A 122 122 LEU CB C 122 41.900 41.996 -0.096 1
1 1443 . 5 1 1 A 122 122 LEU N N 122 122.600 121.098 1.502 1
1 1444 . 5 1 1 A 123 123 LEU H H 123 8.260 7.920 0.340 1
1 1445 . 5 1 1 A 123 123 LEU HA H 123 3.850 3.984 -0.134 1
1 1455 . 5 1 1 A 123 123 LEU C C 123 178.900 178.446 0.454 1
1 1456 . 5 1 1 A 123 123 LEU CA C 123 58.500 58.156 0.344 1
1 1457 . 5 1 1 A 123 123 LEU CB C 123 41.200 41.316 -0.116 1
1 1461 . 5 1 1 A 123 123 LEU N N 123 119.700 120.337 -0.637 1
1 1462 . 5 1 1 A 124 124 SER H H 124 7.950 8.070 -0.120 1
1 1463 . 5 1 1 A 124 124 SER HA H 124 4.240 4.035 0.205 1
1 1466 . 5 1 1 A 124 124 SER C C 124 177.500 177.161 0.339 1
1 1467 . 5 1 1 A 124 124 SER CA C 124 61.600 61.768 -0.168 1
1 1468 . 5 1 1 A 124 124 SER CB C 124 62.600 62.913 -0.313 1
1 1469 . 5 1 1 A 124 124 SER N N 124 113.400 114.217 -0.817 1
1 1470 . 5 1 1 A 125 125 CYS H H 125 8.040 8.326 -0.286 1
1 1471 . 5 1 1 A 125 125 CYS HA H 125 4.350 4.103 0.247 1
1 1474 . 5 1 1 A 125 125 CYS C C 125 176.800 176.795 0.005 1
1 1475 . 5 1 1 A 125 125 CYS CA C 125 62.600 63.873 -1.273 1
1 1476 . 5 1 1 A 125 125 CYS CB C 125 27.100 26.967 0.133 1
1 1477 . 5 1 1 A 125 125 CYS N N 125 119.800 119.347 0.453 1
1 1478 . 5 1 1 A 126 126 VAL H H 126 8.290 8.513 -0.223 1
1 1479 . 5 1 1 A 126 126 VAL HA H 126 3.430 3.395 0.035 1
1 1487 . 5 1 1 A 126 126 VAL C C 126 177.800 177.775 0.025 1
1 1488 . 5 1 1 A 126 126 VAL CA C 126 67.100 66.810 0.290 1
1 1489 . 5 1 1 A 126 126 VAL CB C 126 31.400 31.465 -0.065 1
1 1492 . 5 1 1 A 126 126 VAL N N 126 121.900 120.670 1.230 1
1 1493 . 5 1 1 A 127 127 GLN H H 127 8.200 8.052 0.148 1
1 1494 . 5 1 1 A 127 127 GLN HA H 127 3.970 3.899 0.071 1
1 1501 . 5 1 1 A 127 127 GLN C C 127 178.200 178.487 -0.287 1
1 1502 . 5 1 1 A 127 127 GLN CA C 127 58.700 58.756 -0.056 1
1 1503 . 5 1 1 A 127 127 GLN CB C 127 27.800 28.473 -0.673 1
1 1505 . 5 1 1 A 127 127 GLN N N 127 119.700 117.818 1.882 1
1 1507 . 5 1 1 A 128 128 GLU H H 128 7.880 7.848 0.032 1
1 1508 . 5 1 1 A 128 128 GLU HA H 128 4.200 4.019 0.181 1
1 1513 . 5 1 1 A 128 128 GLU C C 128 178.400 178.643 -0.243 1
1 1514 . 5 1 1 A 128 128 GLU CA C 128 59.000 58.961 0.039 1
1 1515 . 5 1 1 A 128 128 GLU CB C 128 28.400 29.597 -1.197 1
1 1517 . 5 1 1 A 128 128 GLU N N 128 119.800 119.611 0.189 1
1 1518 . 5 1 1 A 129 129 ILE H H 129 8.000 8.272 -0.272 1
1 1519 . 5 1 1 A 129 129 ILE HA H 129 3.460 3.271 0.189 1
1 1529 . 5 1 1 A 129 129 ILE C C 129 176.800 177.672 -0.872 1
1 1530 . 5 1 1 A 129 129 ILE CA C 129 66.100 65.244 0.856 1
1 1531 . 5 1 1 A 129 129 ILE CB C 129 38.200 37.259 0.941 1
1 1535 . 5 1 1 A 129 129 ILE N N 129 119.500 120.452 -0.952 1
1 1536 . 5 1 1 A 130 130 SER H H 130 8.040 8.127 -0.087 1
1 1537 . 5 1 1 A 130 130 SER HA H 130 3.780 4.062 -0.282 1
1 1540 . 5 1 1 A 130 130 SER C C 130 176.200 175.651 0.549 1
1 1541 . 5 1 1 A 130 130 SER CA C 130 62.100 62.326 -0.226 1
1 1542 . 5 1 1 A 130 130 SER CB C 130 62.600 62.707 -0.107 1
1 1543 . 5 1 1 A 130 130 SER N N 130 112.800 115.712 -2.912 1
1 1544 . 5 1 1 A 131 131 ASP H H 131 8.270 8.222 0.048 1
1 1545 . 5 1 1 A 131 131 ASP HA H 131 4.310 4.400 -0.090 1
1 1548 . 5 1 1 A 131 131 ASP C C 131 179.200 178.610 0.590 1
1 1549 . 5 1 1 A 131 131 ASP CA C 131 56.800 57.198 -0.398 1
1 1550 . 5 1 1 A 131 131 ASP CB C 131 40.900 40.938 -0.038 1
1 1551 . 5 1 1 A 131 131 ASP N N 131 119.600 122.137 -2.537 1
1 1552 . 5 1 1 A 132 132 VAL H H 132 8.470 8.205 0.265 1
1 1553 . 5 1 1 A 132 132 VAL HA H 132 3.520 3.788 -0.268 1
1 1561 . 5 1 1 A 132 132 VAL C C 132 178.700 178.585 0.115 1
1 1562 . 5 1 1 A 132 132 VAL CA C 132 66.500 65.646 0.854 1
1 1563 . 5 1 1 A 132 132 VAL CB C 132 31.500 32.140 -0.640 1
1 1566 . 5 1 1 A 132 132 VAL N N 132 118.100 119.765 -1.665 1
1 1567 . 5 1 1 A 133 133 VAL H H 133 8.140 7.984 0.156 1
1 1568 . 5 1 1 A 133 133 VAL HA H 133 3.770 3.797 -0.027 1
1 1576 . 5 1 1 A 133 133 VAL C C 133 176.500 178.565 -2.065 1
1 1577 . 5 1 1 A 133 133 VAL CA C 133 65.100 66.868 -1.768 1
1 1578 . 5 1 1 A 133 133 VAL CB C 133 31.600 31.313 0.287 1
1 1581 . 5 1 1 A 133 133 VAL N N 133 117.000 121.135 -4.135 1
1 1582 . 5 1 1 A 134 134 GLN H H 134 7.490 7.926 -0.436 1
1 1583 . 5 1 1 A 134 134 GLN HA H 134 4.350 4.087 0.263 1
1 1590 . 5 1 1 A 134 134 GLN C C 134 175.400 178.613 -3.213 1
1 1591 . 5 1 1 A 134 134 GLN CA C 134 56.700 58.765 -2.065 1
1 1592 . 5 1 1 A 134 134 GLN CB C 134 30.500 28.013 2.487 1
1 1594 . 5 1 1 A 134 134 GLN N N 134 116.300 118.858 -2.558 1
1 1 . 6 1 1 A 2 2 GLY HA2 H 2 3.890 4.122 -0.232 1
1 2 . 6 1 1 A 2 2 GLY HA3 H 2 3.890 4.145 -0.255 1
1 3 . 6 1 1 A 2 2 GLY C C 2 174.200 174.188 0.012 1
1 4 . 6 1 1 A 2 2 GLY CA C 2 44.700 44.720 -0.020 1
1 5 . 6 1 1 A 3 3 HIS H H 3 8.380 8.801 -0.421 1
1 6 . 6 1 1 A 3 3 HIS HA H 3 4.610 4.791 -0.181 1
1 9 . 6 1 1 A 3 3 HIS C C 3 174.500 176.417 -1.917 1
1 10 . 6 1 1 A 3 3 HIS CA C 3 55.200 56.122 -0.922 1
1 11 . 6 1 1 A 3 3 HIS CB C 3 28.800 31.443 -2.643 1
1 12 . 6 1 1 A 3 3 HIS N N 3 117.600 119.934 -2.334 1
1 13 . 6 1 1 A 4 4 HIS H H 4 8.520 7.933 0.587 1
1 14 . 6 1 1 A 4 4 HIS HA H 4 4.640 4.232 0.408 1
1 17 . 6 1 1 A 4 4 HIS C C 4 174.200 176.102 -1.902 1
1 18 . 6 1 1 A 4 4 HIS CA C 4 55.100 57.993 -2.893 1
1 19 . 6 1 1 A 4 4 HIS CB C 4 28.900 30.162 -1.262 1
1 20 . 6 1 1 A 4 4 HIS N N 4 119.000 118.978 0.022 1
1 21 . 6 1 1 A 5 5 HIS H H 5 8.530 7.798 0.732 1
1 22 . 6 1 1 A 5 5 HIS HA H 5 4.410 4.610 -0.200 1
1 25 . 6 1 1 A 5 5 HIS CA C 5 54.900 55.390 -0.490 1
1 26 . 6 1 1 A 5 5 HIS CB C 5 27.300 31.043 -3.743 1
1 27 . 6 1 1 A 5 5 HIS N N 5 121.600 117.946 3.654 1
1 28 . 6 1 1 A 6 6 HIS HA H 6 4.640 5.010 -0.370 1
1 31 . 6 1 1 A 6 6 HIS C C 6 174.100 174.113 -0.013 1
1 32 . 6 1 1 A 6 6 HIS CA C 6 55.100 53.703 1.397 1
1 33 . 6 1 1 A 6 6 HIS CB C 6 29.100 31.959 -2.859 1
1 34 . 6 1 1 A 7 7 HIS H H 7 8.690 8.590 0.100 1
1 35 . 6 1 1 A 7 7 HIS HA H 7 4.650 4.794 -0.144 1
1 38 . 6 1 1 A 7 7 HIS C C 7 174.200 174.178 0.022 1
1 39 . 6 1 1 A 7 7 HIS CA C 7 55.200 55.191 0.009 1
1 40 . 6 1 1 A 7 7 HIS CB C 7 29.300 30.856 -1.556 1
1 41 . 6 1 1 A 7 7 HIS N N 7 121.400 118.642 2.758 1
1 42 . 6 1 1 A 8 8 HIS H H 8 8.660 7.539 1.121 1
1 43 . 6 1 1 A 8 8 HIS HA H 8 4.700 4.994 -0.294 1
1 46 . 6 1 1 A 8 8 HIS C C 8 174.200 173.462 0.738 1
1 47 . 6 1 1 A 8 8 HIS CA C 8 55.000 53.530 1.470 1
1 48 . 6 1 1 A 8 8 HIS CB C 8 29.300 32.226 -2.926 1
1 49 . 6 1 1 A 8 8 HIS N N 8 120.400 120.681 -0.281 1
1 50 . 6 1 1 A 9 9 SER H H 9 8.490 8.604 -0.114 1
1 51 . 6 1 1 A 9 9 SER HA H 9 4.390 4.908 -0.518 1
1 54 . 6 1 1 A 9 9 SER C C 9 174.100 173.516 0.584 1
1 55 . 6 1 1 A 9 9 SER CA C 9 58.300 57.796 0.504 1
1 56 . 6 1 1 A 9 9 SER CB C 9 63.700 64.629 -0.929 1
1 57 . 6 1 1 A 9 9 SER N N 9 118.100 124.547 -6.447 1
1 58 . 6 1 1 A 10 10 HIS H H 10 8.710 8.682 0.028 1
1 59 . 6 1 1 A 10 10 HIS HA H 10 4.690 5.123 -0.433 1
1 63 . 6 1 1 A 10 10 HIS C C 10 174.200 172.806 1.394 1
1 64 . 6 1 1 A 10 10 HIS CA C 10 55.200 54.108 1.092 1
1 65 . 6 1 1 A 10 10 HIS CB C 10 28.800 31.911 -3.111 1
1 66 . 6 1 1 A 10 10 HIS N N 10 120.700 117.838 2.862 1
1 67 . 6 1 1 A 11 11 MET H H 11 8.410 8.671 -0.261 1
1 68 . 6 1 1 A 11 11 MET HA H 11 4.420 4.464 -0.044 1
1 76 . 6 1 1 A 11 11 MET C C 11 175.800 175.660 0.140 1
1 77 . 6 1 1 A 11 11 MET CA C 11 55.100 54.203 0.897 1
1 78 . 6 1 1 A 11 11 MET CB C 11 32.800 31.358 1.442 1
1 81 . 6 1 1 A 11 11 MET N N 11 122.300 119.978 2.322 1
1 82 . 6 1 1 A 12 12 ALA H H 12 8.440 8.247 0.193 1
1 83 . 6 1 1 A 12 12 ALA HA H 12 4.280 5.326 -1.046 1
1 87 . 6 1 1 A 12 12 ALA C C 12 177.400 176.305 1.095 1
1 88 . 6 1 1 A 12 12 ALA CA C 12 52.400 50.186 2.214 1
1 89 . 6 1 1 A 12 12 ALA CB C 12 18.800 21.428 -2.628 1
1 90 . 6 1 1 A 12 12 ALA N N 12 125.900 127.286 -1.386 1
1 91 . 6 1 1 A 13 13 ASN H H 13 8.440 8.907 -0.467 1
1 92 . 6 1 1 A 13 13 ASN HA H 13 4.660 5.338 -0.678 1
1 97 . 6 1 1 A 13 13 ASN C C 13 175.900 174.073 1.827 1
1 98 . 6 1 1 A 13 13 ASN CA C 13 53.200 51.476 1.724 1
1 99 . 6 1 1 A 13 13 ASN CB C 13 38.800 41.780 -2.980 1
1 100 . 6 1 1 A 13 13 ASN N N 13 118.300 119.102 -0.802 1
1 102 . 6 1 1 A 14 14 GLY H H 14 8.370 8.429 -0.059 1
1 103 . 6 1 1 A 14 14 GLY HA2 H 14 3.920 4.192 -0.272 1
1 104 . 6 1 1 A 14 14 GLY HA3 H 14 3.920 4.195 -0.275 1
1 105 . 6 1 1 A 14 14 GLY C C 14 174.000 173.142 0.858 1
1 106 . 6 1 1 A 14 14 GLY CA C 14 45.200 44.521 0.679 1
1 107 . 6 1 1 A 14 14 GLY N N 14 109.600 107.317 2.283 1
1 108 . 6 1 1 A 15 15 ALA H H 15 8.140 8.352 -0.212 1
1 109 . 6 1 1 A 15 15 ALA HA H 15 4.280 4.287 -0.007 1
1 113 . 6 1 1 A 15 15 ALA C C 15 177.300 176.713 0.587 1
1 114 . 6 1 1 A 15 15 ALA CA C 15 52.500 52.331 0.169 1
1 115 . 6 1 1 A 15 15 ALA CB C 15 19.100 18.456 0.644 1
1 116 . 6 1 1 A 15 15 ALA N N 15 123.800 124.670 -0.870 1
1 117 . 6 1 1 A 16 16 ALA H H 16 8.030 8.079 -0.049 1
1 118 . 6 1 1 A 16 16 ALA HA H 16 4.280 4.663 -0.383 1
1 122 . 6 1 1 A 16 16 ALA C C 16 178.400 177.014 1.386 1
1 123 . 6 1 1 A 16 16 ALA CA C 16 52.600 51.557 1.043 1
1 124 . 6 1 1 A 16 16 ALA CB C 16 19.100 19.431 -0.331 1
1 125 . 6 1 1 A 16 16 ALA N N 16 122.300 125.937 -3.637 1
1 126 . 6 1 1 A 17 17 GLY H H 17 8.320 8.926 -0.606 1
1 127 . 6 1 1 A 17 17 GLY HA2 H 17 3.960 3.913 0.047 1
1 128 . 6 1 1 A 17 17 GLY HA3 H 17 3.960 3.914 0.046 1
1 129 . 6 1 1 A 17 17 GLY C C 17 174.500 175.351 -0.851 1
1 130 . 6 1 1 A 17 17 GLY CA C 17 45.200 46.806 -1.606 1
1 131 . 6 1 1 A 17 17 GLY N N 17 107.800 111.701 -3.901 1
1 132 . 6 1 1 A 18 18 THR H H 18 7.970 7.641 0.329 1
1 133 . 6 1 1 A 18 18 THR HA H 18 4.290 3.877 0.413 1
1 138 . 6 1 1 A 18 18 THR C C 18 174.600 176.415 -1.815 1
1 139 . 6 1 1 A 18 18 THR CA C 18 62.000 66.458 -4.458 1
1 140 . 6 1 1 A 18 18 THR CB C 18 69.700 68.585 1.115 1
1 142 . 6 1 1 A 18 18 THR N N 18 113.800 114.609 -0.809 1
1 143 . 6 1 1 A 19 19 LYS H H 19 8.350 8.365 -0.015 1
1 144 . 6 1 1 A 19 19 LYS HA H 19 4.270 4.152 0.118 1
1 153 . 6 1 1 A 19 19 LYS C C 19 176.600 177.772 -1.172 1
1 154 . 6 1 1 A 19 19 LYS CA C 19 56.500 58.895 -2.395 1
1 155 . 6 1 1 A 19 19 LYS CB C 19 32.800 32.020 0.780 1
1 159 . 6 1 1 A 19 19 LYS N N 19 124.000 120.235 3.765 1
1 160 . 6 1 1 A 20 20 VAL H H 20 8.060 7.611 0.449 1
1 161 . 6 1 1 A 20 20 VAL HA H 20 3.990 4.209 -0.219 1
1 169 . 6 1 1 A 20 20 VAL C C 20 175.900 176.914 -1.014 1
1 170 . 6 1 1 A 20 20 VAL CA C 20 62.400 62.901 -0.501 1
1 171 . 6 1 1 A 20 20 VAL CB C 20 32.600 32.517 0.083 1
1 174 . 6 1 1 A 20 20 VAL N N 20 121.700 119.381 2.319 1
1 175 . 6 1 1 A 21 21 ALA H H 21 8.310 7.651 0.659 1
1 176 . 6 1 1 A 21 21 ALA HA H 21 4.290 4.043 0.247 1
1 180 . 6 1 1 A 21 21 ALA C C 21 177.600 179.912 -2.312 1
1 181 . 6 1 1 A 21 21 ALA CA C 21 52.400 55.195 -2.795 1
1 182 . 6 1 1 A 21 21 ALA CB C 21 19.000 18.755 0.245 1
1 183 . 6 1 1 A 21 21 ALA N N 21 127.700 124.503 3.197 1
1 184 . 6 1 1 A 22 22 LEU H H 22 8.150 7.920 0.230 1
1 185 . 6 1 1 A 22 22 LEU HA H 22 4.280 4.339 -0.059 1
1 195 . 6 1 1 A 22 22 LEU C C 22 177.400 176.021 1.379 1
1 196 . 6 1 1 A 22 22 LEU CA C 22 55.200 54.611 0.589 1
1 197 . 6 1 1 A 22 22 LEU CB C 22 42.200 41.859 0.341 1
1 201 . 6 1 1 A 22 22 LEU N N 22 121.800 116.027 5.773 1
1 202 . 6 1 1 A 23 23 ARG H H 23 8.240 7.946 0.294 1
1 203 . 6 1 1 A 23 23 ARG HA H 23 4.290 4.026 0.264 1
1 211 . 6 1 1 A 23 23 ARG C C 23 176.300 176.117 0.183 1
1 212 . 6 1 1 A 23 23 ARG CA C 23 56.000 56.988 -0.988 1
1 213 . 6 1 1 A 23 23 ARG CB C 23 30.600 28.709 1.891 1
1 216 . 6 1 1 A 23 23 ARG N N 23 122.000 118.942 3.058 1
1 218 . 6 1 1 A 24 24 LYS H H 24 8.370 8.155 0.215 1
1 219 . 6 1 1 A 24 24 LYS HA H 24 4.330 4.430 -0.100 1
1 228 . 6 1 1 A 24 24 LYS C C 24 176.800 176.633 0.167 1
1 229 . 6 1 1 A 24 24 LYS CA C 24 56.400 57.629 -1.229 1
1 230 . 6 1 1 A 24 24 LYS CB C 24 32.700 33.320 -0.620 1
1 234 . 6 1 1 A 24 24 LYS N N 24 122.900 124.345 -1.445 1
1 235 . 6 1 1 A 25 25 THR H H 25 8.100 7.807 0.293 1
1 236 . 6 1 1 A 25 25 THR HA H 25 4.290 4.823 -0.533 1
1 241 . 6 1 1 A 25 25 THR C C 25 174.600 172.419 2.181 1
1 242 . 6 1 1 A 25 25 THR CA C 25 61.500 59.792 1.708 1
1 243 . 6 1 1 A 25 25 THR CB C 25 69.800 72.057 -2.257 1
1 245 . 6 1 1 A 25 25 THR N N 25 115.500 110.690 4.810 1
1 246 . 6 1 1 A 26 26 LYS H H 26 8.370 8.771 -0.401 1
1 247 . 6 1 1 A 26 26 LYS HA H 26 4.270 4.542 -0.272 1
1 256 . 6 1 1 A 26 26 LYS C C 26 176.600 176.880 -0.280 1
1 257 . 6 1 1 A 26 26 LYS CA C 26 56.600 54.819 1.781 1
1 258 . 6 1 1 A 26 26 LYS CB C 26 32.700 34.153 -1.453 1
1 262 . 6 1 1 A 26 26 LYS N N 26 123.700 123.949 -0.249 1
1 263 . 6 1 1 A 27 27 GLN H H 27 8.390 8.818 -0.428 1
1 264 . 6 1 1 A 27 27 GLN HA H 27 4.240 4.531 -0.291 1
1 271 . 6 1 1 A 27 27 GLN C C 27 175.900 175.949 -0.049 1
1 272 . 6 1 1 A 27 27 GLN CA C 27 56.100 56.393 -0.293 1
1 273 . 6 1 1 A 27 27 GLN CB C 27 29.300 29.430 -0.130 1
1 275 . 6 1 1 A 27 27 GLN N N 27 121.700 119.208 2.492 1
1 277 . 6 1 1 A 28 28 ALA H H 28 8.330 7.807 0.523 1
1 278 . 6 1 1 A 28 28 ALA HA H 28 4.240 4.524 -0.284 1
1 282 . 6 1 1 A 28 28 ALA C C 28 177.700 177.252 0.448 1
1 283 . 6 1 1 A 28 28 ALA CA C 28 52.500 51.238 1.262 1
1 284 . 6 1 1 A 28 28 ALA CB C 28 19.100 22.170 -3.070 1
1 285 . 6 1 1 A 28 28 ALA N N 28 125.400 119.310 6.090 1
1 286 . 6 1 1 A 29 29 ALA H H 29 8.250 8.871 -0.621 1
1 287 . 6 1 1 A 29 29 ALA HA H 29 4.230 4.028 0.202 1
1 291 . 6 1 1 A 29 29 ALA C C 29 178.000 179.830 -1.830 1
1 292 . 6 1 1 A 29 29 ALA CA C 29 52.500 55.089 -2.589 1
1 293 . 6 1 1 A 29 29 ALA CB C 29 19.100 18.492 0.608 1
1 294 . 6 1 1 A 29 29 ALA N N 29 123.000 123.225 -0.225 1
1 295 . 6 1 1 A 30 30 GLU H H 30 8.260 8.722 -0.462 1
1 296 . 6 1 1 A 30 30 GLU HA H 30 4.220 4.133 0.087 1
1 301 . 6 1 1 A 30 30 GLU C C 30 176.500 176.898 -0.398 1
1 302 . 6 1 1 A 30 30 GLU CA C 30 56.400 59.109 -2.709 1
1 303 . 6 1 1 A 30 30 GLU CB C 30 29.500 28.935 0.565 1
1 305 . 6 1 1 A 30 30 GLU N N 30 119.700 116.266 3.434 1
1 306 . 6 1 1 A 31 31 LYS H H 31 8.230 7.904 0.326 1
1 307 . 6 1 1 A 31 31 LYS HA H 31 4.280 4.524 -0.244 1
1 316 . 6 1 1 A 31 31 LYS C C 31 176.500 176.524 -0.024 1
1 317 . 6 1 1 A 31 31 LYS CA C 31 56.400 55.927 0.473 1
1 318 . 6 1 1 A 31 31 LYS CB C 31 32.800 34.277 -1.477 1
1 322 . 6 1 1 A 31 31 LYS N N 31 122.700 118.517 4.183 1
1 323 . 6 1 1 A 32 32 ILE H H 32 8.140 7.216 0.924 1
1 324 . 6 1 1 A 32 32 ILE HA H 32 4.110 4.264 -0.154 1
1 334 . 6 1 1 A 32 32 ILE C C 32 176.400 176.431 -0.031 1
1 335 . 6 1 1 A 32 32 ILE CA C 32 61.200 61.525 -0.325 1
1 336 . 6 1 1 A 32 32 ILE CB C 32 38.600 36.819 1.781 1
1 340 . 6 1 1 A 32 32 ILE N N 32 122.300 122.525 -0.225 1
1 341 . 6 1 1 A 33 33 SER H H 33 8.230 8.321 -0.091 1
1 342 . 6 1 1 A 33 33 SER HA H 33 4.400 4.032 0.368 1
1 345 . 6 1 1 A 33 33 SER C C 33 174.800 176.749 -1.949 1
1 346 . 6 1 1 A 33 33 SER CA C 33 58.300 61.403 -3.103 1
1 347 . 6 1 1 A 33 33 SER CB C 33 63.700 62.892 0.808 1
1 348 . 6 1 1 A 33 33 SER N N 33 119.600 124.262 -4.662 1
1 349 . 6 1 1 A 34 34 ALA H H 34 8.430 8.313 0.117 1
1 350 . 6 1 1 A 34 34 ALA HA H 34 4.220 4.067 0.153 1
1 354 . 6 1 1 A 34 34 ALA C C 34 179.500 179.924 -0.424 1
1 355 . 6 1 1 A 34 34 ALA CA C 34 53.500 55.004 -1.504 1
1 356 . 6 1 1 A 34 34 ALA CB C 34 18.800 18.346 0.454 1
1 357 . 6 1 1 A 34 34 ALA N N 34 126.000 122.802 3.198 1
1 358 . 6 1 1 A 35 35 ASP H H 35 8.380 7.795 0.585 1
1 359 . 6 1 1 A 35 35 ASP HA H 35 4.520 4.364 0.156 1
1 362 . 6 1 1 A 35 35 ASP C C 35 176.500 178.790 -2.290 1
1 363 . 6 1 1 A 35 35 ASP CA C 35 54.800 56.638 -1.838 1
1 364 . 6 1 1 A 35 35 ASP CB C 35 40.200 40.821 -0.621 1
1 365 . 6 1 1 A 35 35 ASP N N 35 118.200 118.682 -0.482 1
1 366 . 6 1 1 A 36 36 LYS H H 36 8.000 7.786 0.214 1
1 367 . 6 1 1 A 36 36 LYS HA H 36 4.270 4.061 0.209 1
1 376 . 6 1 1 A 36 36 LYS C C 36 177.000 177.065 -0.065 1
1 377 . 6 1 1 A 36 36 LYS CA C 36 56.800 58.921 -2.121 1
1 378 . 6 1 1 A 36 36 LYS CB C 36 32.900 31.943 0.957 1
1 382 . 6 1 1 A 36 36 LYS N N 36 120.900 118.501 2.399 1
1 383 . 6 1 1 A 37 37 ILE H H 37 7.970 7.394 0.576 1
1 384 . 6 1 1 A 37 37 ILE HA H 37 4.020 3.999 0.021 1
1 394 . 6 1 1 A 37 37 ILE C C 37 176.100 174.947 1.153 1
1 395 . 6 1 1 A 37 37 ILE CA C 37 61.300 61.330 -0.030 1
1 396 . 6 1 1 A 37 37 ILE CB C 37 38.100 37.202 0.898 1
1 400 . 6 1 1 A 37 37 ILE N N 37 121.800 121.017 0.783 1
1 401 . 6 1 1 A 38 38 SER H H 38 7.980 8.547 -0.567 1
1 402 . 6 1 1 A 38 38 SER HA H 38 4.540 4.637 -0.097 1
1 405 . 6 1 1 A 38 38 SER C C 38 174.700 175.426 -0.726 1
1 406 . 6 1 1 A 38 38 SER CA C 38 58.200 57.943 0.257 1
1 407 . 6 1 1 A 38 38 SER CB C 38 64.400 64.196 0.204 1
1 408 . 6 1 1 A 38 38 SER N N 38 119.000 124.352 -5.352 1
1 409 . 6 1 1 A 39 39 LYS H H 39 8.690 9.036 -0.346 1
1 410 . 6 1 1 A 39 39 LYS HA H 39 3.400 3.662 -0.262 1
1 419 . 6 1 1 A 39 39 LYS C C 39 177.400 178.041 -0.641 1
1 420 . 6 1 1 A 39 39 LYS CA C 39 59.800 60.394 -0.594 1
1 421 . 6 1 1 A 39 39 LYS CB C 39 32.400 32.556 -0.156 1
1 425 . 6 1 1 A 39 39 LYS N N 39 124.200 124.939 -0.739 1
1 426 . 6 1 1 A 40 40 GLU H H 40 8.280 8.447 -0.167 1
1 427 . 6 1 1 A 40 40 GLU HA H 40 3.840 4.033 -0.193 1
1 432 . 6 1 1 A 40 40 GLU C C 40 178.400 178.833 -0.433 1
1 433 . 6 1 1 A 40 40 GLU CA C 40 59.400 59.301 0.099 1
1 434 . 6 1 1 A 40 40 GLU CB C 40 28.300 28.868 -0.568 1
1 436 . 6 1 1 A 40 40 GLU N N 40 116.300 117.426 -1.126 1
1 437 . 6 1 1 A 41 41 ALA H H 41 7.890 8.200 -0.310 1
1 438 . 6 1 1 A 41 41 ALA HA H 41 3.910 4.314 -0.404 1
1 442 . 6 1 1 A 41 41 ALA C C 41 179.900 179.786 0.114 1
1 443 . 6 1 1 A 41 41 ALA CA C 41 54.700 55.464 -0.764 1
1 444 . 6 1 1 A 41 41 ALA CB C 41 17.900 17.824 0.076 1
1 445 . 6 1 1 A 41 41 ALA N N 41 122.300 122.916 -0.616 1
1 446 . 6 1 1 A 42 42 LEU H H 42 7.490 8.045 -0.555 1
1 447 . 6 1 1 A 42 42 LEU HA H 42 3.480 3.983 -0.503 1
1 457 . 6 1 1 A 42 42 LEU C C 42 178.900 178.701 0.199 1
1 458 . 6 1 1 A 42 42 LEU CA C 42 59.800 57.616 2.184 1
1 459 . 6 1 1 A 42 42 LEU CB C 42 42.300 41.415 0.885 1
1 463 . 6 1 1 A 42 42 LEU N N 42 121.000 119.658 1.342 1
1 464 . 6 1 1 A 43 43 LEU H H 43 8.290 8.080 0.210 1
1 465 . 6 1 1 A 43 43 LEU HA H 43 3.780 3.885 -0.105 1
1 475 . 6 1 1 A 43 43 LEU C C 43 179.400 179.391 0.009 1
1 476 . 6 1 1 A 43 43 LEU CA C 43 57.600 57.948 -0.348 1
1 477 . 6 1 1 A 43 43 LEU CB C 43 40.900 41.250 -0.350 1
1 481 . 6 1 1 A 43 43 LEU N N 43 119.200 118.021 1.179 1
1 482 . 6 1 1 A 44 44 GLU H H 44 8.330 8.656 -0.326 1
1 483 . 6 1 1 A 44 44 GLU HA H 44 4.050 4.000 0.050 1
1 488 . 6 1 1 A 44 44 GLU C C 44 178.600 178.743 -0.143 1
1 489 . 6 1 1 A 44 44 GLU CA C 44 58.900 59.356 -0.456 1
1 490 . 6 1 1 A 44 44 GLU CB C 44 28.300 28.951 -0.651 1
1 492 . 6 1 1 A 44 44 GLU N N 44 119.600 117.534 2.066 1
1 493 . 6 1 1 A 45 45 CYS H H 45 7.690 7.797 -0.107 1
1 494 . 6 1 1 A 45 45 CYS HA H 45 4.120 4.014 0.106 1
1 497 . 6 1 1 A 45 45 CYS C C 45 176.100 176.639 -0.539 1
1 498 . 6 1 1 A 45 45 CYS CA C 45 62.500 62.655 -0.155 1
1 499 . 6 1 1 A 45 45 CYS CB C 45 26.200 25.902 0.298 1
1 500 . 6 1 1 A 45 45 CYS N N 45 120.900 118.966 1.934 1
1 501 . 6 1 1 A 46 46 ALA H H 46 8.540 8.074 0.466 1
1 502 . 6 1 1 A 46 46 ALA HA H 46 3.900 3.897 0.003 1
1 506 . 6 1 1 A 46 46 ALA C C 46 179.200 178.828 0.372 1
1 507 . 6 1 1 A 46 46 ALA CA C 46 55.500 55.567 -0.067 1
1 508 . 6 1 1 A 46 46 ALA CB C 46 16.800 17.951 -1.151 1
1 509 . 6 1 1 A 46 46 ALA N N 46 121.500 122.117 -0.617 1
1 510 . 6 1 1 A 47 47 ASP H H 47 8.460 8.111 0.349 1
1 511 . 6 1 1 A 47 47 ASP HA H 47 4.340 4.325 0.015 1
1 514 . 6 1 1 A 47 47 ASP C C 47 178.800 178.472 0.328 1
1 515 . 6 1 1 A 47 47 ASP CA C 47 56.600 57.547 -0.947 1
1 516 . 6 1 1 A 47 47 ASP CB C 47 39.800 42.007 -2.207 1
1 517 . 6 1 1 A 47 47 ASP N N 47 119.000 118.558 0.442 1
1 518 . 6 1 1 A 48 48 LEU H H 48 8.040 7.961 0.079 1
1 519 . 6 1 1 A 48 48 LEU HA H 48 4.110 3.918 0.192 1
1 529 . 6 1 1 A 48 48 LEU C C 48 180.000 179.592 0.408 1
1 530 . 6 1 1 A 48 48 LEU CA C 48 58.000 58.266 -0.266 1
1 531 . 6 1 1 A 48 48 LEU CB C 48 41.700 41.461 0.239 1
1 535 . 6 1 1 A 48 48 LEU N N 48 123.000 120.073 2.927 1
1 536 . 6 1 1 A 49 49 LEU H H 49 8.300 7.990 0.310 1
1 537 . 6 1 1 A 49 49 LEU HA H 49 4.110 3.929 0.181 1
1 547 . 6 1 1 A 49 49 LEU C C 49 177.200 178.830 -1.630 1
1 548 . 6 1 1 A 49 49 LEU CA C 49 57.600 57.932 -0.332 1
1 549 . 6 1 1 A 49 49 LEU CB C 49 41.200 41.682 -0.482 1
1 553 . 6 1 1 A 49 49 LEU N N 49 120.900 119.784 1.116 1
1 554 . 6 1 1 A 50 50 SER H H 50 8.660 7.951 0.709 1
1 555 . 6 1 1 A 50 50 SER HA H 50 4.000 4.106 -0.106 1
1 558 . 6 1 1 A 50 50 SER C C 50 176.800 177.108 -0.308 1
1 559 . 6 1 1 A 50 50 SER CA C 50 62.500 61.633 0.867 1
1 560 . 6 1 1 A 50 50 SER CB C 50 62.600 62.939 -0.339 1
1 561 . 6 1 1 A 50 50 SER N N 50 113.300 114.321 -1.021 1
1 562 . 6 1 1 A 51 51 SER H H 51 7.980 8.270 -0.290 1
1 563 . 6 1 1 A 51 51 SER HA H 51 4.220 4.172 0.048 1
1 566 . 6 1 1 A 51 51 SER C C 51 176.300 176.871 -0.571 1
1 567 . 6 1 1 A 51 51 SER CA C 51 61.200 61.528 -0.328 1
1 568 . 6 1 1 A 51 51 SER CB C 51 62.700 62.626 0.074 1
1 569 . 6 1 1 A 51 51 SER N N 51 115.900 115.220 0.680 1
1 570 . 6 1 1 A 52 52 ALA H H 52 8.030 8.140 -0.110 1
1 571 . 6 1 1 A 52 52 ALA HA H 52 4.130 4.157 -0.027 1
1 575 . 6 1 1 A 52 52 ALA C C 52 178.500 179.552 -1.052 1
1 576 . 6 1 1 A 52 52 ALA CA C 52 54.500 54.652 -0.152 1
1 577 . 6 1 1 A 52 52 ALA CB C 52 18.000 18.198 -0.198 1
1 578 . 6 1 1 A 52 52 ALA N N 52 125.400 122.876 2.524 1
1 579 . 6 1 1 A 53 53 LEU H H 53 7.710 7.959 -0.249 1
1 580 . 6 1 1 A 53 53 LEU HA H 53 4.180 4.162 0.018 1
1 590 . 6 1 1 A 53 53 LEU C C 53 177.700 177.899 -0.199 1
1 591 . 6 1 1 A 53 53 LEU CA C 53 56.500 56.579 -0.079 1
1 592 . 6 1 1 A 53 53 LEU CB C 53 42.400 41.579 0.821 1
1 596 . 6 1 1 A 53 53 LEU N N 53 113.800 118.800 -5.000 1
1 597 . 6 1 1 A 54 54 THR H H 54 7.550 7.558 -0.008 1
1 598 . 6 1 1 A 54 54 THR HA H 54 4.420 4.446 -0.026 1
1 603 . 6 1 1 A 54 54 THR C C 54 174.100 174.959 -0.859 1
1 604 . 6 1 1 A 54 54 THR CA C 54 61.600 62.930 -1.330 1
1 605 . 6 1 1 A 54 54 THR CB C 54 69.300 69.772 -0.472 1
1 607 . 6 1 1 A 54 54 THR N N 54 107.700 107.736 -0.036 1
1 608 . 6 1 1 A 55 55 GLU H H 55 7.750 7.219 0.531 1
1 609 . 6 1 1 A 55 55 GLU HA H 55 4.760 4.560 0.200 1
1 614 . 6 1 1 A 55 55 GLU CA C 55 53.400 54.856 -1.456 1
1 615 . 6 1 1 A 55 55 GLU CB C 55 30.100 30.102 -0.002 1
1 617 . 6 1 1 A 55 55 GLU N N 55 122.800 120.868 1.932 1
1 618 . 6 1 1 A 56 56 PRO HA H 56 4.670 4.685 -0.015 1
1 625 . 6 1 1 A 56 56 PRO C C 56 176.200 176.401 -0.201 1
1 626 . 6 1 1 A 56 56 PRO CA C 56 62.900 63.097 -0.197 1
1 627 . 6 1 1 A 56 56 PRO CB C 56 29.200 31.703 -2.503 1
1 630 . 6 1 1 A 57 57 VAL H H 57 8.010 8.379 -0.369 1
1 631 . 6 1 1 A 57 57 VAL HA H 57 4.590 4.957 -0.367 1
1 639 . 6 1 1 A 57 57 VAL CA C 57 58.600 58.424 0.176 1
1 640 . 6 1 1 A 57 57 VAL CB C 57 32.800 35.044 -2.244 1
1 643 . 6 1 1 A 57 57 VAL N N 57 121.400 117.350 4.050 1
1 644 . 6 1 1 A 58 58 PRO HA H 58 4.450 4.745 -0.295 1
1 651 . 6 1 1 A 58 58 PRO C C 58 177.500 177.787 -0.287 1
1 652 . 6 1 1 A 58 58 PRO CA C 58 62.600 62.492 0.108 1
1 653 . 6 1 1 A 58 58 PRO CB C 58 32.200 32.500 -0.300 1
1 656 . 6 1 1 A 59 59 ASN H H 59 8.890 8.963 -0.073 1
1 657 . 6 1 1 A 59 59 ASN HA H 59 4.330 4.393 -0.063 1
1 662 . 6 1 1 A 59 59 ASN C C 59 177.600 177.587 0.013 1
1 663 . 6 1 1 A 59 59 ASN CA C 59 56.300 56.525 -0.225 1
1 664 . 6 1 1 A 59 59 ASN CB C 59 38.400 38.432 -0.032 1
1 665 . 6 1 1 A 59 59 ASN N N 59 122.200 121.567 0.633 1
1 667 . 6 1 1 A 60 60 SER H H 60 8.660 8.075 0.585 1
1 668 . 6 1 1 A 60 60 SER HA H 60 4.010 4.080 -0.070 1
1 671 . 6 1 1 A 60 60 SER C C 60 176.200 176.084 0.116 1
1 672 . 6 1 1 A 60 60 SER CA C 60 60.800 61.668 -0.868 1
1 673 . 6 1 1 A 60 60 SER CB C 60 61.500 62.778 -1.278 1
1 674 . 6 1 1 A 60 60 SER N N 60 113.200 116.121 -2.921 1
1 675 . 6 1 1 A 61 61 GLN H H 61 7.420 8.022 -0.602 1
1 676 . 6 1 1 A 61 61 GLN HA H 61 4.280 4.046 0.234 1
1 683 . 6 1 1 A 61 61 GLN C C 61 178.600 178.491 0.109 1
1 684 . 6 1 1 A 61 61 GLN CA C 61 57.900 58.819 -0.919 1
1 685 . 6 1 1 A 61 61 GLN CB C 61 28.600 28.087 0.513 1
1 687 . 6 1 1 A 61 61 GLN N N 61 122.200 121.450 0.750 1
1 689 . 6 1 1 A 62 62 LEU H H 62 7.430 8.044 -0.614 1
1 690 . 6 1 1 A 62 62 LEU HA H 62 3.850 4.062 -0.212 1
1 700 . 6 1 1 A 62 62 LEU C C 62 178.800 178.956 -0.156 1
1 701 . 6 1 1 A 62 62 LEU CA C 62 57.900 58.111 -0.211 1
1 702 . 6 1 1 A 62 62 LEU CB C 62 42.100 41.917 0.183 1
1 706 . 6 1 1 A 62 62 LEU N N 62 120.600 119.986 0.614 1
1 707 . 6 1 1 A 63 63 VAL H H 63 8.200 7.920 0.280 1
1 708 . 6 1 1 A 63 63 VAL HA H 63 3.370 3.483 -0.113 1
1 716 . 6 1 1 A 63 63 VAL C C 63 178.000 177.766 0.234 1
1 717 . 6 1 1 A 63 63 VAL CA C 63 66.600 66.957 -0.357 1
1 718 . 6 1 1 A 63 63 VAL CB C 63 31.700 31.294 0.406 1
1 721 . 6 1 1 A 63 63 VAL N N 63 118.200 117.819 0.381 1
1 722 . 6 1 1 A 64 64 ASP H H 64 7.960 8.180 -0.220 1
1 723 . 6 1 1 A 64 64 ASP HA H 64 4.460 4.322 0.138 1
1 726 . 6 1 1 A 64 64 ASP C C 64 178.100 178.709 -0.609 1
1 727 . 6 1 1 A 64 64 ASP CA C 64 57.700 57.490 0.210 1
1 728 . 6 1 1 A 64 64 ASP CB C 64 39.800 41.394 -1.594 1
1 729 . 6 1 1 A 64 64 ASP N N 64 120.200 120.275 -0.075 1
1 730 . 6 1 1 A 65 65 THR H H 65 8.380 8.488 -0.108 1
1 731 . 6 1 1 A 65 65 THR HA H 65 3.970 3.983 -0.013 1
1 736 . 6 1 1 A 65 65 THR C C 65 176.500 177.251 -0.751 1
1 737 . 6 1 1 A 65 65 THR CA C 65 66.500 66.648 -0.148 1
1 738 . 6 1 1 A 65 65 THR CB C 65 67.800 68.066 -0.266 1
1 740 . 6 1 1 A 65 65 THR N N 65 118.100 115.538 2.562 1
1 741 . 6 1 1 A 66 66 GLY H H 66 8.900 8.591 0.309 1
1 742 . 6 1 1 A 66 66 GLY HA2 H 66 3.630 3.736 -0.106 1
1 743 . 6 1 1 A 66 66 GLY HA3 H 66 3.630 3.753 -0.123 1
1 744 . 6 1 1 A 66 66 GLY C C 66 174.200 175.634 -1.434 1
1 745 . 6 1 1 A 66 66 GLY CA C 66 47.500 46.970 0.530 1
1 746 . 6 1 1 A 66 66 GLY N N 66 110.500 107.581 2.919 1
1 747 . 6 1 1 A 67 67 HIS H H 67 8.650 8.236 0.414 1
1 748 . 6 1 1 A 67 67 HIS HA H 67 4.220 4.134 0.086 1
1 752 . 6 1 1 A 67 67 HIS C C 67 176.900 177.586 -0.686 1
1 753 . 6 1 1 A 67 67 HIS CA C 67 59.000 59.083 -0.083 1
1 754 . 6 1 1 A 67 67 HIS CB C 67 27.800 29.540 -1.740 1
1 756 . 6 1 1 A 67 67 HIS N N 67 120.100 122.098 -1.998 1
1 757 . 6 1 1 A 68 68 GLN H H 68 7.860 7.930 -0.070 1
1 758 . 6 1 1 A 68 68 GLN HA H 68 3.990 4.007 -0.017 1
1 765 . 6 1 1 A 68 68 GLN C C 68 177.800 177.788 0.012 1
1 766 . 6 1 1 A 68 68 GLN CA C 68 58.800 58.519 0.281 1
1 767 . 6 1 1 A 68 68 GLN CB C 68 28.200 27.601 0.599 1
1 769 . 6 1 1 A 68 68 GLN N N 68 121.400 116.547 4.853 1
1 771 . 6 1 1 A 69 69 LEU H H 69 8.300 7.822 0.478 1
1 772 . 6 1 1 A 69 69 LEU HA H 69 4.330 4.039 0.291 1
1 782 . 6 1 1 A 69 69 LEU C C 69 179.300 179.666 -0.366 1
1 783 . 6 1 1 A 69 69 LEU CA C 69 58.200 58.150 0.050 1
1 784 . 6 1 1 A 69 69 LEU CB C 69 40.500 41.217 -0.717 1
1 788 . 6 1 1 A 69 69 LEU N N 69 120.300 122.036 -1.736 1
1 789 . 6 1 1 A 70 70 LEU H H 70 8.460 7.832 0.628 1
1 790 . 6 1 1 A 70 70 LEU HA H 70 3.880 3.869 0.011 1
1 800 . 6 1 1 A 70 70 LEU C C 70 179.100 178.613 0.487 1
1 801 . 6 1 1 A 70 70 LEU CA C 70 58.300 58.003 0.297 1
1 802 . 6 1 1 A 70 70 LEU CB C 70 41.500 41.327 0.173 1
1 806 . 6 1 1 A 70 70 LEU N N 70 121.200 119.639 1.561 1
1 807 . 6 1 1 A 71 71 ASP H H 71 8.140 7.720 0.420 1
1 808 . 6 1 1 A 71 71 ASP HA H 71 4.420 4.288 0.132 1
1 811 . 6 1 1 A 71 71 ASP C C 71 180.000 178.252 1.748 1
1 812 . 6 1 1 A 71 71 ASP CA C 71 57.300 57.373 -0.073 1
1 813 . 6 1 1 A 71 71 ASP CB C 71 39.300 41.606 -2.306 1
1 814 . 6 1 1 A 71 71 ASP N N 71 121.100 118.851 2.249 1
1 815 . 6 1 1 A 72 72 TYR H H 72 8.320 8.312 0.008 1
1 816 . 6 1 1 A 72 72 TYR HA H 72 4.550 4.446 0.104 1
1 823 . 6 1 1 A 72 72 TYR C C 72 179.100 178.637 0.463 1
1 824 . 6 1 1 A 72 72 TYR CA C 72 60.500 60.604 -0.104 1
1 825 . 6 1 1 A 72 72 TYR CB C 72 37.600 38.186 -0.586 1
1 828 . 6 1 1 A 72 72 TYR N N 72 120.300 117.886 2.414 1
1 829 . 6 1 1 A 73 73 CYS H H 73 8.850 8.677 0.173 1
1 830 . 6 1 1 A 73 73 CYS HA H 73 4.380 4.644 -0.264 1
1 834 . 6 1 1 A 73 73 CYS C C 73 177.300 177.227 0.073 1
1 835 . 6 1 1 A 73 73 CYS CA C 73 64.400 63.537 0.863 1
1 836 . 6 1 1 A 73 73 CYS CB C 73 27.600 26.910 0.690 1
1 837 . 6 1 1 A 73 73 CYS N N 73 116.800 118.663 -1.863 1
1 838 . 6 1 1 A 74 74 SER H H 74 8.410 8.539 -0.129 1
1 839 . 6 1 1 A 74 74 SER HA H 74 4.290 4.259 0.031 1
1 842 . 6 1 1 A 74 74 SER C C 74 176.300 176.901 -0.601 1
1 843 . 6 1 1 A 74 74 SER CA C 74 61.400 61.232 0.168 1
1 844 . 6 1 1 A 74 74 SER CB C 74 62.600 62.620 -0.020 1
1 845 . 6 1 1 A 74 74 SER N N 74 115.900 116.941 -1.041 1
1 846 . 6 1 1 A 75 75 GLY H H 75 7.790 8.132 -0.342 1
1 847 . 6 1 1 A 75 75 GLY HA2 H 75 4.320 3.745 0.575 1
1 848 . 6 1 1 A 75 75 GLY HA3 H 75 3.900 3.747 0.153 1
1 849 . 6 1 1 A 75 75 GLY C C 75 174.600 175.278 -0.678 1
1 850 . 6 1 1 A 75 75 GLY CA C 75 45.600 47.065 -1.465 1
1 851 . 6 1 1 A 75 75 GLY N N 75 107.500 109.094 -1.594 1
1 852 . 6 1 1 A 76 76 TYR H H 76 8.040 8.556 -0.516 1
1 853 . 6 1 1 A 76 76 TYR HA H 76 4.310 4.013 0.297 1
1 860 . 6 1 1 A 76 76 TYR C C 76 176.200 177.580 -1.380 1
1 861 . 6 1 1 A 76 76 TYR CA C 76 60.000 60.913 -0.913 1
1 862 . 6 1 1 A 76 76 TYR CB C 76 40.700 38.738 1.962 1
1 865 . 6 1 1 A 76 76 TYR N N 76 121.900 123.285 -1.385 1
1 866 . 6 1 1 A 77 77 VAL H H 77 7.540 8.190 -0.650 1
1 867 . 6 1 1 A 77 77 VAL HA H 77 3.450 3.504 -0.054 1
1 875 . 6 1 1 A 77 77 VAL C C 77 175.500 177.157 -1.657 1
1 876 . 6 1 1 A 77 77 VAL CA C 77 65.500 64.419 1.081 1
1 877 . 6 1 1 A 77 77 VAL CB C 77 31.600 31.329 0.271 1
1 880 . 6 1 1 A 77 77 VAL N N 77 116.600 118.836 -2.236 1
1 881 . 6 1 1 A 78 78 ASP H H 78 7.580 8.060 -0.480 1
1 882 . 6 1 1 A 78 78 ASP HA H 78 4.380 4.359 0.021 1
1 885 . 6 1 1 A 78 78 ASP C C 78 177.000 177.672 -0.672 1
1 886 . 6 1 1 A 78 78 ASP CA C 78 55.800 57.128 -1.328 1
1 887 . 6 1 1 A 78 78 ASP CB C 78 39.900 41.019 -1.119 1
1 888 . 6 1 1 A 78 78 ASP N N 78 116.400 120.828 -4.428 1
1 889 . 6 1 1 A 79 79 CYS H H 79 8.040 7.671 0.369 1
1 890 . 6 1 1 A 79 79 CYS HA H 79 4.110 4.338 -0.228 1
1 893 . 6 1 1 A 79 79 CYS C C 79 174.200 174.569 -0.369 1
1 894 . 6 1 1 A 79 79 CYS CA C 79 58.600 59.485 -0.885 1
1 895 . 6 1 1 A 79 79 CYS CB C 79 27.200 27.526 -0.326 1
1 896 . 6 1 1 A 79 79 CYS N N 79 117.000 114.742 2.258 1
1 897 . 6 1 1 A 80 80 ILE H H 80 6.960 7.132 -0.172 1
1 898 . 6 1 1 A 80 80 ILE HA H 80 4.120 4.108 0.012 1
1 908 . 6 1 1 A 80 80 ILE CA C 80 58.700 59.027 -0.327 1
1 909 . 6 1 1 A 80 80 ILE CB C 80 38.500 37.494 1.006 1
1 913 . 6 1 1 A 80 80 ILE N N 80 123.200 122.678 0.522 1
1 914 . 6 1 1 A 81 81 PRO HA H 81 4.340 4.386 -0.046 1
1 921 . 6 1 1 A 81 81 PRO C C 81 178.000 176.286 1.714 1
1 922 . 6 1 1 A 81 81 PRO CA C 81 64.700 64.531 0.169 1
1 923 . 6 1 1 A 81 81 PRO CB C 81 32.600 32.117 0.483 1
1 926 . 6 1 1 A 82 82 GLN H H 82 7.560 7.940 -0.380 1
1 927 . 6 1 1 A 82 82 GLN HA H 82 4.600 4.447 0.153 1
1 934 . 6 1 1 A 82 82 GLN C C 82 177.400 176.581 0.819 1
1 935 . 6 1 1 A 82 82 GLN CA C 82 55.600 55.845 -0.245 1
1 936 . 6 1 1 A 82 82 GLN CB C 82 28.800 29.305 -0.505 1
1 938 . 6 1 1 A 82 82 GLN N N 82 115.900 118.138 -2.238 1
1 940 . 6 1 1 A 83 83 THR H H 83 8.880 8.589 0.291 1
1 941 . 6 1 1 A 83 83 THR HA H 83 3.750 3.900 -0.150 1
1 946 . 6 1 1 A 83 83 THR C C 83 176.300 176.187 0.113 1
1 947 . 6 1 1 A 83 83 THR CA C 83 66.500 66.221 0.279 1
1 948 . 6 1 1 A 83 83 THR CB C 83 68.700 68.773 -0.073 1
1 950 . 6 1 1 A 83 83 THR N N 83 122.700 119.910 2.790 1
1 951 . 6 1 1 A 84 84 ARG H H 84 8.990 8.171 0.819 1
1 952 . 6 1 1 A 84 84 ARG HA H 84 4.250 4.053 0.197 1
1 960 . 6 1 1 A 84 84 ARG C C 84 178.900 179.259 -0.359 1
1 961 . 6 1 1 A 84 84 ARG CA C 84 59.100 59.742 -0.642 1
1 962 . 6 1 1 A 84 84 ARG CB C 84 29.300 30.242 -0.942 1
1 965 . 6 1 1 A 84 84 ARG N N 84 120.100 121.353 -1.253 1
1 967 . 6 1 1 A 85 85 ASN H H 85 7.270 8.344 -1.074 1
1 968 . 6 1 1 A 85 85 ASN HA H 85 4.810 4.644 0.166 1
1 973 . 6 1 1 A 85 85 ASN C C 85 176.800 177.682 -0.882 1
1 974 . 6 1 1 A 85 85 ASN CA C 85 54.800 56.325 -1.525 1
1 975 . 6 1 1 A 85 85 ASN CB C 85 37.600 37.817 -0.217 1
1 976 . 6 1 1 A 85 85 ASN N N 85 117.400 118.486 -1.086 1
1 978 . 6 1 1 A 86 86 LYS H H 86 8.340 8.261 0.079 1
1 979 . 6 1 1 A 86 86 LYS HA H 86 3.890 4.153 -0.263 1
1 988 . 6 1 1 A 86 86 LYS C C 86 178.600 178.841 -0.241 1
1 989 . 6 1 1 A 86 86 LYS CA C 86 60.800 59.031 1.769 1
1 990 . 6 1 1 A 86 86 LYS CB C 86 32.700 32.327 0.373 1
1 994 . 6 1 1 A 86 86 LYS N N 86 124.200 120.371 3.829 1
1 995 . 6 1 1 A 87 87 PHE H H 87 8.120 8.758 -0.638 1
1 996 . 6 1 1 A 87 87 PHE HA H 87 4.260 4.224 0.036 1
1 1004 . 6 1 1 A 87 87 PHE C C 87 178.100 177.427 0.673 1
1 1005 . 6 1 1 A 87 87 PHE CA C 87 61.300 61.666 -0.366 1
1 1006 . 6 1 1 A 87 87 PHE CB C 87 38.200 39.131 -0.931 1
1 1010 . 6 1 1 A 87 87 PHE N N 87 118.300 121.140 -2.840 1
1 1011 . 6 1 1 A 88 88 ALA H H 88 7.860 8.325 -0.465 1
1 1012 . 6 1 1 A 88 88 ALA HA H 88 4.200 4.021 0.179 1
1 1016 . 6 1 1 A 88 88 ALA C C 88 180.600 179.483 1.117 1
1 1017 . 6 1 1 A 88 88 ALA CA C 88 54.900 55.174 -0.274 1
1 1018 . 6 1 1 A 88 88 ALA CB C 88 18.100 17.773 0.327 1
1 1019 . 6 1 1 A 88 88 ALA N N 88 121.700 120.746 0.954 1
1 1020 . 6 1 1 A 89 89 PHE H H 89 8.690 8.423 0.267 1
1 1021 . 6 1 1 A 89 89 PHE HA H 89 4.080 4.152 -0.072 1
1 1029 . 6 1 1 A 89 89 PHE C C 89 176.300 177.928 -1.628 1
1 1030 . 6 1 1 A 89 89 PHE CA C 89 62.000 61.546 0.454 1
1 1031 . 6 1 1 A 89 89 PHE CB C 89 39.800 39.611 0.189 1
1 1035 . 6 1 1 A 89 89 PHE N N 89 120.100 119.910 0.190 1
1 1036 . 6 1 1 A 90 90 ARG H H 90 8.560 8.152 0.408 1
1 1037 . 6 1 1 A 90 90 ARG HA H 90 3.790 3.843 -0.053 1
1 1045 . 6 1 1 A 90 90 ARG C C 90 179.600 178.936 0.664 1
1 1046 . 6 1 1 A 90 90 ARG CA C 90 60.000 59.721 0.279 1
1 1047 . 6 1 1 A 90 90 ARG CB C 90 30.000 29.940 0.060 1
1 1050 . 6 1 1 A 90 90 ARG N N 90 118.000 118.613 -0.613 1
1 1052 . 6 1 1 A 91 91 GLU H H 91 8.120 8.187 -0.067 1
1 1053 . 6 1 1 A 91 91 GLU HA H 91 3.980 3.904 0.076 1
1 1058 . 6 1 1 A 91 91 GLU C C 91 178.400 178.681 -0.281 1
1 1059 . 6 1 1 A 91 91 GLU CA C 91 58.900 59.206 -0.306 1
1 1060 . 6 1 1 A 91 91 GLU CB C 91 28.800 29.129 -0.329 1
1 1062 . 6 1 1 A 91 91 GLU N N 91 119.300 118.121 1.179 1
1 1063 . 6 1 1 A 92 92 ALA H H 92 7.820 7.623 0.197 1
1 1064 . 6 1 1 A 92 92 ALA HA H 92 4.050 3.961 0.089 1
1 1068 . 6 1 1 A 92 92 ALA C C 92 179.800 179.796 0.004 1
1 1069 . 6 1 1 A 92 92 ALA CA C 92 55.000 55.139 -0.139 1
1 1070 . 6 1 1 A 92 92 ALA CB C 92 18.000 18.263 -0.263 1
1 1071 . 6 1 1 A 92 92 ALA N N 92 123.400 122.175 1.225 1
1 1072 . 6 1 1 A 93 93 VAL H H 93 8.430 7.665 0.765 1
1 1073 . 6 1 1 A 93 93 VAL HA H 93 3.250 3.322 -0.072 1
1 1081 . 6 1 1 A 93 93 VAL C C 93 177.900 178.075 -0.175 1
1 1082 . 6 1 1 A 93 93 VAL CA C 93 66.800 66.754 0.046 1
1 1083 . 6 1 1 A 93 93 VAL CB C 93 31.300 31.263 0.037 1
1 1086 . 6 1 1 A 93 93 VAL N N 93 119.900 118.347 1.553 1
1 1087 . 6 1 1 A 94 94 SER H H 94 7.990 8.247 -0.257 1
1 1088 . 6 1 1 A 94 94 SER HA H 94 4.230 3.979 0.251 1
1 1091 . 6 1 1 A 94 94 SER C C 94 177.200 176.921 0.279 1
1 1092 . 6 1 1 A 94 94 SER CA C 94 61.600 61.138 0.462 1
1 1093 . 6 1 1 A 94 94 SER CB C 94 62.700 63.150 -0.450 1
1 1094 . 6 1 1 A 94 94 SER N N 94 116.000 116.503 -0.503 1
1 1095 . 6 1 1 A 95 95 LYS H H 95 7.710 7.536 0.174 1
1 1096 . 6 1 1 A 95 95 LYS HA H 95 4.020 4.068 -0.048 1
1 1105 . 6 1 1 A 95 95 LYS C C 95 179.400 179.169 0.231 1
1 1106 . 6 1 1 A 95 95 LYS CA C 95 59.600 59.271 0.329 1
1 1107 . 6 1 1 A 95 95 LYS CB C 95 32.300 32.338 -0.038 1
1 1111 . 6 1 1 A 95 95 LYS N N 95 121.400 121.718 -0.318 1
1 1112 . 6 1 1 A 96 96 LEU H H 96 8.270 8.032 0.238 1
1 1113 . 6 1 1 A 96 96 LEU HA H 96 4.040 3.935 0.105 1
1 1123 . 6 1 1 A 96 96 LEU C C 96 177.700 178.255 -0.555 1
1 1124 . 6 1 1 A 96 96 LEU CA C 96 58.600 58.183 0.417 1
1 1125 . 6 1 1 A 96 96 LEU CB C 96 41.000 41.651 -0.651 1
1 1129 . 6 1 1 A 96 96 LEU N N 96 124.800 120.860 3.940 1
1 1130 . 6 1 1 A 97 97 GLU H H 97 8.500 8.374 0.126 1
1 1131 . 6 1 1 A 97 97 GLU HA H 97 3.760 4.030 -0.270 1
1 1136 . 6 1 1 A 97 97 GLU C C 97 179.100 179.210 -0.110 1
1 1137 . 6 1 1 A 97 97 GLU CA C 97 59.900 59.005 0.895 1
1 1138 . 6 1 1 A 97 97 GLU CB C 97 28.700 29.229 -0.529 1
1 1140 . 6 1 1 A 97 97 GLU N N 97 119.000 117.377 1.623 1
1 1141 . 6 1 1 A 98 98 LEU H H 98 7.740 8.050 -0.310 1
1 1142 . 6 1 1 A 98 98 LEU HA H 98 4.110 3.979 0.131 1
1 1152 . 6 1 1 A 98 98 LEU C C 98 179.700 179.352 0.348 1
1 1153 . 6 1 1 A 98 98 LEU CA C 98 57.900 57.838 0.062 1
1 1154 . 6 1 1 A 98 98 LEU CB C 98 41.800 41.918 -0.118 1
1 1158 . 6 1 1 A 98 98 LEU N N 98 119.200 121.112 -1.912 1
1 1159 . 6 1 1 A 99 99 SER H H 99 8.290 8.050 0.240 1
1 1160 . 6 1 1 A 99 99 SER HA H 99 4.220 4.431 -0.211 1
1 1163 . 6 1 1 A 99 99 SER C C 99 176.600 177.496 -0.896 1
1 1164 . 6 1 1 A 99 99 SER CA C 99 62.400 61.215 1.185 1
1 1165 . 6 1 1 A 99 99 SER CB C 99 63.200 62.747 0.453 1
1 1166 . 6 1 1 A 99 99 SER N N 99 116.300 114.337 1.963 1
1 1167 . 6 1 1 A 100 100 LEU H H 100 8.490 8.450 0.040 1
1 1168 . 6 1 1 A 100 100 LEU HA H 100 3.960 3.998 -0.038 1
1 1178 . 6 1 1 A 100 100 LEU C C 100 179.300 179.695 -0.395 1
1 1179 . 6 1 1 A 100 100 LEU CA C 100 57.700 57.901 -0.201 1
1 1180 . 6 1 1 A 100 100 LEU CB C 100 41.300 41.108 0.192 1
1 1184 . 6 1 1 A 100 100 LEU N N 100 120.900 122.244 -1.344 1
1 1185 . 6 1 1 A 101 101 GLN H H 101 7.680 8.854 -1.174 1
1 1186 . 6 1 1 A 101 101 GLN HA H 101 4.100 3.972 0.128 1
1 1193 . 6 1 1 A 101 101 GLN C C 101 178.700 177.974 0.726 1
1 1194 . 6 1 1 A 101 101 GLN CA C 101 58.800 58.847 -0.047 1
1 1195 . 6 1 1 A 101 101 GLN CB C 101 27.900 27.717 0.183 1
1 1197 . 6 1 1 A 101 101 GLN N N 101 119.100 117.957 1.143 1
1 1199 . 6 1 1 A 102 102 GLU H H 102 7.850 7.911 -0.061 1
1 1200 . 6 1 1 A 102 102 GLU HA H 102 4.050 4.112 -0.062 1
1 1205 . 6 1 1 A 102 102 GLU C C 102 179.100 178.980 0.120 1
1 1206 . 6 1 1 A 102 102 GLU CA C 102 58.400 59.340 -0.940 1
1 1207 . 6 1 1 A 102 102 GLU CB C 102 28.600 29.196 -0.596 1
1 1209 . 6 1 1 A 102 102 GLU N N 102 118.400 119.326 -0.926 1
1 1210 . 6 1 1 A 103 103 LEU H H 103 8.080 8.215 -0.135 1
1 1211 . 6 1 1 A 103 103 LEU HA H 103 4.020 4.010 0.010 1
1 1221 . 6 1 1 A 103 103 LEU C C 103 178.200 178.208 -0.008 1
1 1222 . 6 1 1 A 103 103 LEU CA C 103 57.000 58.255 -1.255 1
1 1223 . 6 1 1 A 103 103 LEU CB C 103 41.900 41.682 0.218 1
1 1227 . 6 1 1 A 103 103 LEU N N 103 120.600 122.597 -1.997 1
1 1228 . 6 1 1 A 104 104 GLN H H 104 7.900 8.378 -0.478 1
1 1229 . 6 1 1 A 104 104 GLN HA H 104 4.090 4.126 -0.036 1
1 1236 . 6 1 1 A 104 104 GLN C C 104 177.300 176.921 0.379 1
1 1237 . 6 1 1 A 104 104 GLN CA C 104 58.100 58.140 -0.040 1
1 1238 . 6 1 1 A 104 104 GLN CB C 104 29.400 28.086 1.314 1
1 1240 . 6 1 1 A 104 104 GLN N N 104 117.700 116.709 0.991 1
1 1242 . 6 1 1 A 105 105 VAL H H 105 7.620 7.323 0.297 1
1 1243 . 6 1 1 A 105 105 VAL HA H 105 4.190 4.246 -0.056 1
1 1251 . 6 1 1 A 105 105 VAL C C 105 176.800 176.802 -0.002 1
1 1252 . 6 1 1 A 105 105 VAL CA C 105 62.600 62.579 0.021 1
1 1253 . 6 1 1 A 105 105 VAL CB C 105 32.000 32.713 -0.713 1
1 1256 . 6 1 1 A 105 105 VAL N N 105 114.900 115.614 -0.714 1
1 1257 . 6 1 1 A 106 106 SER H H 106 7.900 7.633 0.267 1
1 1258 . 6 1 1 A 106 106 SER HA H 106 4.460 4.818 -0.358 1
1 1261 . 6 1 1 A 106 106 SER C C 106 175.000 174.867 0.133 1
1 1262 . 6 1 1 A 106 106 SER CA C 106 58.900 57.936 0.964 1
1 1263 . 6 1 1 A 106 106 SER CB C 106 63.900 64.003 -0.103 1
1 1264 . 6 1 1 A 106 106 SER N N 106 116.900 117.096 -0.196 1
1 1265 . 6 1 1 A 107 107 SER H H 107 8.230 7.626 0.604 1
1 1266 . 6 1 1 A 107 107 SER HA H 107 4.390 4.143 0.247 1
1 1269 . 6 1 1 A 107 107 SER C C 107 174.600 175.476 -0.876 1
1 1270 . 6 1 1 A 107 107 SER CA C 107 58.400 61.111 -2.711 1
1 1271 . 6 1 1 A 107 107 SER CB C 107 63.600 63.419 0.181 1
1 1272 . 6 1 1 A 107 107 SER N N 107 117.500 117.002 0.498 1
1 1273 . 6 1 1 A 108 108 ALA H H 108 8.080 7.728 0.352 1
1 1274 . 6 1 1 A 108 108 ALA HA H 108 4.280 3.885 0.395 1
1 1278 . 6 1 1 A 108 108 ALA C C 108 177.500 178.482 -0.982 1
1 1279 . 6 1 1 A 108 108 ALA CA C 108 52.700 54.973 -2.273 1
1 1280 . 6 1 1 A 108 108 ALA CB C 108 19.200 17.805 1.395 1
1 1281 . 6 1 1 A 108 108 ALA N N 108 124.900 120.063 4.837 1
1 1282 . 6 1 1 A 109 109 ALA H H 109 8.080 8.506 -0.426 1
1 1283 . 6 1 1 A 109 109 ALA HA H 109 4.280 4.080 0.200 1
1 1287 . 6 1 1 A 109 109 ALA C C 109 177.700 178.016 -0.316 1
1 1288 . 6 1 1 A 109 109 ALA CA C 109 52.400 54.347 -1.947 1
1 1289 . 6 1 1 A 109 109 ALA CB C 109 19.400 19.372 0.028 1
1 1290 . 6 1 1 A 109 109 ALA N N 109 123.000 120.544 2.456 1
1 1291 . 6 1 1 A 110 110 ALA H H 110 8.300 7.957 0.343 1
1 1292 . 6 1 1 A 110 110 ALA HA H 110 4.280 3.945 0.335 1
1 1296 . 6 1 1 A 110 110 ALA C C 110 178.200 177.632 0.568 1
1 1297 . 6 1 1 A 110 110 ALA CA C 110 52.700 55.003 -2.303 1
1 1298 . 6 1 1 A 110 110 ALA CB C 110 19.200 17.355 1.845 1
1 1299 . 6 1 1 A 110 110 ALA N N 110 123.200 118.264 4.936 1
1 1300 . 6 1 1 A 111 111 GLY H H 111 8.300 8.414 -0.114 1
1 1301 . 6 1 1 A 111 111 GLY HA2 H 111 3.930 4.020 -0.090 1
1 1302 . 6 1 1 A 111 111 GLY HA3 H 111 3.940 4.020 -0.080 1
1 1303 . 6 1 1 A 111 111 GLY C C 111 173.700 172.629 1.071 1
1 1304 . 6 1 1 A 111 111 GLY CA C 111 45.100 45.829 -0.729 1
1 1305 . 6 1 1 A 111 111 GLY N N 111 108.000 104.365 3.635 1
1 1306 . 6 1 1 A 112 112 VAL H H 112 7.930 7.881 0.049 1
1 1307 . 6 1 1 A 112 112 VAL HA H 112 4.420 4.558 -0.138 1
1 1315 . 6 1 1 A 112 112 VAL CA C 112 60.000 58.950 1.050 1
1 1316 . 6 1 1 A 112 112 VAL CB C 112 32.200 35.386 -3.186 1
1 1319 . 6 1 1 A 112 112 VAL N N 112 120.400 121.060 -0.660 1
1 1320 . 6 1 1 A 113 113 PRO HA H 113 4.370 4.685 -0.315 1
1 1327 . 6 1 1 A 113 113 PRO C C 113 177.300 177.937 -0.637 1
1 1328 . 6 1 1 A 113 113 PRO CA C 113 63.900 62.729 1.171 1
1 1329 . 6 1 1 A 113 113 PRO CB C 113 31.800 32.542 -0.742 1
1 1332 . 6 1 1 A 114 114 GLY H H 114 8.570 8.745 -0.175 1
1 1333 . 6 1 1 A 114 114 GLY HA2 H 114 3.880 3.911 -0.031 1
1 1334 . 6 1 1 A 114 114 GLY HA3 H 114 4.120 3.912 0.208 1
1 1335 . 6 1 1 A 114 114 GLY C C 114 174.900 175.301 -0.401 1
1 1336 . 6 1 1 A 114 114 GLY CA C 114 45.200 45.510 -0.310 1
1 1337 . 6 1 1 A 114 114 GLY N N 114 109.000 111.212 -2.212 1
1 1338 . 6 1 1 A 115 115 THR H H 115 7.900 8.137 -0.237 1
1 1339 . 6 1 1 A 115 115 THR HA H 115 4.400 3.868 0.532 1
1 1344 . 6 1 1 A 115 115 THR C C 115 174.300 173.762 0.538 1
1 1345 . 6 1 1 A 115 115 THR CA C 115 61.700 65.305 -3.605 1
1 1346 . 6 1 1 A 115 115 THR CB C 115 69.700 69.284 0.416 1
1 1348 . 6 1 1 A 115 115 THR N N 115 111.400 116.380 -4.980 1
1 1349 . 6 1 1 A 116 116 ASN H H 116 8.450 8.156 0.294 1
1 1350 . 6 1 1 A 116 116 ASN HA H 116 4.970 5.055 -0.085 1
1 1355 . 6 1 1 A 116 116 ASN CA C 116 51.500 49.438 2.062 1
1 1356 . 6 1 1 A 116 116 ASN CB C 116 38.900 39.707 -0.807 1
1 1357 . 6 1 1 A 116 116 ASN N N 116 123.100 117.020 6.080 1
1 1359 . 6 1 1 A 117 117 PRO HA H 117 4.370 4.366 0.004 1
1 1366 . 6 1 1 A 117 117 PRO C C 117 178.400 178.375 0.025 1
1 1367 . 6 1 1 A 117 117 PRO CA C 117 64.800 64.930 -0.130 1
1 1368 . 6 1 1 A 117 117 PRO CB C 117 32.100 32.000 0.100 1
1 1371 . 6 1 1 A 118 118 VAL H H 118 7.750 7.602 0.148 1
1 1372 . 6 1 1 A 118 118 VAL HA H 118 3.810 3.747 0.063 1
1 1380 . 6 1 1 A 118 118 VAL C C 118 178.300 178.173 0.127 1
1 1381 . 6 1 1 A 118 118 VAL CA C 118 65.200 65.489 -0.289 1
1 1382 . 6 1 1 A 118 118 VAL CB C 118 31.500 31.447 0.053 1
1 1385 . 6 1 1 A 118 118 VAL N N 118 118.300 116.154 2.146 1
1 1386 . 6 1 1 A 119 119 LEU H H 119 7.540 8.131 -0.591 1
1 1387 . 6 1 1 A 119 119 LEU HA H 119 4.030 3.886 0.144 1
1 1397 . 6 1 1 A 119 119 LEU C C 119 178.900 179.595 -0.695 1
1 1398 . 6 1 1 A 119 119 LEU CA C 119 57.800 57.901 -0.101 1
1 1399 . 6 1 1 A 119 119 LEU CB C 119 40.700 41.118 -0.418 1
1 1403 . 6 1 1 A 119 119 LEU N N 119 119.700 120.308 -0.608 1
1 1404 . 6 1 1 A 120 120 ASN H H 120 8.080 8.319 -0.239 1
1 1405 . 6 1 1 A 120 120 ASN HA H 120 4.420 4.455 -0.035 1
1 1410 . 6 1 1 A 120 120 ASN C C 120 178.100 178.292 -0.192 1
1 1411 . 6 1 1 A 120 120 ASN CA C 120 56.100 56.653 -0.553 1
1 1412 . 6 1 1 A 120 120 ASN CB C 120 37.800 38.007 -0.207 1
1 1413 . 6 1 1 A 120 120 ASN N N 120 117.700 118.330 -0.630 1
1 1415 . 6 1 1 A 121 121 ASN H H 121 8.120 8.185 -0.065 1
1 1416 . 6 1 1 A 121 121 ASN HA H 121 4.490 4.513 -0.023 1
1 1421 . 6 1 1 A 121 121 ASN C C 121 178.000 178.208 -0.208 1
1 1422 . 6 1 1 A 121 121 ASN CA C 121 56.100 56.418 -0.318 1
1 1423 . 6 1 1 A 121 121 ASN CB C 121 37.800 38.212 -0.412 1
1 1424 . 6 1 1 A 121 121 ASN N N 121 120.000 117.369 2.631 1
1 1426 . 6 1 1 A 122 122 LEU H H 122 8.180 8.380 -0.200 1
1 1427 . 6 1 1 A 122 122 LEU HA H 122 4.050 3.924 0.126 1
1 1437 . 6 1 1 A 122 122 LEU C C 122 173.800 178.900 -5.100 1
1 1438 . 6 1 1 A 122 122 LEU CA C 122 58.500 57.888 0.612 1
1 1439 . 6 1 1 A 122 122 LEU CB C 122 41.900 41.983 -0.083 1
1 1443 . 6 1 1 A 122 122 LEU N N 122 122.600 120.873 1.727 1
1 1444 . 6 1 1 A 123 123 LEU H H 123 8.260 7.954 0.306 1
1 1445 . 6 1 1 A 123 123 LEU HA H 123 3.850 3.989 -0.139 1
1 1455 . 6 1 1 A 123 123 LEU C C 123 178.900 178.432 0.468 1
1 1456 . 6 1 1 A 123 123 LEU CA C 123 58.500 58.351 0.149 1
1 1457 . 6 1 1 A 123 123 LEU CB C 123 41.200 41.488 -0.288 1
1 1461 . 6 1 1 A 123 123 LEU N N 123 119.700 120.310 -0.610 1
1 1462 . 6 1 1 A 124 124 SER H H 124 7.950 8.087 -0.137 1
1 1463 . 6 1 1 A 124 124 SER HA H 124 4.240 4.048 0.192 1
1 1466 . 6 1 1 A 124 124 SER C C 124 177.500 177.170 0.330 1
1 1467 . 6 1 1 A 124 124 SER CA C 124 61.600 61.751 -0.151 1
1 1468 . 6 1 1 A 124 124 SER CB C 124 62.600 62.879 -0.279 1
1 1469 . 6 1 1 A 124 124 SER N N 124 113.400 113.684 -0.284 1
1 1470 . 6 1 1 A 125 125 CYS H H 125 8.040 8.384 -0.344 1
1 1471 . 6 1 1 A 125 125 CYS HA H 125 4.350 4.108 0.242 1
1 1474 . 6 1 1 A 125 125 CYS C C 125 176.800 177.111 -0.311 1
1 1475 . 6 1 1 A 125 125 CYS CA C 125 62.600 63.639 -1.039 1
1 1476 . 6 1 1 A 125 125 CYS CB C 125 27.100 26.153 0.947 1
1 1477 . 6 1 1 A 125 125 CYS N N 125 119.800 119.089 0.711 1
1 1478 . 6 1 1 A 126 126 VAL H H 126 8.290 8.584 -0.294 1
1 1479 . 6 1 1 A 126 126 VAL HA H 126 3.430 3.384 0.046 1
1 1487 . 6 1 1 A 126 126 VAL C C 126 177.800 177.668 0.132 1
1 1488 . 6 1 1 A 126 126 VAL CA C 126 67.100 66.895 0.205 1
1 1489 . 6 1 1 A 126 126 VAL CB C 126 31.400 31.565 -0.165 1
1 1492 . 6 1 1 A 126 126 VAL N N 126 121.900 120.479 1.421 1
1 1493 . 6 1 1 A 127 127 GLN H H 127 8.200 8.203 -0.003 1
1 1494 . 6 1 1 A 127 127 GLN HA H 127 3.970 3.987 -0.017 1
1 1501 . 6 1 1 A 127 127 GLN C C 127 178.200 178.372 -0.172 1
1 1502 . 6 1 1 A 127 127 GLN CA C 127 58.700 58.847 -0.147 1
1 1503 . 6 1 1 A 127 127 GLN CB C 127 27.800 28.598 -0.798 1
1 1505 . 6 1 1 A 127 127 GLN N N 127 119.700 118.359 1.341 1
1 1507 . 6 1 1 A 128 128 GLU H H 128 7.880 8.080 -0.200 1
1 1508 . 6 1 1 A 128 128 GLU HA H 128 4.200 4.041 0.159 1
1 1513 . 6 1 1 A 128 128 GLU C C 128 178.400 178.723 -0.323 1
1 1514 . 6 1 1 A 128 128 GLU CA C 128 59.000 59.096 -0.096 1
1 1515 . 6 1 1 A 128 128 GLU CB C 128 28.400 29.405 -1.005 1
1 1517 . 6 1 1 A 128 128 GLU N N 128 119.800 119.699 0.101 1
1 1518 . 6 1 1 A 129 129 ILE H H 129 8.000 8.467 -0.467 1
1 1519 . 6 1 1 A 129 129 ILE HA H 129 3.460 3.601 -0.141 1
1 1529 . 6 1 1 A 129 129 ILE C C 129 176.800 178.167 -1.367 1
1 1530 . 6 1 1 A 129 129 ILE CA C 129 66.100 65.469 0.631 1
1 1531 . 6 1 1 A 129 129 ILE CB C 129 38.200 37.438 0.762 1
1 1535 . 6 1 1 A 129 129 ILE N N 129 119.500 120.231 -0.731 1
1 1536 . 6 1 1 A 130 130 SER H H 130 8.040 8.411 -0.371 1
1 1537 . 6 1 1 A 130 130 SER HA H 130 3.780 4.193 -0.413 1
1 1540 . 6 1 1 A 130 130 SER C C 130 176.200 176.463 -0.263 1
1 1541 . 6 1 1 A 130 130 SER CA C 130 62.100 61.640 0.460 1
1 1542 . 6 1 1 A 130 130 SER CB C 130 62.600 62.230 0.370 1
1 1543 . 6 1 1 A 130 130 SER N N 130 112.800 114.842 -2.042 1
1 1544 . 6 1 1 A 131 131 ASP H H 131 8.270 8.082 0.188 1
1 1545 . 6 1 1 A 131 131 ASP HA H 131 4.310 4.405 -0.095 1
1 1548 . 6 1 1 A 131 131 ASP C C 131 179.200 178.521 0.679 1
1 1549 . 6 1 1 A 131 131 ASP CA C 131 56.800 57.357 -0.557 1
1 1550 . 6 1 1 A 131 131 ASP CB C 131 40.900 41.124 -0.224 1
1 1551 . 6 1 1 A 131 131 ASP N N 131 119.600 122.329 -2.729 1
1 1552 . 6 1 1 A 132 132 VAL H H 132 8.470 8.352 0.118 1
1 1553 . 6 1 1 A 132 132 VAL HA H 132 3.520 3.705 -0.185 1
1 1561 . 6 1 1 A 132 132 VAL C C 132 178.700 178.552 0.148 1
1 1562 . 6 1 1 A 132 132 VAL CA C 132 66.500 66.510 -0.010 1
1 1563 . 6 1 1 A 132 132 VAL CB C 132 31.500 31.727 -0.227 1
1 1566 . 6 1 1 A 132 132 VAL N N 132 118.100 119.710 -1.610 1
1 1567 . 6 1 1 A 133 133 VAL H H 133 8.140 8.070 0.070 1
1 1568 . 6 1 1 A 133 133 VAL HA H 133 3.770 3.688 0.082 1
1 1576 . 6 1 1 A 133 133 VAL C C 133 176.500 177.266 -0.766 1
1 1577 . 6 1 1 A 133 133 VAL CA C 133 65.100 66.659 -1.559 1
1 1578 . 6 1 1 A 133 133 VAL CB C 133 31.600 31.537 0.063 1
1 1581 . 6 1 1 A 133 133 VAL N N 133 117.000 120.646 -3.646 1
1 1582 . 6 1 1 A 134 134 GLN H H 134 7.490 7.693 -0.203 1
1 1583 . 6 1 1 A 134 134 GLN HA H 134 4.350 4.267 0.083 1
1 1590 . 6 1 1 A 134 134 GLN C C 134 175.400 176.582 -1.182 1
1 1591 . 6 1 1 A 134 134 GLN CA C 134 56.700 56.516 0.184 1
1 1592 . 6 1 1 A 134 134 GLN CB C 134 30.500 28.567 1.933 1
1 1594 . 6 1 1 A 134 134 GLN N N 134 116.300 118.963 -2.663 1
1 1 . 7 1 1 A 2 2 GLY HA2 H 2 3.890 3.933 -0.043 1
1 2 . 7 1 1 A 2 2 GLY HA3 H 2 3.890 4.051 -0.161 1
1 3 . 7 1 1 A 2 2 GLY C C 2 174.200 173.315 0.885 1
1 4 . 7 1 1 A 2 2 GLY CA C 2 44.700 44.422 0.278 1
1 5 . 7 1 1 A 3 3 HIS H H 3 8.380 8.447 -0.067 1
1 6 . 7 1 1 A 3 3 HIS HA H 3 4.610 4.627 -0.017 1
1 9 . 7 1 1 A 3 3 HIS C C 3 174.500 175.325 -0.825 1
1 10 . 7 1 1 A 3 3 HIS CA C 3 55.200 54.985 0.215 1
1 11 . 7 1 1 A 3 3 HIS CB C 3 28.800 28.053 0.747 1
1 12 . 7 1 1 A 3 3 HIS N N 3 117.600 118.130 -0.530 1
1 13 . 7 1 1 A 4 4 HIS H H 4 8.520 8.043 0.477 1
1 14 . 7 1 1 A 4 4 HIS HA H 4 4.640 4.838 -0.198 1
1 17 . 7 1 1 A 4 4 HIS C C 4 174.200 176.028 -1.828 1
1 18 . 7 1 1 A 4 4 HIS CA C 4 55.100 55.340 -0.240 1
1 19 . 7 1 1 A 4 4 HIS CB C 4 28.900 30.381 -1.481 1
1 20 . 7 1 1 A 4 4 HIS N N 4 119.000 118.749 0.251 1
1 21 . 7 1 1 A 5 5 HIS H H 5 8.530 7.754 0.776 1
1 22 . 7 1 1 A 5 5 HIS HA H 5 4.410 4.086 0.324 1
1 25 . 7 1 1 A 5 5 HIS CA C 5 54.900 58.932 -4.032 1
1 26 . 7 1 1 A 5 5 HIS CB C 5 27.300 29.933 -2.633 1
1 27 . 7 1 1 A 5 5 HIS N N 5 121.600 118.463 3.137 1
1 28 . 7 1 1 A 6 6 HIS HA H 6 4.640 4.914 -0.274 1
1 31 . 7 1 1 A 6 6 HIS C C 6 174.100 173.678 0.422 1
1 32 . 7 1 1 A 6 6 HIS CA C 6 55.100 53.968 1.132 1
1 33 . 7 1 1 A 6 6 HIS CB C 6 29.100 32.251 -3.151 1
1 34 . 7 1 1 A 7 7 HIS H H 7 8.690 8.895 -0.205 1
1 35 . 7 1 1 A 7 7 HIS HA H 7 4.650 4.644 0.006 1
1 38 . 7 1 1 A 7 7 HIS C C 7 174.200 175.700 -1.500 1
1 39 . 7 1 1 A 7 7 HIS CA C 7 55.200 55.899 -0.699 1
1 40 . 7 1 1 A 7 7 HIS CB C 7 29.300 29.555 -0.255 1
1 41 . 7 1 1 A 7 7 HIS N N 7 121.400 124.957 -3.557 1
1 42 . 7 1 1 A 8 8 HIS H H 8 8.660 9.017 -0.357 1
1 43 . 7 1 1 A 8 8 HIS HA H 8 4.700 4.708 -0.008 1
1 46 . 7 1 1 A 8 8 HIS C C 8 174.200 174.359 -0.159 1
1 47 . 7 1 1 A 8 8 HIS CA C 8 55.000 57.396 -2.396 1
1 48 . 7 1 1 A 8 8 HIS CB C 8 29.300 30.597 -1.297 1
1 49 . 7 1 1 A 8 8 HIS N N 8 120.400 125.682 -5.282 1
1 50 . 7 1 1 A 9 9 SER H H 9 8.490 7.881 0.609 1
1 51 . 7 1 1 A 9 9 SER HA H 9 4.390 4.752 -0.362 1
1 54 . 7 1 1 A 9 9 SER C C 9 174.100 172.385 1.715 1
1 55 . 7 1 1 A 9 9 SER CA C 9 58.300 55.984 2.316 1
1 56 . 7 1 1 A 9 9 SER CB C 9 63.700 66.111 -2.411 1
1 57 . 7 1 1 A 9 9 SER N N 9 118.100 113.139 4.961 1
1 58 . 7 1 1 A 10 10 HIS H H 10 8.710 8.836 -0.126 1
1 59 . 7 1 1 A 10 10 HIS HA H 10 4.690 4.835 -0.145 1
1 63 . 7 1 1 A 10 10 HIS C C 10 174.200 173.584 0.616 1
1 64 . 7 1 1 A 10 10 HIS CA C 10 55.200 56.083 -0.883 1
1 65 . 7 1 1 A 10 10 HIS CB C 10 28.800 31.813 -3.013 1
1 66 . 7 1 1 A 10 10 HIS N N 10 120.700 122.203 -1.503 1
1 67 . 7 1 1 A 11 11 MET H H 11 8.410 7.664 0.746 1
1 68 . 7 1 1 A 11 11 MET HA H 11 4.420 4.436 -0.016 1
1 76 . 7 1 1 A 11 11 MET C C 11 175.800 176.472 -0.672 1
1 77 . 7 1 1 A 11 11 MET CA C 11 55.100 54.818 0.282 1
1 78 . 7 1 1 A 11 11 MET CB C 11 32.800 33.235 -0.435 1
1 81 . 7 1 1 A 11 11 MET N N 11 122.300 120.800 1.500 1
1 82 . 7 1 1 A 12 12 ALA H H 12 8.440 8.514 -0.074 1
1 83 . 7 1 1 A 12 12 ALA HA H 12 4.280 4.774 -0.494 1
1 87 . 7 1 1 A 12 12 ALA C C 12 177.400 178.281 -0.881 1
1 88 . 7 1 1 A 12 12 ALA CA C 12 52.400 50.723 1.677 1
1 89 . 7 1 1 A 12 12 ALA CB C 12 18.800 21.484 -2.684 1
1 90 . 7 1 1 A 12 12 ALA N N 12 125.900 123.981 1.919 1
1 91 . 7 1 1 A 13 13 ASN H H 13 8.440 8.841 -0.401 1
1 92 . 7 1 1 A 13 13 ASN HA H 13 4.660 4.767 -0.107 1
1 97 . 7 1 1 A 13 13 ASN C C 13 175.900 176.016 -0.116 1
1 98 . 7 1 1 A 13 13 ASN CA C 13 53.200 54.684 -1.484 1
1 99 . 7 1 1 A 13 13 ASN CB C 13 38.800 38.370 0.430 1
1 100 . 7 1 1 A 13 13 ASN N N 13 118.300 118.209 0.091 1
1 102 . 7 1 1 A 14 14 GLY H H 14 8.370 8.073 0.297 1
1 103 . 7 1 1 A 14 14 GLY HA2 H 14 3.920 3.976 -0.056 1
1 104 . 7 1 1 A 14 14 GLY HA3 H 14 3.920 3.976 -0.056 1
1 105 . 7 1 1 A 14 14 GLY C C 14 174.000 174.701 -0.701 1
1 106 . 7 1 1 A 14 14 GLY CA C 14 45.200 45.467 -0.267 1
1 107 . 7 1 1 A 14 14 GLY N N 14 109.600 107.949 1.651 1
1 108 . 7 1 1 A 15 15 ALA H H 15 8.140 7.788 0.352 1
1 109 . 7 1 1 A 15 15 ALA HA H 15 4.280 4.379 -0.099 1
1 113 . 7 1 1 A 15 15 ALA C C 15 177.300 178.056 -0.756 1
1 114 . 7 1 1 A 15 15 ALA CA C 15 52.500 54.217 -1.717 1
1 115 . 7 1 1 A 15 15 ALA CB C 15 19.100 19.501 -0.401 1
1 116 . 7 1 1 A 15 15 ALA N N 15 123.800 120.370 3.430 1
1 117 . 7 1 1 A 16 16 ALA H H 16 8.030 7.940 0.090 1
1 118 . 7 1 1 A 16 16 ALA HA H 16 4.280 4.066 0.214 1
1 122 . 7 1 1 A 16 16 ALA C C 16 178.400 178.293 0.107 1
1 123 . 7 1 1 A 16 16 ALA CA C 16 52.600 53.708 -1.108 1
1 124 . 7 1 1 A 16 16 ALA CB C 16 19.100 18.263 0.837 1
1 125 . 7 1 1 A 16 16 ALA N N 16 122.300 119.706 2.594 1
1 126 . 7 1 1 A 17 17 GLY H H 17 8.320 8.970 -0.650 1
1 127 . 7 1 1 A 17 17 GLY HA2 H 17 3.960 3.991 -0.031 1
1 128 . 7 1 1 A 17 17 GLY HA3 H 17 3.960 3.992 -0.032 1
1 129 . 7 1 1 A 17 17 GLY C C 17 174.500 175.947 -1.447 1
1 130 . 7 1 1 A 17 17 GLY CA C 17 45.200 45.642 -0.442 1
1 131 . 7 1 1 A 17 17 GLY N N 17 107.800 112.362 -4.562 1
1 132 . 7 1 1 A 18 18 THR H H 18 7.970 8.266 -0.296 1
1 133 . 7 1 1 A 18 18 THR HA H 18 4.290 3.952 0.338 1
1 138 . 7 1 1 A 18 18 THR C C 18 174.600 176.939 -2.339 1
1 139 . 7 1 1 A 18 18 THR CA C 18 62.000 66.412 -4.412 1
1 140 . 7 1 1 A 18 18 THR CB C 18 69.700 68.558 1.142 1
1 142 . 7 1 1 A 18 18 THR N N 18 113.800 116.441 -2.641 1
1 143 . 7 1 1 A 19 19 LYS H H 19 8.350 8.330 0.020 1
1 144 . 7 1 1 A 19 19 LYS HA H 19 4.270 4.207 0.063 1
1 153 . 7 1 1 A 19 19 LYS C C 19 176.600 176.424 0.176 1
1 154 . 7 1 1 A 19 19 LYS CA C 19 56.500 58.581 -2.081 1
1 155 . 7 1 1 A 19 19 LYS CB C 19 32.800 32.516 0.284 1
1 159 . 7 1 1 A 19 19 LYS N N 19 124.000 119.362 4.638 1
1 160 . 7 1 1 A 20 20 VAL H H 20 8.060 7.783 0.277 1
1 161 . 7 1 1 A 20 20 VAL HA H 20 3.990 4.425 -0.435 1
1 169 . 7 1 1 A 20 20 VAL C C 20 175.900 174.925 0.975 1
1 170 . 7 1 1 A 20 20 VAL CA C 20 62.400 61.842 0.558 1
1 171 . 7 1 1 A 20 20 VAL CB C 20 32.600 33.149 -0.549 1
1 174 . 7 1 1 A 20 20 VAL N N 20 121.700 118.076 3.624 1
1 175 . 7 1 1 A 21 21 ALA H H 21 8.310 8.284 0.026 1
1 176 . 7 1 1 A 21 21 ALA HA H 21 4.290 4.498 -0.208 1
1 180 . 7 1 1 A 21 21 ALA C C 21 177.600 177.770 -0.170 1
1 181 . 7 1 1 A 21 21 ALA CA C 21 52.400 52.977 -0.577 1
1 182 . 7 1 1 A 21 21 ALA CB C 21 19.000 19.510 -0.510 1
1 183 . 7 1 1 A 21 21 ALA N N 21 127.700 129.211 -1.511 1
1 184 . 7 1 1 A 22 22 LEU H H 22 8.150 8.208 -0.058 1
1 185 . 7 1 1 A 22 22 LEU HA H 22 4.280 4.177 0.103 1
1 195 . 7 1 1 A 22 22 LEU C C 22 177.400 177.615 -0.215 1
1 196 . 7 1 1 A 22 22 LEU CA C 22 55.200 55.335 -0.135 1
1 197 . 7 1 1 A 22 22 LEU CB C 22 42.200 41.435 0.765 1
1 201 . 7 1 1 A 22 22 LEU N N 22 121.800 118.700 3.100 1
1 202 . 7 1 1 A 23 23 ARG H H 23 8.240 7.916 0.324 1
1 203 . 7 1 1 A 23 23 ARG HA H 23 4.290 4.320 -0.030 1
1 211 . 7 1 1 A 23 23 ARG C C 23 176.300 176.362 -0.062 1
1 212 . 7 1 1 A 23 23 ARG CA C 23 56.000 55.191 0.809 1
1 213 . 7 1 1 A 23 23 ARG CB C 23 30.600 28.711 1.889 1
1 216 . 7 1 1 A 23 23 ARG N N 23 122.000 121.692 0.308 1
1 218 . 7 1 1 A 24 24 LYS H H 24 8.370 8.576 -0.206 1
1 219 . 7 1 1 A 24 24 LYS HA H 24 4.330 4.373 -0.043 1
1 228 . 7 1 1 A 24 24 LYS C C 24 176.800 176.521 0.279 1
1 229 . 7 1 1 A 24 24 LYS CA C 24 56.400 57.438 -1.038 1
1 230 . 7 1 1 A 24 24 LYS CB C 24 32.700 33.060 -0.360 1
1 234 . 7 1 1 A 24 24 LYS N N 24 122.900 126.794 -3.894 1
1 235 . 7 1 1 A 25 25 THR H H 25 8.100 7.876 0.224 1
1 236 . 7 1 1 A 25 25 THR HA H 25 4.290 4.733 -0.443 1
1 241 . 7 1 1 A 25 25 THR C C 25 174.600 173.123 1.477 1
1 242 . 7 1 1 A 25 25 THR CA C 25 61.500 59.383 2.117 1
1 243 . 7 1 1 A 25 25 THR CB C 25 69.800 71.467 -1.667 1
1 245 . 7 1 1 A 25 25 THR N N 25 115.500 110.614 4.886 1
1 246 . 7 1 1 A 26 26 LYS H H 26 8.370 8.640 -0.270 1
1 247 . 7 1 1 A 26 26 LYS HA H 26 4.270 4.429 -0.159 1
1 256 . 7 1 1 A 26 26 LYS C C 26 176.600 176.651 -0.051 1
1 257 . 7 1 1 A 26 26 LYS CA C 26 56.600 55.799 0.801 1
1 258 . 7 1 1 A 26 26 LYS CB C 26 32.700 34.041 -1.341 1
1 262 . 7 1 1 A 26 26 LYS N N 26 123.700 123.232 0.468 1
1 263 . 7 1 1 A 27 27 GLN H H 27 8.390 8.694 -0.304 1
1 264 . 7 1 1 A 27 27 GLN HA H 27 4.240 4.611 -0.371 1
1 271 . 7 1 1 A 27 27 GLN C C 27 175.900 176.165 -0.265 1
1 272 . 7 1 1 A 27 27 GLN CA C 27 56.100 56.335 -0.235 1
1 273 . 7 1 1 A 27 27 GLN CB C 27 29.300 30.593 -1.293 1
1 275 . 7 1 1 A 27 27 GLN N N 27 121.700 117.802 3.898 1
1 277 . 7 1 1 A 28 28 ALA H H 28 8.330 7.739 0.591 1
1 278 . 7 1 1 A 28 28 ALA HA H 28 4.240 4.575 -0.335 1
1 282 . 7 1 1 A 28 28 ALA C C 28 177.700 177.417 0.283 1
1 283 . 7 1 1 A 28 28 ALA CA C 28 52.500 50.837 1.663 1
1 284 . 7 1 1 A 28 28 ALA CB C 28 19.100 22.187 -3.087 1
1 285 . 7 1 1 A 28 28 ALA N N 28 125.400 119.753 5.647 1
1 286 . 7 1 1 A 29 29 ALA H H 29 8.250 8.882 -0.632 1
1 287 . 7 1 1 A 29 29 ALA HA H 29 4.230 4.111 0.119 1
1 291 . 7 1 1 A 29 29 ALA C C 29 178.000 179.481 -1.481 1
1 292 . 7 1 1 A 29 29 ALA CA C 29 52.500 55.564 -3.064 1
1 293 . 7 1 1 A 29 29 ALA CB C 29 19.100 18.209 0.891 1
1 294 . 7 1 1 A 29 29 ALA N N 29 123.000 123.818 -0.818 1
1 295 . 7 1 1 A 30 30 GLU H H 30 8.260 7.986 0.274 1
1 296 . 7 1 1 A 30 30 GLU HA H 30 4.220 4.200 0.020 1
1 301 . 7 1 1 A 30 30 GLU C C 30 176.500 177.230 -0.730 1
1 302 . 7 1 1 A 30 30 GLU CA C 30 56.400 58.379 -1.979 1
1 303 . 7 1 1 A 30 30 GLU CB C 30 29.500 29.456 0.044 1
1 305 . 7 1 1 A 30 30 GLU N N 30 119.700 117.629 2.071 1
1 306 . 7 1 1 A 31 31 LYS H H 31 8.230 7.978 0.252 1
1 307 . 7 1 1 A 31 31 LYS HA H 31 4.280 4.523 -0.243 1
1 316 . 7 1 1 A 31 31 LYS C C 31 176.500 176.771 -0.271 1
1 317 . 7 1 1 A 31 31 LYS CA C 31 56.400 56.313 0.087 1
1 318 . 7 1 1 A 31 31 LYS CB C 31 32.800 33.934 -1.134 1
1 322 . 7 1 1 A 31 31 LYS N N 31 122.700 118.389 4.311 1
1 323 . 7 1 1 A 32 32 ILE H H 32 8.140 7.441 0.699 1
1 324 . 7 1 1 A 32 32 ILE HA H 32 4.110 4.080 0.030 1
1 334 . 7 1 1 A 32 32 ILE C C 32 176.400 177.984 -1.584 1
1 335 . 7 1 1 A 32 32 ILE CA C 32 61.200 61.620 -0.420 1
1 336 . 7 1 1 A 32 32 ILE CB C 32 38.600 37.125 1.475 1
1 340 . 7 1 1 A 32 32 ILE N N 32 122.300 120.882 1.418 1
1 341 . 7 1 1 A 33 33 SER H H 33 8.230 8.949 -0.719 1
1 342 . 7 1 1 A 33 33 SER HA H 33 4.400 4.034 0.366 1
1 345 . 7 1 1 A 33 33 SER C C 33 174.800 176.309 -1.509 1
1 346 . 7 1 1 A 33 33 SER CA C 33 58.300 61.954 -3.654 1
1 347 . 7 1 1 A 33 33 SER CB C 33 63.700 62.744 0.956 1
1 348 . 7 1 1 A 33 33 SER N N 33 119.600 123.133 -3.533 1
1 349 . 7 1 1 A 34 34 ALA H H 34 8.430 8.377 0.053 1
1 350 . 7 1 1 A 34 34 ALA HA H 34 4.220 4.055 0.165 1
1 354 . 7 1 1 A 34 34 ALA C C 34 179.500 179.709 -0.209 1
1 355 . 7 1 1 A 34 34 ALA CA C 34 53.500 55.167 -1.667 1
1 356 . 7 1 1 A 34 34 ALA CB C 34 18.800 18.174 0.626 1
1 357 . 7 1 1 A 34 34 ALA N N 34 126.000 123.466 2.534 1
1 358 . 7 1 1 A 35 35 ASP H H 35 8.380 7.843 0.537 1
1 359 . 7 1 1 A 35 35 ASP HA H 35 4.520 4.303 0.217 1
1 362 . 7 1 1 A 35 35 ASP C C 35 176.500 178.485 -1.985 1
1 363 . 7 1 1 A 35 35 ASP CA C 35 54.800 57.092 -2.292 1
1 364 . 7 1 1 A 35 35 ASP CB C 35 40.200 40.877 -0.677 1
1 365 . 7 1 1 A 35 35 ASP N N 35 118.200 118.204 -0.004 1
1 366 . 7 1 1 A 36 36 LYS H H 36 8.000 7.822 0.178 1
1 367 . 7 1 1 A 36 36 LYS HA H 36 4.270 4.091 0.179 1
1 376 . 7 1 1 A 36 36 LYS C C 36 177.000 177.444 -0.444 1
1 377 . 7 1 1 A 36 36 LYS CA C 36 56.800 58.829 -2.029 1
1 378 . 7 1 1 A 36 36 LYS CB C 36 32.900 32.121 0.779 1
1 382 . 7 1 1 A 36 36 LYS N N 36 120.900 118.149 2.751 1
1 383 . 7 1 1 A 37 37 ILE H H 37 7.970 7.733 0.237 1
1 384 . 7 1 1 A 37 37 ILE HA H 37 4.020 4.343 -0.323 1
1 394 . 7 1 1 A 37 37 ILE C C 37 176.100 174.803 1.297 1
1 395 . 7 1 1 A 37 37 ILE CA C 37 61.300 61.063 0.237 1
1 396 . 7 1 1 A 37 37 ILE CB C 37 38.100 36.151 1.949 1
1 400 . 7 1 1 A 37 37 ILE N N 37 121.800 119.662 2.138 1
1 401 . 7 1 1 A 38 38 SER H H 38 7.980 8.931 -0.951 1
1 402 . 7 1 1 A 38 38 SER HA H 38 4.540 4.658 -0.118 1
1 405 . 7 1 1 A 38 38 SER C C 38 174.700 175.529 -0.829 1
1 406 . 7 1 1 A 38 38 SER CA C 38 58.200 58.062 0.138 1
1 407 . 7 1 1 A 38 38 SER CB C 38 64.400 64.382 0.018 1
1 408 . 7 1 1 A 38 38 SER N N 38 119.000 122.177 -3.177 1
1 409 . 7 1 1 A 39 39 LYS H H 39 8.690 9.094 -0.404 1
1 410 . 7 1 1 A 39 39 LYS HA H 39 3.400 3.836 -0.436 1
1 419 . 7 1 1 A 39 39 LYS C C 39 177.400 178.199 -0.799 1
1 420 . 7 1 1 A 39 39 LYS CA C 39 59.800 60.559 -0.759 1
1 421 . 7 1 1 A 39 39 LYS CB C 39 32.400 32.278 0.122 1
1 425 . 7 1 1 A 39 39 LYS N N 39 124.200 124.738 -0.538 1
1 426 . 7 1 1 A 40 40 GLU H H 40 8.280 8.395 -0.115 1
1 427 . 7 1 1 A 40 40 GLU HA H 40 3.840 4.068 -0.228 1
1 432 . 7 1 1 A 40 40 GLU C C 40 178.400 178.932 -0.532 1
1 433 . 7 1 1 A 40 40 GLU CA C 40 59.400 59.239 0.161 1
1 434 . 7 1 1 A 40 40 GLU CB C 40 28.300 29.365 -1.065 1
1 436 . 7 1 1 A 40 40 GLU N N 40 116.300 117.416 -1.116 1
1 437 . 7 1 1 A 41 41 ALA H H 41 7.890 7.999 -0.109 1
1 438 . 7 1 1 A 41 41 ALA HA H 41 3.910 4.119 -0.209 1
1 442 . 7 1 1 A 41 41 ALA C C 41 179.900 179.850 0.050 1
1 443 . 7 1 1 A 41 41 ALA CA C 41 54.700 55.234 -0.534 1
1 444 . 7 1 1 A 41 41 ALA CB C 41 17.900 18.193 -0.293 1
1 445 . 7 1 1 A 41 41 ALA N N 41 122.300 122.443 -0.143 1
1 446 . 7 1 1 A 42 42 LEU H H 42 7.490 7.879 -0.389 1
1 447 . 7 1 1 A 42 42 LEU HA H 42 3.480 3.982 -0.502 1
1 457 . 7 1 1 A 42 42 LEU C C 42 178.900 178.570 0.330 1
1 458 . 7 1 1 A 42 42 LEU CA C 42 59.800 57.744 2.056 1
1 459 . 7 1 1 A 42 42 LEU CB C 42 42.300 41.566 0.734 1
1 463 . 7 1 1 A 42 42 LEU N N 42 121.000 119.593 1.407 1
1 464 . 7 1 1 A 43 43 LEU H H 43 8.290 8.155 0.135 1
1 465 . 7 1 1 A 43 43 LEU HA H 43 3.780 3.856 -0.076 1
1 475 . 7 1 1 A 43 43 LEU C C 43 179.400 179.276 0.124 1
1 476 . 7 1 1 A 43 43 LEU CA C 43 57.600 57.965 -0.365 1
1 477 . 7 1 1 A 43 43 LEU CB C 43 40.900 41.180 -0.280 1
1 481 . 7 1 1 A 43 43 LEU N N 43 119.200 118.042 1.158 1
1 482 . 7 1 1 A 44 44 GLU H H 44 8.330 8.440 -0.110 1
1 483 . 7 1 1 A 44 44 GLU HA H 44 4.050 4.000 0.050 1
1 488 . 7 1 1 A 44 44 GLU C C 44 178.600 179.353 -0.753 1
1 489 . 7 1 1 A 44 44 GLU CA C 44 58.900 59.206 -0.306 1
1 490 . 7 1 1 A 44 44 GLU CB C 44 28.300 29.818 -1.518 1
1 492 . 7 1 1 A 44 44 GLU N N 44 119.600 118.354 1.246 1
1 493 . 7 1 1 A 45 45 CYS H H 45 7.690 7.983 -0.293 1
1 494 . 7 1 1 A 45 45 CYS HA H 45 4.120 4.003 0.117 1
1 497 . 7 1 1 A 45 45 CYS C C 45 176.100 176.703 -0.603 1
1 498 . 7 1 1 A 45 45 CYS CA C 45 62.500 62.789 -0.289 1
1 499 . 7 1 1 A 45 45 CYS CB C 45 26.200 25.827 0.373 1
1 500 . 7 1 1 A 45 45 CYS N N 45 120.900 118.720 2.180 1
1 501 . 7 1 1 A 46 46 ALA H H 46 8.540 7.959 0.581 1
1 502 . 7 1 1 A 46 46 ALA HA H 46 3.900 3.941 -0.041 1
1 506 . 7 1 1 A 46 46 ALA C C 46 179.200 178.994 0.206 1
1 507 . 7 1 1 A 46 46 ALA CA C 46 55.500 55.346 0.154 1
1 508 . 7 1 1 A 46 46 ALA CB C 46 16.800 18.232 -1.432 1
1 509 . 7 1 1 A 46 46 ALA N N 46 121.500 121.902 -0.402 1
1 510 . 7 1 1 A 47 47 ASP H H 47 8.460 8.266 0.194 1
1 511 . 7 1 1 A 47 47 ASP HA H 47 4.340 4.329 0.011 1
1 514 . 7 1 1 A 47 47 ASP C C 47 178.800 178.617 0.183 1
1 515 . 7 1 1 A 47 47 ASP CA C 47 56.600 57.395 -0.795 1
1 516 . 7 1 1 A 47 47 ASP CB C 47 39.800 42.308 -2.508 1
1 517 . 7 1 1 A 47 47 ASP N N 47 119.000 118.564 0.436 1
1 518 . 7 1 1 A 48 48 LEU H H 48 8.040 7.910 0.130 1
1 519 . 7 1 1 A 48 48 LEU HA H 48 4.110 3.843 0.267 1
1 529 . 7 1 1 A 48 48 LEU C C 48 180.000 179.251 0.749 1
1 530 . 7 1 1 A 48 48 LEU CA C 48 58.000 58.042 -0.042 1
1 531 . 7 1 1 A 48 48 LEU CB C 48 41.700 41.439 0.261 1
1 535 . 7 1 1 A 48 48 LEU N N 48 123.000 120.126 2.874 1
1 536 . 7 1 1 A 49 49 LEU H H 49 8.300 8.178 0.122 1
1 537 . 7 1 1 A 49 49 LEU HA H 49 4.110 3.780 0.330 1
1 547 . 7 1 1 A 49 49 LEU C C 49 177.200 178.747 -1.547 1
1 548 . 7 1 1 A 49 49 LEU CA C 49 57.600 58.057 -0.457 1
1 549 . 7 1 1 A 49 49 LEU CB C 49 41.200 41.678 -0.478 1
1 553 . 7 1 1 A 49 49 LEU N N 49 120.900 118.844 2.056 1
1 554 . 7 1 1 A 50 50 SER H H 50 8.660 8.039 0.621 1
1 555 . 7 1 1 A 50 50 SER HA H 50 4.000 4.170 -0.170 1
1 558 . 7 1 1 A 50 50 SER C C 50 176.800 176.919 -0.119 1
1 559 . 7 1 1 A 50 50 SER CA C 50 62.500 61.441 1.059 1
1 560 . 7 1 1 A 50 50 SER CB C 50 62.600 62.232 0.368 1
1 561 . 7 1 1 A 50 50 SER N N 50 113.300 112.902 0.398 1
1 562 . 7 1 1 A 51 51 SER H H 51 7.980 8.094 -0.114 1
1 563 . 7 1 1 A 51 51 SER HA H 51 4.220 4.097 0.123 1
1 566 . 7 1 1 A 51 51 SER C C 51 176.300 176.767 -0.467 1
1 567 . 7 1 1 A 51 51 SER CA C 51 61.200 61.896 -0.696 1
1 568 . 7 1 1 A 51 51 SER CB C 51 62.700 62.680 0.020 1
1 569 . 7 1 1 A 51 51 SER N N 51 115.900 116.124 -0.224 1
1 570 . 7 1 1 A 52 52 ALA H H 52 8.030 8.181 -0.151 1
1 571 . 7 1 1 A 52 52 ALA HA H 52 4.130 4.145 -0.015 1
1 575 . 7 1 1 A 52 52 ALA C C 52 178.500 179.499 -0.999 1
1 576 . 7 1 1 A 52 52 ALA CA C 52 54.500 54.477 0.023 1
1 577 . 7 1 1 A 52 52 ALA CB C 52 18.000 18.316 -0.316 1
1 578 . 7 1 1 A 52 52 ALA N N 52 125.400 123.400 2.000 1
1 579 . 7 1 1 A 53 53 LEU H H 53 7.710 7.911 -0.201 1
1 580 . 7 1 1 A 53 53 LEU HA H 53 4.180 4.107 0.073 1
1 590 . 7 1 1 A 53 53 LEU C C 53 177.700 179.262 -1.562 1
1 591 . 7 1 1 A 53 53 LEU CA C 53 56.500 57.262 -0.762 1
1 592 . 7 1 1 A 53 53 LEU CB C 53 42.400 41.784 0.616 1
1 596 . 7 1 1 A 53 53 LEU N N 53 113.800 118.000 -4.200 1
1 597 . 7 1 1 A 54 54 THR H H 54 7.550 7.389 0.161 1
1 598 . 7 1 1 A 54 54 THR HA H 54 4.420 4.225 0.195 1
1 603 . 7 1 1 A 54 54 THR C C 54 174.100 174.410 -0.310 1
1 604 . 7 1 1 A 54 54 THR CA C 54 61.600 64.455 -2.855 1
1 605 . 7 1 1 A 54 54 THR CB C 54 69.300 68.617 0.683 1
1 607 . 7 1 1 A 54 54 THR N N 54 107.700 109.594 -1.894 1
1 608 . 7 1 1 A 55 55 GLU H H 55 7.750 7.373 0.377 1
1 609 . 7 1 1 A 55 55 GLU HA H 55 4.760 4.914 -0.154 1
1 614 . 7 1 1 A 55 55 GLU CA C 55 53.400 54.152 -0.752 1
1 615 . 7 1 1 A 55 55 GLU CB C 55 30.100 31.351 -1.251 1
1 617 . 7 1 1 A 55 55 GLU N N 55 122.800 118.830 3.970 1
1 618 . 7 1 1 A 56 56 PRO HA H 56 4.670 4.817 -0.147 1
1 625 . 7 1 1 A 56 56 PRO C C 56 176.200 176.474 -0.274 1
1 626 . 7 1 1 A 56 56 PRO CA C 56 62.900 62.739 0.161 1
1 627 . 7 1 1 A 56 56 PRO CB C 56 29.200 31.634 -2.434 1
1 630 . 7 1 1 A 57 57 VAL H H 57 8.010 8.332 -0.322 1
1 631 . 7 1 1 A 57 57 VAL HA H 57 4.590 4.944 -0.354 1
1 639 . 7 1 1 A 57 57 VAL CA C 57 58.600 58.277 0.323 1
1 640 . 7 1 1 A 57 57 VAL CB C 57 32.800 34.856 -2.056 1
1 643 . 7 1 1 A 57 57 VAL N N 57 121.400 117.384 4.016 1
1 644 . 7 1 1 A 58 58 PRO HA H 58 4.450 4.905 -0.455 1
1 651 . 7 1 1 A 58 58 PRO C C 58 177.500 177.822 -0.322 1
1 652 . 7 1 1 A 58 58 PRO CA C 58 62.600 63.163 -0.563 1
1 653 . 7 1 1 A 58 58 PRO CB C 58 32.200 32.017 0.183 1
1 656 . 7 1 1 A 59 59 ASN H H 59 8.890 8.349 0.541 1
1 657 . 7 1 1 A 59 59 ASN HA H 59 4.330 4.379 -0.049 1
1 662 . 7 1 1 A 59 59 ASN C C 59 177.600 177.729 -0.129 1
1 663 . 7 1 1 A 59 59 ASN CA C 59 56.300 56.168 0.132 1
1 664 . 7 1 1 A 59 59 ASN CB C 59 38.400 38.195 0.205 1
1 665 . 7 1 1 A 59 59 ASN N N 59 122.200 121.849 0.351 1
1 667 . 7 1 1 A 60 60 SER H H 60 8.660 8.295 0.365 1
1 668 . 7 1 1 A 60 60 SER HA H 60 4.010 4.140 -0.130 1
1 671 . 7 1 1 A 60 60 SER C C 60 176.200 176.206 -0.006 1
1 672 . 7 1 1 A 60 60 SER CA C 60 60.800 61.247 -0.447 1
1 673 . 7 1 1 A 60 60 SER CB C 60 61.500 62.612 -1.112 1
1 674 . 7 1 1 A 60 60 SER N N 60 113.200 113.583 -0.383 1
1 675 . 7 1 1 A 61 61 GLN H H 61 7.420 7.795 -0.375 1
1 676 . 7 1 1 A 61 61 GLN HA H 61 4.280 4.030 0.250 1
1 683 . 7 1 1 A 61 61 GLN C C 61 178.600 178.465 0.135 1
1 684 . 7 1 1 A 61 61 GLN CA C 61 57.900 58.893 -0.993 1
1 685 . 7 1 1 A 61 61 GLN CB C 61 28.600 28.040 0.560 1
1 687 . 7 1 1 A 61 61 GLN N N 61 122.200 121.181 1.019 1
1 689 . 7 1 1 A 62 62 LEU H H 62 7.430 7.822 -0.392 1
1 690 . 7 1 1 A 62 62 LEU HA H 62 3.850 4.062 -0.212 1
1 700 . 7 1 1 A 62 62 LEU C C 62 178.800 179.221 -0.421 1
1 701 . 7 1 1 A 62 62 LEU CA C 62 57.900 58.056 -0.156 1
1 702 . 7 1 1 A 62 62 LEU CB C 62 42.100 41.737 0.363 1
1 706 . 7 1 1 A 62 62 LEU N N 62 120.600 119.965 0.635 1
1 707 . 7 1 1 A 63 63 VAL H H 63 8.200 8.324 -0.124 1
1 708 . 7 1 1 A 63 63 VAL HA H 63 3.370 3.519 -0.149 1
1 716 . 7 1 1 A 63 63 VAL C C 63 178.000 178.092 -0.092 1
1 717 . 7 1 1 A 63 63 VAL CA C 63 66.600 67.099 -0.499 1
1 718 . 7 1 1 A 63 63 VAL CB C 63 31.700 31.476 0.224 1
1 721 . 7 1 1 A 63 63 VAL N N 63 118.200 118.479 -0.279 1
1 722 . 7 1 1 A 64 64 ASP H H 64 7.960 8.309 -0.349 1
1 723 . 7 1 1 A 64 64 ASP HA H 64 4.460 4.392 0.068 1
1 726 . 7 1 1 A 64 64 ASP C C 64 178.100 178.726 -0.626 1
1 727 . 7 1 1 A 64 64 ASP CA C 64 57.700 57.406 0.294 1
1 728 . 7 1 1 A 64 64 ASP CB C 64 39.800 41.298 -1.498 1
1 729 . 7 1 1 A 64 64 ASP N N 64 120.200 120.377 -0.177 1
1 730 . 7 1 1 A 65 65 THR H H 65 8.380 8.688 -0.308 1
1 731 . 7 1 1 A 65 65 THR HA H 65 3.970 4.030 -0.060 1
1 736 . 7 1 1 A 65 65 THR C C 65 176.500 176.991 -0.491 1
1 737 . 7 1 1 A 65 65 THR CA C 65 66.500 66.564 -0.064 1
1 738 . 7 1 1 A 65 65 THR CB C 65 67.800 68.178 -0.378 1
1 740 . 7 1 1 A 65 65 THR N N 65 118.100 114.921 3.179 1
1 741 . 7 1 1 A 66 66 GLY H H 66 8.900 8.425 0.475 1
1 742 . 7 1 1 A 66 66 GLY HA2 H 66 3.630 3.627 0.003 1
1 743 . 7 1 1 A 66 66 GLY HA3 H 66 3.630 3.648 -0.018 1
1 744 . 7 1 1 A 66 66 GLY C C 66 174.200 175.560 -1.360 1
1 745 . 7 1 1 A 66 66 GLY CA C 66 47.500 47.379 0.121 1
1 746 . 7 1 1 A 66 66 GLY N N 66 110.500 107.514 2.986 1
1 747 . 7 1 1 A 67 67 HIS H H 67 8.650 8.334 0.316 1
1 748 . 7 1 1 A 67 67 HIS HA H 67 4.220 4.154 0.066 1
1 752 . 7 1 1 A 67 67 HIS C C 67 176.900 177.667 -0.767 1
1 753 . 7 1 1 A 67 67 HIS CA C 67 59.000 59.221 -0.221 1
1 754 . 7 1 1 A 67 67 HIS CB C 67 27.800 29.410 -1.610 1
1 756 . 7 1 1 A 67 67 HIS N N 67 120.100 121.650 -1.550 1
1 757 . 7 1 1 A 68 68 GLN H H 68 7.860 8.038 -0.178 1
1 758 . 7 1 1 A 68 68 GLN HA H 68 3.990 3.999 -0.009 1
1 765 . 7 1 1 A 68 68 GLN C C 68 177.800 177.875 -0.075 1
1 766 . 7 1 1 A 68 68 GLN CA C 68 58.800 58.520 0.280 1
1 767 . 7 1 1 A 68 68 GLN CB C 68 28.200 27.555 0.645 1
1 769 . 7 1 1 A 68 68 GLN N N 68 121.400 116.634 4.766 1
1 771 . 7 1 1 A 69 69 LEU H H 69 8.300 7.995 0.305 1
1 772 . 7 1 1 A 69 69 LEU HA H 69 4.330 4.065 0.265 1
1 782 . 7 1 1 A 69 69 LEU C C 69 179.300 179.993 -0.693 1
1 783 . 7 1 1 A 69 69 LEU CA C 69 58.200 58.083 0.117 1
1 784 . 7 1 1 A 69 69 LEU CB C 69 40.500 40.959 -0.459 1
1 788 . 7 1 1 A 69 69 LEU N N 69 120.300 121.849 -1.549 1
1 789 . 7 1 1 A 70 70 LEU H H 70 8.460 7.941 0.519 1
1 790 . 7 1 1 A 70 70 LEU HA H 70 3.880 3.944 -0.064 1
1 800 . 7 1 1 A 70 70 LEU C C 70 179.100 179.267 -0.167 1
1 801 . 7 1 1 A 70 70 LEU CA C 70 58.300 58.009 0.291 1
1 802 . 7 1 1 A 70 70 LEU CB C 70 41.500 40.327 1.173 1
1 806 . 7 1 1 A 70 70 LEU N N 70 121.200 120.112 1.088 1
1 807 . 7 1 1 A 71 71 ASP H H 71 8.140 8.069 0.071 1
1 808 . 7 1 1 A 71 71 ASP HA H 71 4.420 4.374 0.046 1
1 811 . 7 1 1 A 71 71 ASP C C 71 180.000 178.282 1.718 1
1 812 . 7 1 1 A 71 71 ASP CA C 71 57.300 57.261 0.039 1
1 813 . 7 1 1 A 71 71 ASP CB C 71 39.300 41.050 -1.750 1
1 814 . 7 1 1 A 71 71 ASP N N 71 121.100 119.541 1.559 1
1 815 . 7 1 1 A 72 72 TYR H H 72 8.320 8.099 0.221 1
1 816 . 7 1 1 A 72 72 TYR HA H 72 4.550 4.456 0.094 1
1 823 . 7 1 1 A 72 72 TYR C C 72 179.100 178.791 0.309 1
1 824 . 7 1 1 A 72 72 TYR CA C 72 60.500 60.721 -0.221 1
1 825 . 7 1 1 A 72 72 TYR CB C 72 37.600 38.004 -0.404 1
1 828 . 7 1 1 A 72 72 TYR N N 72 120.300 118.399 1.901 1
1 829 . 7 1 1 A 73 73 CYS H H 73 8.850 8.662 0.188 1
1 830 . 7 1 1 A 73 73 CYS HA H 73 4.380 4.561 -0.181 1
1 834 . 7 1 1 A 73 73 CYS C C 73 177.300 176.906 0.394 1
1 835 . 7 1 1 A 73 73 CYS CA C 73 64.400 63.261 1.139 1
1 836 . 7 1 1 A 73 73 CYS CB C 73 27.600 26.310 1.290 1
1 837 . 7 1 1 A 73 73 CYS N N 73 116.800 118.629 -1.829 1
1 838 . 7 1 1 A 74 74 SER H H 74 8.410 8.459 -0.049 1
1 839 . 7 1 1 A 74 74 SER HA H 74 4.290 4.240 0.050 1
1 842 . 7 1 1 A 74 74 SER C C 74 176.300 177.188 -0.888 1
1 843 . 7 1 1 A 74 74 SER CA C 74 61.400 61.222 0.178 1
1 844 . 7 1 1 A 74 74 SER CB C 74 62.600 62.186 0.414 1
1 845 . 7 1 1 A 74 74 SER N N 74 115.900 116.838 -0.938 1
1 846 . 7 1 1 A 75 75 GLY H H 75 7.790 8.139 -0.349 1
1 847 . 7 1 1 A 75 75 GLY HA2 H 75 4.320 3.698 0.622 1
1 848 . 7 1 1 A 75 75 GLY HA3 H 75 3.900 3.701 0.199 1
1 849 . 7 1 1 A 75 75 GLY C C 75 174.600 175.435 -0.835 1
1 850 . 7 1 1 A 75 75 GLY CA C 75 45.600 47.232 -1.632 1
1 851 . 7 1 1 A 75 75 GLY N N 75 107.500 109.937 -2.437 1
1 852 . 7 1 1 A 76 76 TYR H H 76 8.040 8.241 -0.201 1
1 853 . 7 1 1 A 76 76 TYR HA H 76 4.310 4.032 0.278 1
1 860 . 7 1 1 A 76 76 TYR C C 76 176.200 177.423 -1.223 1
1 861 . 7 1 1 A 76 76 TYR CA C 76 60.000 61.025 -1.025 1
1 862 . 7 1 1 A 76 76 TYR CB C 76 40.700 38.558 2.142 1
1 865 . 7 1 1 A 76 76 TYR N N 76 121.900 123.478 -1.578 1
1 866 . 7 1 1 A 77 77 VAL H H 77 7.540 8.620 -1.080 1
1 867 . 7 1 1 A 77 77 VAL HA H 77 3.450 3.390 0.060 1
1 875 . 7 1 1 A 77 77 VAL C C 77 175.500 177.315 -1.815 1
1 876 . 7 1 1 A 77 77 VAL CA C 77 65.500 64.810 0.690 1
1 877 . 7 1 1 A 77 77 VAL CB C 77 31.600 31.195 0.405 1
1 880 . 7 1 1 A 77 77 VAL N N 77 116.600 119.430 -2.830 1
1 881 . 7 1 1 A 78 78 ASP H H 78 7.580 8.172 -0.592 1
1 882 . 7 1 1 A 78 78 ASP HA H 78 4.380 4.391 -0.011 1
1 885 . 7 1 1 A 78 78 ASP C C 78 177.000 177.692 -0.692 1
1 886 . 7 1 1 A 78 78 ASP CA C 78 55.800 57.396 -1.596 1
1 887 . 7 1 1 A 78 78 ASP CB C 78 39.900 41.473 -1.573 1
1 888 . 7 1 1 A 78 78 ASP N N 78 116.400 120.762 -4.362 1
1 889 . 7 1 1 A 79 79 CYS H H 79 8.040 7.739 0.301 1
1 890 . 7 1 1 A 79 79 CYS HA H 79 4.110 4.406 -0.296 1
1 893 . 7 1 1 A 79 79 CYS C C 79 174.200 174.655 -0.455 1
1 894 . 7 1 1 A 79 79 CYS CA C 79 58.600 59.237 -0.637 1
1 895 . 7 1 1 A 79 79 CYS CB C 79 27.200 27.381 -0.181 1
1 896 . 7 1 1 A 79 79 CYS N N 79 117.000 114.930 2.070 1
1 897 . 7 1 1 A 80 80 ILE H H 80 6.960 7.112 -0.152 1
1 898 . 7 1 1 A 80 80 ILE HA H 80 4.120 4.103 0.017 1
1 908 . 7 1 1 A 80 80 ILE CA C 80 58.700 59.286 -0.586 1
1 909 . 7 1 1 A 80 80 ILE CB C 80 38.500 37.406 1.094 1
1 913 . 7 1 1 A 80 80 ILE N N 80 123.200 123.032 0.168 1
1 914 . 7 1 1 A 81 81 PRO HA H 81 4.340 4.438 -0.098 1
1 921 . 7 1 1 A 81 81 PRO C C 81 178.000 176.319 1.681 1
1 922 . 7 1 1 A 81 81 PRO CA C 81 64.700 64.452 0.248 1
1 923 . 7 1 1 A 81 81 PRO CB C 81 32.600 32.048 0.552 1
1 926 . 7 1 1 A 82 82 GLN H H 82 7.560 8.193 -0.633 1
1 927 . 7 1 1 A 82 82 GLN HA H 82 4.600 4.529 0.071 1
1 934 . 7 1 1 A 82 82 GLN C C 82 177.400 175.734 1.666 1
1 935 . 7 1 1 A 82 82 GLN CA C 82 55.600 55.045 0.555 1
1 936 . 7 1 1 A 82 82 GLN CB C 82 28.800 27.960 0.840 1
1 938 . 7 1 1 A 82 82 GLN N N 82 115.900 118.002 -2.102 1
1 940 . 7 1 1 A 83 83 THR H H 83 8.880 8.344 0.536 1
1 941 . 7 1 1 A 83 83 THR HA H 83 3.750 3.953 -0.203 1
1 946 . 7 1 1 A 83 83 THR C C 83 176.300 176.429 -0.129 1
1 947 . 7 1 1 A 83 83 THR CA C 83 66.500 66.207 0.293 1
1 948 . 7 1 1 A 83 83 THR CB C 83 68.700 68.783 -0.083 1
1 950 . 7 1 1 A 83 83 THR N N 83 122.700 119.437 3.263 1
1 951 . 7 1 1 A 84 84 ARG H H 84 8.990 8.219 0.771 1
1 952 . 7 1 1 A 84 84 ARG HA H 84 4.250 4.044 0.206 1
1 960 . 7 1 1 A 84 84 ARG C C 84 178.900 179.320 -0.420 1
1 961 . 7 1 1 A 84 84 ARG CA C 84 59.100 59.739 -0.639 1
1 962 . 7 1 1 A 84 84 ARG CB C 84 29.300 30.183 -0.883 1
1 965 . 7 1 1 A 84 84 ARG N N 84 120.100 121.258 -1.158 1
1 967 . 7 1 1 A 85 85 ASN H H 85 7.270 8.349 -1.079 1
1 968 . 7 1 1 A 85 85 ASN HA H 85 4.810 4.658 0.152 1
1 973 . 7 1 1 A 85 85 ASN C C 85 176.800 177.880 -1.080 1
1 974 . 7 1 1 A 85 85 ASN CA C 85 54.800 56.189 -1.389 1
1 975 . 7 1 1 A 85 85 ASN CB C 85 37.600 37.846 -0.246 1
1 976 . 7 1 1 A 85 85 ASN N N 85 117.400 118.403 -1.003 1
1 978 . 7 1 1 A 86 86 LYS H H 86 8.340 8.218 0.122 1
1 979 . 7 1 1 A 86 86 LYS HA H 86 3.890 4.134 -0.244 1
1 988 . 7 1 1 A 86 86 LYS C C 86 178.600 178.799 -0.199 1
1 989 . 7 1 1 A 86 86 LYS CA C 86 60.800 58.961 1.839 1
1 990 . 7 1 1 A 86 86 LYS CB C 86 32.700 32.137 0.563 1
1 994 . 7 1 1 A 86 86 LYS N N 86 124.200 120.775 3.425 1
1 995 . 7 1 1 A 87 87 PHE H H 87 8.120 8.694 -0.574 1
1 996 . 7 1 1 A 87 87 PHE HA H 87 4.260 4.254 0.006 1
1 1004 . 7 1 1 A 87 87 PHE C C 87 178.100 177.285 0.815 1
1 1005 . 7 1 1 A 87 87 PHE CA C 87 61.300 61.621 -0.321 1
1 1006 . 7 1 1 A 87 87 PHE CB C 87 38.200 39.086 -0.886 1
1 1010 . 7 1 1 A 87 87 PHE N N 87 118.300 121.177 -2.877 1
1 1011 . 7 1 1 A 88 88 ALA H H 88 7.860 8.195 -0.335 1
1 1012 . 7 1 1 A 88 88 ALA HA H 88 4.200 4.044 0.156 1
1 1016 . 7 1 1 A 88 88 ALA C C 88 180.600 179.725 0.875 1
1 1017 . 7 1 1 A 88 88 ALA CA C 88 54.900 55.136 -0.236 1
1 1018 . 7 1 1 A 88 88 ALA CB C 88 18.100 17.742 0.358 1
1 1019 . 7 1 1 A 88 88 ALA N N 88 121.700 120.768 0.932 1
1 1020 . 7 1 1 A 89 89 PHE H H 89 8.690 8.404 0.286 1
1 1021 . 7 1 1 A 89 89 PHE HA H 89 4.080 4.118 -0.038 1
1 1029 . 7 1 1 A 89 89 PHE C C 89 176.300 177.906 -1.606 1
1 1030 . 7 1 1 A 89 89 PHE CA C 89 62.000 61.740 0.260 1
1 1031 . 7 1 1 A 89 89 PHE CB C 89 39.800 39.386 0.414 1
1 1035 . 7 1 1 A 89 89 PHE N N 89 120.100 119.835 0.265 1
1 1036 . 7 1 1 A 90 90 ARG H H 90 8.560 8.309 0.251 1
1 1037 . 7 1 1 A 90 90 ARG HA H 90 3.790 3.880 -0.090 1
1 1045 . 7 1 1 A 90 90 ARG C C 90 179.600 178.501 1.099 1
1 1046 . 7 1 1 A 90 90 ARG CA C 90 60.000 59.555 0.445 1
1 1047 . 7 1 1 A 90 90 ARG CB C 90 30.000 30.096 -0.096 1
1 1050 . 7 1 1 A 90 90 ARG N N 90 118.000 118.302 -0.302 1
1 1052 . 7 1 1 A 91 91 GLU H H 91 8.120 8.137 -0.017 1
1 1053 . 7 1 1 A 91 91 GLU HA H 91 3.980 3.912 0.068 1
1 1058 . 7 1 1 A 91 91 GLU C C 91 178.400 178.918 -0.518 1
1 1059 . 7 1 1 A 91 91 GLU CA C 91 58.900 59.247 -0.347 1
1 1060 . 7 1 1 A 91 91 GLU CB C 91 28.800 29.088 -0.288 1
1 1062 . 7 1 1 A 91 91 GLU N N 91 119.300 118.115 1.185 1
1 1063 . 7 1 1 A 92 92 ALA H H 92 7.820 7.877 -0.057 1
1 1064 . 7 1 1 A 92 92 ALA HA H 92 4.050 3.985 0.065 1
1 1068 . 7 1 1 A 92 92 ALA C C 92 179.800 179.560 0.240 1
1 1069 . 7 1 1 A 92 92 ALA CA C 92 55.000 55.015 -0.015 1
1 1070 . 7 1 1 A 92 92 ALA CB C 92 18.000 18.356 -0.356 1
1 1071 . 7 1 1 A 92 92 ALA N N 92 123.400 122.182 1.218 1
1 1072 . 7 1 1 A 93 93 VAL H H 93 8.430 7.971 0.459 1
1 1073 . 7 1 1 A 93 93 VAL HA H 93 3.250 3.297 -0.047 1
1 1081 . 7 1 1 A 93 93 VAL C C 93 177.900 178.074 -0.174 1
1 1082 . 7 1 1 A 93 93 VAL CA C 93 66.800 66.425 0.375 1
1 1083 . 7 1 1 A 93 93 VAL CB C 93 31.300 31.192 0.108 1
1 1086 . 7 1 1 A 93 93 VAL N N 93 119.900 118.049 1.851 1
1 1087 . 7 1 1 A 94 94 SER H H 94 7.990 7.985 0.005 1
1 1088 . 7 1 1 A 94 94 SER HA H 94 4.230 3.962 0.268 1
1 1091 . 7 1 1 A 94 94 SER C C 94 177.200 176.653 0.547 1
1 1092 . 7 1 1 A 94 94 SER CA C 94 61.600 61.839 -0.239 1
1 1093 . 7 1 1 A 94 94 SER CB C 94 62.700 62.741 -0.041 1
1 1094 . 7 1 1 A 94 94 SER N N 94 116.000 116.546 -0.546 1
1 1095 . 7 1 1 A 95 95 LYS H H 95 7.710 7.672 0.038 1
1 1096 . 7 1 1 A 95 95 LYS HA H 95 4.020 4.044 -0.024 1
1 1105 . 7 1 1 A 95 95 LYS C C 95 179.400 179.133 0.267 1
1 1106 . 7 1 1 A 95 95 LYS CA C 95 59.600 59.262 0.338 1
1 1107 . 7 1 1 A 95 95 LYS CB C 95 32.300 32.297 0.003 1
1 1111 . 7 1 1 A 95 95 LYS N N 95 121.400 121.855 -0.455 1
1 1112 . 7 1 1 A 96 96 LEU H H 96 8.270 7.911 0.359 1
1 1113 . 7 1 1 A 96 96 LEU HA H 96 4.040 3.926 0.114 1
1 1123 . 7 1 1 A 96 96 LEU C C 96 177.700 178.251 -0.551 1
1 1124 . 7 1 1 A 96 96 LEU CA C 96 58.600 58.212 0.388 1
1 1125 . 7 1 1 A 96 96 LEU CB C 96 41.000 41.647 -0.647 1
1 1129 . 7 1 1 A 96 96 LEU N N 96 124.800 120.960 3.840 1
1 1130 . 7 1 1 A 97 97 GLU H H 97 8.500 8.233 0.267 1
1 1131 . 7 1 1 A 97 97 GLU HA H 97 3.760 4.072 -0.312 1
1 1136 . 7 1 1 A 97 97 GLU C C 97 179.100 179.234 -0.134 1
1 1137 . 7 1 1 A 97 97 GLU CA C 97 59.900 59.014 0.886 1
1 1138 . 7 1 1 A 97 97 GLU CB C 97 28.700 29.306 -0.606 1
1 1140 . 7 1 1 A 97 97 GLU N N 97 119.000 117.351 1.649 1
1 1141 . 7 1 1 A 98 98 LEU H H 98 7.740 8.192 -0.452 1
1 1142 . 7 1 1 A 98 98 LEU HA H 98 4.110 3.966 0.144 1
1 1152 . 7 1 1 A 98 98 LEU C C 98 179.700 179.147 0.553 1
1 1153 . 7 1 1 A 98 98 LEU CA C 98 57.900 57.795 0.105 1
1 1154 . 7 1 1 A 98 98 LEU CB C 98 41.800 41.427 0.373 1
1 1158 . 7 1 1 A 98 98 LEU N N 98 119.200 121.556 -2.356 1
1 1159 . 7 1 1 A 99 99 SER H H 99 8.290 8.270 0.020 1
1 1160 . 7 1 1 A 99 99 SER HA H 99 4.220 4.235 -0.015 1
1 1163 . 7 1 1 A 99 99 SER C C 99 176.600 177.017 -0.417 1
1 1164 . 7 1 1 A 99 99 SER CA C 99 62.400 61.057 1.343 1
1 1165 . 7 1 1 A 99 99 SER CB C 99 63.200 63.103 0.097 1
1 1166 . 7 1 1 A 99 99 SER N N 99 116.300 113.783 2.517 1
1 1167 . 7 1 1 A 100 100 LEU H H 100 8.490 8.069 0.421 1
1 1168 . 7 1 1 A 100 100 LEU HA H 100 3.960 4.028 -0.068 1
1 1178 . 7 1 1 A 100 100 LEU C C 100 179.300 179.116 0.184 1
1 1179 . 7 1 1 A 100 100 LEU CA C 100 57.700 57.705 -0.005 1
1 1180 . 7 1 1 A 100 100 LEU CB C 100 41.300 41.260 0.040 1
1 1184 . 7 1 1 A 100 100 LEU N N 100 120.900 123.118 -2.218 1
1 1185 . 7 1 1 A 101 101 GLN H H 101 7.680 8.406 -0.726 1
1 1186 . 7 1 1 A 101 101 GLN HA H 101 4.100 4.043 0.057 1
1 1193 . 7 1 1 A 101 101 GLN C C 101 178.700 177.837 0.863 1
1 1194 . 7 1 1 A 101 101 GLN CA C 101 58.800 58.866 -0.066 1
1 1195 . 7 1 1 A 101 101 GLN CB C 101 27.900 28.278 -0.378 1
1 1197 . 7 1 1 A 101 101 GLN N N 101 119.100 118.005 1.095 1
1 1199 . 7 1 1 A 102 102 GLU H H 102 7.850 8.282 -0.432 1
1 1200 . 7 1 1 A 102 102 GLU HA H 102 4.050 4.100 -0.050 1
1 1205 . 7 1 1 A 102 102 GLU C C 102 179.100 178.762 0.338 1
1 1206 . 7 1 1 A 102 102 GLU CA C 102 58.400 58.955 -0.555 1
1 1207 . 7 1 1 A 102 102 GLU CB C 102 28.600 28.232 0.368 1
1 1209 . 7 1 1 A 102 102 GLU N N 102 118.400 118.971 -0.571 1
1 1210 . 7 1 1 A 103 103 LEU H H 103 8.080 7.596 0.484 1
1 1211 . 7 1 1 A 103 103 LEU HA H 103 4.020 3.992 0.028 1
1 1221 . 7 1 1 A 103 103 LEU C C 103 178.200 178.525 -0.325 1
1 1222 . 7 1 1 A 103 103 LEU CA C 103 57.000 58.279 -1.279 1
1 1223 . 7 1 1 A 103 103 LEU CB C 103 41.900 41.915 -0.015 1
1 1227 . 7 1 1 A 103 103 LEU N N 103 120.600 123.438 -2.838 1
1 1228 . 7 1 1 A 104 104 GLN H H 104 7.900 8.288 -0.388 1
1 1229 . 7 1 1 A 104 104 GLN HA H 104 4.090 4.047 0.043 1
1 1236 . 7 1 1 A 104 104 GLN C C 104 177.300 177.086 0.214 1
1 1237 . 7 1 1 A 104 104 GLN CA C 104 58.100 58.151 -0.051 1
1 1238 . 7 1 1 A 104 104 GLN CB C 104 29.400 27.638 1.762 1
1 1240 . 7 1 1 A 104 104 GLN N N 104 117.700 117.094 0.606 1
1 1242 . 7 1 1 A 105 105 VAL H H 105 7.620 7.294 0.326 1
1 1243 . 7 1 1 A 105 105 VAL HA H 105 4.190 3.993 0.197 1
1 1251 . 7 1 1 A 105 105 VAL C C 105 176.800 177.341 -0.541 1
1 1252 . 7 1 1 A 105 105 VAL CA C 105 62.600 64.491 -1.891 1
1 1253 . 7 1 1 A 105 105 VAL CB C 105 32.000 31.514 0.486 1
1 1256 . 7 1 1 A 105 105 VAL N N 105 114.900 117.484 -2.584 1
1 1257 . 7 1 1 A 106 106 SER H H 106 7.900 7.476 0.424 1
1 1258 . 7 1 1 A 106 106 SER HA H 106 4.460 4.598 -0.138 1
1 1261 . 7 1 1 A 106 106 SER C C 106 175.000 176.559 -1.559 1
1 1262 . 7 1 1 A 106 106 SER CA C 106 58.900 60.448 -1.548 1
1 1263 . 7 1 1 A 106 106 SER CB C 106 63.900 64.100 -0.200 1
1 1264 . 7 1 1 A 106 106 SER N N 106 116.900 117.289 -0.389 1
1 1265 . 7 1 1 A 107 107 SER H H 107 8.230 8.399 -0.169 1
1 1266 . 7 1 1 A 107 107 SER HA H 107 4.390 4.196 0.194 1
1 1269 . 7 1 1 A 107 107 SER C C 107 174.600 174.747 -0.147 1
1 1270 . 7 1 1 A 107 107 SER CA C 107 58.400 61.094 -2.694 1
1 1271 . 7 1 1 A 107 107 SER CB C 107 63.600 62.997 0.603 1
1 1272 . 7 1 1 A 107 107 SER N N 107 117.500 116.255 1.245 1
1 1273 . 7 1 1 A 108 108 ALA H H 108 8.080 7.918 0.162 1
1 1274 . 7 1 1 A 108 108 ALA HA H 108 4.280 3.960 0.320 1
1 1278 . 7 1 1 A 108 108 ALA C C 108 177.500 175.759 1.741 1
1 1279 . 7 1 1 A 108 108 ALA CA C 108 52.700 53.570 -0.870 1
1 1280 . 7 1 1 A 108 108 ALA CB C 108 19.200 17.908 1.292 1
1 1281 . 7 1 1 A 108 108 ALA N N 108 124.900 120.683 4.217 1
1 1282 . 7 1 1 A 109 109 ALA H H 109 8.080 7.576 0.504 1
1 1283 . 7 1 1 A 109 109 ALA HA H 109 4.280 4.507 -0.227 1
1 1287 . 7 1 1 A 109 109 ALA C C 109 177.700 177.587 0.113 1
1 1288 . 7 1 1 A 109 109 ALA CA C 109 52.400 50.715 1.685 1
1 1289 . 7 1 1 A 109 109 ALA CB C 109 19.400 20.676 -1.276 1
1 1290 . 7 1 1 A 109 109 ALA N N 109 123.000 119.042 3.958 1
1 1291 . 7 1 1 A 110 110 ALA H H 110 8.300 8.610 -0.310 1
1 1292 . 7 1 1 A 110 110 ALA HA H 110 4.280 4.085 0.195 1
1 1296 . 7 1 1 A 110 110 ALA C C 110 178.200 178.395 -0.195 1
1 1297 . 7 1 1 A 110 110 ALA CA C 110 52.700 53.881 -1.181 1
1 1298 . 7 1 1 A 110 110 ALA CB C 110 19.200 19.746 -0.546 1
1 1299 . 7 1 1 A 110 110 ALA N N 110 123.200 123.788 -0.588 1
1 1300 . 7 1 1 A 111 111 GLY H H 111 8.300 7.267 1.033 1
1 1301 . 7 1 1 A 111 111 GLY HA2 H 111 3.930 4.120 -0.190 1
1 1302 . 7 1 1 A 111 111 GLY HA3 H 111 3.940 4.120 -0.180 1
1 1303 . 7 1 1 A 111 111 GLY C C 111 173.700 172.798 0.902 1
1 1304 . 7 1 1 A 111 111 GLY CA C 111 45.100 45.709 -0.609 1
1 1305 . 7 1 1 A 111 111 GLY N N 111 108.000 103.146 4.854 1
1 1306 . 7 1 1 A 112 112 VAL H H 112 7.930 8.133 -0.203 1
1 1307 . 7 1 1 A 112 112 VAL HA H 112 4.420 4.565 -0.145 1
1 1315 . 7 1 1 A 112 112 VAL CA C 112 60.000 58.685 1.315 1
1 1316 . 7 1 1 A 112 112 VAL CB C 112 32.200 34.617 -2.417 1
1 1319 . 7 1 1 A 112 112 VAL N N 112 120.400 121.308 -0.908 1
1 1320 . 7 1 1 A 113 113 PRO HA H 113 4.370 4.707 -0.337 1
1 1327 . 7 1 1 A 113 113 PRO C C 113 177.300 177.945 -0.645 1
1 1328 . 7 1 1 A 113 113 PRO CA C 113 63.900 62.708 1.192 1
1 1329 . 7 1 1 A 113 113 PRO CB C 113 31.800 32.752 -0.952 1
1 1332 . 7 1 1 A 114 114 GLY H H 114 8.570 8.741 -0.171 1
1 1333 . 7 1 1 A 114 114 GLY HA2 H 114 3.880 3.905 -0.025 1
1 1334 . 7 1 1 A 114 114 GLY HA3 H 114 4.120 3.905 0.215 1
1 1335 . 7 1 1 A 114 114 GLY C C 114 174.900 175.256 -0.356 1
1 1336 . 7 1 1 A 114 114 GLY CA C 114 45.200 45.440 -0.240 1
1 1337 . 7 1 1 A 114 114 GLY N N 114 109.000 110.996 -1.996 1
1 1338 . 7 1 1 A 115 115 THR H H 115 7.900 7.863 0.037 1
1 1339 . 7 1 1 A 115 115 THR HA H 115 4.400 4.010 0.390 1
1 1344 . 7 1 1 A 115 115 THR C C 115 174.300 173.776 0.524 1
1 1345 . 7 1 1 A 115 115 THR CA C 115 61.700 64.963 -3.263 1
1 1346 . 7 1 1 A 115 115 THR CB C 115 69.700 69.332 0.368 1
1 1348 . 7 1 1 A 115 115 THR N N 115 111.400 115.813 -4.413 1
1 1349 . 7 1 1 A 116 116 ASN H H 116 8.450 7.752 0.698 1
1 1350 . 7 1 1 A 116 116 ASN HA H 116 4.970 5.175 -0.205 1
1 1355 . 7 1 1 A 116 116 ASN CA C 116 51.500 50.224 1.276 1
1 1356 . 7 1 1 A 116 116 ASN CB C 116 38.900 40.739 -1.839 1
1 1357 . 7 1 1 A 116 116 ASN N N 116 123.100 114.097 9.003 1
1 1359 . 7 1 1 A 117 117 PRO HA H 117 4.370 4.332 0.038 1
1 1366 . 7 1 1 A 117 117 PRO C C 117 178.400 178.006 0.394 1
1 1367 . 7 1 1 A 117 117 PRO CA C 117 64.800 64.513 0.287 1
1 1368 . 7 1 1 A 117 117 PRO CB C 117 32.100 32.026 0.074 1
1 1371 . 7 1 1 A 118 118 VAL H H 118 7.750 7.526 0.224 1
1 1372 . 7 1 1 A 118 118 VAL HA H 118 3.810 3.736 0.074 1
1 1380 . 7 1 1 A 118 118 VAL C C 118 178.300 178.023 0.277 1
1 1381 . 7 1 1 A 118 118 VAL CA C 118 65.200 65.585 -0.385 1
1 1382 . 7 1 1 A 118 118 VAL CB C 118 31.500 31.424 0.076 1
1 1385 . 7 1 1 A 118 118 VAL N N 118 118.300 116.324 1.976 1
1 1386 . 7 1 1 A 119 119 LEU H H 119 7.540 7.859 -0.319 1
1 1387 . 7 1 1 A 119 119 LEU HA H 119 4.030 3.921 0.109 1
1 1397 . 7 1 1 A 119 119 LEU C C 119 178.900 179.586 -0.686 1
1 1398 . 7 1 1 A 119 119 LEU CA C 119 57.800 58.086 -0.286 1
1 1399 . 7 1 1 A 119 119 LEU CB C 119 40.700 41.059 -0.359 1
1 1403 . 7 1 1 A 119 119 LEU N N 119 119.700 120.344 -0.644 1
1 1404 . 7 1 1 A 120 120 ASN H H 120 8.080 8.001 0.079 1
1 1405 . 7 1 1 A 120 120 ASN HA H 120 4.420 4.507 -0.087 1
1 1410 . 7 1 1 A 120 120 ASN C C 120 178.100 178.430 -0.330 1
1 1411 . 7 1 1 A 120 120 ASN CA C 120 56.100 55.912 0.188 1
1 1412 . 7 1 1 A 120 120 ASN CB C 120 37.800 38.234 -0.434 1
1 1413 . 7 1 1 A 120 120 ASN N N 120 117.700 118.619 -0.919 1
1 1415 . 7 1 1 A 121 121 ASN H H 121 8.120 8.244 -0.124 1
1 1416 . 7 1 1 A 121 121 ASN HA H 121 4.490 4.558 -0.068 1
1 1421 . 7 1 1 A 121 121 ASN C C 121 178.000 178.186 -0.186 1
1 1422 . 7 1 1 A 121 121 ASN CA C 121 56.100 56.493 -0.393 1
1 1423 . 7 1 1 A 121 121 ASN CB C 121 37.800 38.257 -0.457 1
1 1424 . 7 1 1 A 121 121 ASN N N 121 120.000 118.947 1.053 1
1 1426 . 7 1 1 A 122 122 LEU H H 122 8.180 8.124 0.056 1
1 1427 . 7 1 1 A 122 122 LEU HA H 122 4.050 3.888 0.162 1
1 1437 . 7 1 1 A 122 122 LEU C C 122 173.800 178.896 -5.096 1
1 1438 . 7 1 1 A 122 122 LEU CA C 122 58.500 57.937 0.563 1
1 1439 . 7 1 1 A 122 122 LEU CB C 122 41.900 41.830 0.070 1
1 1443 . 7 1 1 A 122 122 LEU N N 122 122.600 120.743 1.857 1
1 1444 . 7 1 1 A 123 123 LEU H H 123 8.260 7.691 0.569 1
1 1445 . 7 1 1 A 123 123 LEU HA H 123 3.850 3.975 -0.125 1
1 1455 . 7 1 1 A 123 123 LEU C C 123 178.900 178.348 0.552 1
1 1456 . 7 1 1 A 123 123 LEU CA C 123 58.500 58.180 0.320 1
1 1457 . 7 1 1 A 123 123 LEU CB C 123 41.200 41.543 -0.343 1
1 1461 . 7 1 1 A 123 123 LEU N N 123 119.700 120.562 -0.862 1
1 1462 . 7 1 1 A 124 124 SER H H 124 7.950 8.326 -0.376 1
1 1463 . 7 1 1 A 124 124 SER HA H 124 4.240 4.201 0.039 1
1 1466 . 7 1 1 A 124 124 SER C C 124 177.500 177.179 0.321 1
1 1467 . 7 1 1 A 124 124 SER CA C 124 61.600 61.733 -0.133 1
1 1468 . 7 1 1 A 124 124 SER CB C 124 62.600 62.746 -0.146 1
1 1469 . 7 1 1 A 124 124 SER N N 124 113.400 113.690 -0.290 1
1 1470 . 7 1 1 A 125 125 CYS H H 125 8.040 8.371 -0.331 1
1 1471 . 7 1 1 A 125 125 CYS HA H 125 4.350 4.102 0.248 1
1 1474 . 7 1 1 A 125 125 CYS C C 125 176.800 176.928 -0.128 1
1 1475 . 7 1 1 A 125 125 CYS CA C 125 62.600 63.745 -1.145 1
1 1476 . 7 1 1 A 125 125 CYS CB C 125 27.100 26.591 0.509 1
1 1477 . 7 1 1 A 125 125 CYS N N 125 119.800 119.632 0.168 1
1 1478 . 7 1 1 A 126 126 VAL H H 126 8.290 8.422 -0.132 1
1 1479 . 7 1 1 A 126 126 VAL HA H 126 3.430 3.384 0.046 1
1 1487 . 7 1 1 A 126 126 VAL C C 126 177.800 177.654 0.146 1
1 1488 . 7 1 1 A 126 126 VAL CA C 126 67.100 66.981 0.119 1
1 1489 . 7 1 1 A 126 126 VAL CB C 126 31.400 31.388 0.012 1
1 1492 . 7 1 1 A 126 126 VAL N N 126 121.900 120.565 1.335 1
1 1493 . 7 1 1 A 127 127 GLN H H 127 8.200 8.195 0.005 1
1 1494 . 7 1 1 A 127 127 GLN HA H 127 3.970 3.954 0.016 1
1 1501 . 7 1 1 A 127 127 GLN C C 127 178.200 178.333 -0.133 1
1 1502 . 7 1 1 A 127 127 GLN CA C 127 58.700 58.844 -0.144 1
1 1503 . 7 1 1 A 127 127 GLN CB C 127 27.800 28.581 -0.781 1
1 1505 . 7 1 1 A 127 127 GLN N N 127 119.700 118.438 1.262 1
1 1507 . 7 1 1 A 128 128 GLU H H 128 7.880 7.988 -0.108 1
1 1508 . 7 1 1 A 128 128 GLU HA H 128 4.200 4.033 0.167 1
1 1513 . 7 1 1 A 128 128 GLU C C 128 178.400 178.659 -0.259 1
1 1514 . 7 1 1 A 128 128 GLU CA C 128 59.000 59.049 -0.049 1
1 1515 . 7 1 1 A 128 128 GLU CB C 128 28.400 29.623 -1.223 1
1 1517 . 7 1 1 A 128 128 GLU N N 128 119.800 119.813 -0.013 1
1 1518 . 7 1 1 A 129 129 ILE H H 129 8.000 8.328 -0.328 1
1 1519 . 7 1 1 A 129 129 ILE HA H 129 3.460 3.567 -0.107 1
1 1529 . 7 1 1 A 129 129 ILE C C 129 176.800 178.033 -1.233 1
1 1530 . 7 1 1 A 129 129 ILE CA C 129 66.100 65.496 0.604 1
1 1531 . 7 1 1 A 129 129 ILE CB C 129 38.200 37.462 0.738 1
1 1535 . 7 1 1 A 129 129 ILE N N 129 119.500 120.144 -0.644 1
1 1536 . 7 1 1 A 130 130 SER H H 130 8.040 8.156 -0.116 1
1 1537 . 7 1 1 A 130 130 SER HA H 130 3.780 4.080 -0.300 1
1 1540 . 7 1 1 A 130 130 SER C C 130 176.200 177.073 -0.873 1
1 1541 . 7 1 1 A 130 130 SER CA C 130 62.100 61.609 0.491 1
1 1542 . 7 1 1 A 130 130 SER CB C 130 62.600 62.892 -0.292 1
1 1543 . 7 1 1 A 130 130 SER N N 130 112.800 115.325 -2.525 1
1 1544 . 7 1 1 A 131 131 ASP H H 131 8.270 8.299 -0.029 1
1 1545 . 7 1 1 A 131 131 ASP HA H 131 4.310 4.311 -0.001 1
1 1548 . 7 1 1 A 131 131 ASP C C 131 179.200 178.527 0.673 1
1 1549 . 7 1 1 A 131 131 ASP CA C 131 56.800 57.770 -0.970 1
1 1550 . 7 1 1 A 131 131 ASP CB C 131 40.900 41.708 -0.808 1
1 1551 . 7 1 1 A 131 131 ASP N N 131 119.600 121.083 -1.483 1
1 1552 . 7 1 1 A 132 132 VAL H H 132 8.470 8.341 0.129 1
1 1553 . 7 1 1 A 132 132 VAL HA H 132 3.520 3.697 -0.177 1
1 1561 . 7 1 1 A 132 132 VAL C C 132 178.700 178.484 0.216 1
1 1562 . 7 1 1 A 132 132 VAL CA C 132 66.500 66.554 -0.054 1
1 1563 . 7 1 1 A 132 132 VAL CB C 132 31.500 31.715 -0.215 1
1 1566 . 7 1 1 A 132 132 VAL N N 132 118.100 119.104 -1.004 1
1 1567 . 7 1 1 A 133 133 VAL H H 133 8.140 8.068 0.072 1
1 1568 . 7 1 1 A 133 133 VAL HA H 133 3.770 3.663 0.107 1
1 1576 . 7 1 1 A 133 133 VAL C C 133 176.500 177.981 -1.481 1
1 1577 . 7 1 1 A 133 133 VAL CA C 133 65.100 66.591 -1.491 1
1 1578 . 7 1 1 A 133 133 VAL CB C 133 31.600 31.432 0.168 1
1 1581 . 7 1 1 A 133 133 VAL N N 133 117.000 120.641 -3.641 1
1 1582 . 7 1 1 A 134 134 GLN H H 134 7.490 8.167 -0.677 1
1 1583 . 7 1 1 A 134 134 GLN HA H 134 4.350 4.251 0.099 1
1 1590 . 7 1 1 A 134 134 GLN C C 134 175.400 176.801 -1.401 1
1 1591 . 7 1 1 A 134 134 GLN CA C 134 56.700 57.356 -0.656 1
1 1592 . 7 1 1 A 134 134 GLN CB C 134 30.500 28.301 2.199 1
1 1594 . 7 1 1 A 134 134 GLN N N 134 116.300 118.835 -2.535 1
1 1 . 8 1 1 A 2 2 GLY HA2 H 2 3.890 3.773 0.117 1
1 2 . 8 1 1 A 2 2 GLY HA3 H 2 3.890 3.853 0.037 1
1 3 . 8 1 1 A 2 2 GLY C C 2 174.200 174.445 -0.245 1
1 4 . 8 1 1 A 2 2 GLY CA C 2 44.700 47.409 -2.709 1
1 5 . 8 1 1 A 3 3 HIS H H 3 8.380 8.090 0.290 1
1 6 . 8 1 1 A 3 3 HIS HA H 3 4.610 4.667 -0.057 1
1 9 . 8 1 1 A 3 3 HIS C C 3 174.500 174.819 -0.319 1
1 10 . 8 1 1 A 3 3 HIS CA C 3 55.200 55.738 -0.538 1
1 11 . 8 1 1 A 3 3 HIS CB C 3 28.800 30.955 -2.155 1
1 12 . 8 1 1 A 3 3 HIS N N 3 117.600 118.730 -1.130 1
1 13 . 8 1 1 A 4 4 HIS H H 4 8.520 8.610 -0.090 1
1 14 . 8 1 1 A 4 4 HIS HA H 4 4.640 5.039 -0.399 1
1 17 . 8 1 1 A 4 4 HIS C C 4 174.200 173.635 0.565 1
1 18 . 8 1 1 A 4 4 HIS CA C 4 55.100 53.773 1.327 1
1 19 . 8 1 1 A 4 4 HIS CB C 4 28.900 32.431 -3.531 1
1 20 . 8 1 1 A 4 4 HIS N N 4 119.000 116.048 2.952 1
1 21 . 8 1 1 A 5 5 HIS H H 5 8.530 8.765 -0.235 1
1 22 . 8 1 1 A 5 5 HIS HA H 5 4.410 4.412 -0.002 1
1 25 . 8 1 1 A 5 5 HIS CA C 5 54.900 55.596 -0.696 1
1 26 . 8 1 1 A 5 5 HIS CB C 5 27.300 31.422 -4.122 1
1 27 . 8 1 1 A 5 5 HIS N N 5 121.600 118.300 3.300 1
1 28 . 8 1 1 A 6 6 HIS HA H 6 4.640 4.544 0.096 1
1 31 . 8 1 1 A 6 6 HIS C C 6 174.100 174.941 -0.841 1
1 32 . 8 1 1 A 6 6 HIS CA C 6 55.100 57.684 -2.584 1
1 33 . 8 1 1 A 6 6 HIS CB C 6 29.100 30.682 -1.582 1
1 34 . 8 1 1 A 7 7 HIS H H 7 8.690 8.895 -0.205 1
1 35 . 8 1 1 A 7 7 HIS HA H 7 4.650 5.097 -0.447 1
1 38 . 8 1 1 A 7 7 HIS C C 7 174.200 174.678 -0.478 1
1 39 . 8 1 1 A 7 7 HIS CA C 7 55.200 54.533 0.667 1
1 40 . 8 1 1 A 7 7 HIS CB C 7 29.300 33.151 -3.851 1
1 41 . 8 1 1 A 7 7 HIS N N 7 121.400 122.612 -1.212 1
1 42 . 8 1 1 A 8 8 HIS H H 8 8.660 8.192 0.468 1
1 43 . 8 1 1 A 8 8 HIS HA H 8 4.700 4.428 0.272 1
1 46 . 8 1 1 A 8 8 HIS C C 8 174.200 174.970 -0.770 1
1 47 . 8 1 1 A 8 8 HIS CA C 8 55.000 57.042 -2.042 1
1 48 . 8 1 1 A 8 8 HIS CB C 8 29.300 29.904 -0.604 1
1 49 . 8 1 1 A 8 8 HIS N N 8 120.400 124.113 -3.713 1
1 50 . 8 1 1 A 9 9 SER H H 9 8.490 8.804 -0.314 1
1 51 . 8 1 1 A 9 9 SER HA H 9 4.390 4.683 -0.293 1
1 54 . 8 1 1 A 9 9 SER C C 9 174.100 173.692 0.408 1
1 55 . 8 1 1 A 9 9 SER CA C 9 58.300 58.270 0.030 1
1 56 . 8 1 1 A 9 9 SER CB C 9 63.700 61.512 2.188 1
1 57 . 8 1 1 A 9 9 SER N N 9 118.100 121.053 -2.953 1
1 58 . 8 1 1 A 10 10 HIS H H 10 8.710 9.008 -0.298 1
1 59 . 8 1 1 A 10 10 HIS HA H 10 4.690 4.905 -0.215 1
1 63 . 8 1 1 A 10 10 HIS C C 10 174.200 174.243 -0.043 1
1 64 . 8 1 1 A 10 10 HIS CA C 10 55.200 56.311 -1.111 1
1 65 . 8 1 1 A 10 10 HIS CB C 10 28.800 30.957 -2.157 1
1 66 . 8 1 1 A 10 10 HIS N N 10 120.700 126.737 -6.037 1
1 67 . 8 1 1 A 11 11 MET H H 11 8.410 8.309 0.101 1
1 68 . 8 1 1 A 11 11 MET HA H 11 4.420 4.893 -0.473 1
1 76 . 8 1 1 A 11 11 MET C C 11 175.800 176.070 -0.270 1
1 77 . 8 1 1 A 11 11 MET CA C 11 55.100 53.895 1.205 1
1 78 . 8 1 1 A 11 11 MET CB C 11 32.800 34.349 -1.549 1
1 81 . 8 1 1 A 11 11 MET N N 11 122.300 124.344 -2.044 1
1 82 . 8 1 1 A 12 12 ALA H H 12 8.440 8.558 -0.118 1
1 83 . 8 1 1 A 12 12 ALA HA H 12 4.280 4.524 -0.244 1
1 87 . 8 1 1 A 12 12 ALA C C 12 177.400 178.008 -0.608 1
1 88 . 8 1 1 A 12 12 ALA CA C 12 52.400 50.872 1.528 1
1 89 . 8 1 1 A 12 12 ALA CB C 12 18.800 20.067 -1.267 1
1 90 . 8 1 1 A 12 12 ALA N N 12 125.900 123.623 2.277 1
1 91 . 8 1 1 A 13 13 ASN H H 13 8.440 8.373 0.067 1
1 92 . 8 1 1 A 13 13 ASN HA H 13 4.660 5.231 -0.571 1
1 97 . 8 1 1 A 13 13 ASN C C 13 175.900 176.560 -0.660 1
1 98 . 8 1 1 A 13 13 ASN CA C 13 53.200 54.533 -1.333 1
1 99 . 8 1 1 A 13 13 ASN CB C 13 38.800 38.735 0.065 1
1 100 . 8 1 1 A 13 13 ASN N N 13 118.300 115.237 3.063 1
1 102 . 8 1 1 A 14 14 GLY H H 14 8.370 8.093 0.277 1
1 103 . 8 1 1 A 14 14 GLY HA2 H 14 3.920 4.006 -0.086 1
1 104 . 8 1 1 A 14 14 GLY HA3 H 14 3.920 4.009 -0.089 1
1 105 . 8 1 1 A 14 14 GLY C C 14 174.000 175.044 -1.044 1
1 106 . 8 1 1 A 14 14 GLY CA C 14 45.200 45.844 -0.644 1
1 107 . 8 1 1 A 14 14 GLY N N 14 109.600 108.855 0.745 1
1 108 . 8 1 1 A 15 15 ALA H H 15 8.140 8.287 -0.147 1
1 109 . 8 1 1 A 15 15 ALA HA H 15 4.280 4.382 -0.102 1
1 113 . 8 1 1 A 15 15 ALA C C 15 177.300 176.658 0.642 1
1 114 . 8 1 1 A 15 15 ALA CA C 15 52.500 51.811 0.689 1
1 115 . 8 1 1 A 15 15 ALA CB C 15 19.100 18.796 0.304 1
1 116 . 8 1 1 A 15 15 ALA N N 15 123.800 122.748 1.052 1
1 117 . 8 1 1 A 16 16 ALA H H 16 8.030 8.067 -0.037 1
1 118 . 8 1 1 A 16 16 ALA HA H 16 4.280 4.077 0.203 1
1 122 . 8 1 1 A 16 16 ALA C C 16 178.400 177.858 0.542 1
1 123 . 8 1 1 A 16 16 ALA CA C 16 52.600 53.505 -0.905 1
1 124 . 8 1 1 A 16 16 ALA CB C 16 19.100 17.837 1.263 1
1 125 . 8 1 1 A 16 16 ALA N N 16 122.300 119.386 2.914 1
1 126 . 8 1 1 A 17 17 GLY H H 17 8.320 8.090 0.230 1
1 127 . 8 1 1 A 17 17 GLY HA2 H 17 3.960 4.008 -0.048 1
1 128 . 8 1 1 A 17 17 GLY HA3 H 17 3.960 4.011 -0.051 1
1 129 . 8 1 1 A 17 17 GLY C C 17 174.500 174.715 -0.215 1
1 130 . 8 1 1 A 17 17 GLY CA C 17 45.200 45.477 -0.277 1
1 131 . 8 1 1 A 17 17 GLY N N 17 107.800 104.453 3.347 1
1 132 . 8 1 1 A 18 18 THR H H 18 7.970 7.678 0.292 1
1 133 . 8 1 1 A 18 18 THR HA H 18 4.290 4.215 0.075 1
1 138 . 8 1 1 A 18 18 THR C C 18 174.600 176.253 -1.653 1
1 139 . 8 1 1 A 18 18 THR CA C 18 62.000 65.575 -3.575 1
1 140 . 8 1 1 A 18 18 THR CB C 18 69.700 68.946 0.754 1
1 142 . 8 1 1 A 18 18 THR N N 18 113.800 113.622 0.178 1
1 143 . 8 1 1 A 19 19 LYS H H 19 8.350 8.450 -0.100 1
1 144 . 8 1 1 A 19 19 LYS HA H 19 4.270 4.162 0.108 1
1 153 . 8 1 1 A 19 19 LYS C C 19 176.600 177.095 -0.495 1
1 154 . 8 1 1 A 19 19 LYS CA C 19 56.500 58.949 -2.449 1
1 155 . 8 1 1 A 19 19 LYS CB C 19 32.800 32.140 0.660 1
1 159 . 8 1 1 A 19 19 LYS N N 19 124.000 120.430 3.570 1
1 160 . 8 1 1 A 20 20 VAL H H 20 8.060 7.858 0.202 1
1 161 . 8 1 1 A 20 20 VAL HA H 20 3.990 4.246 -0.256 1
1 169 . 8 1 1 A 20 20 VAL C C 20 175.900 175.515 0.385 1
1 170 . 8 1 1 A 20 20 VAL CA C 20 62.400 62.093 0.307 1
1 171 . 8 1 1 A 20 20 VAL CB C 20 32.600 30.208 2.392 1
1 174 . 8 1 1 A 20 20 VAL N N 20 121.700 119.292 2.408 1
1 175 . 8 1 1 A 21 21 ALA H H 21 8.310 8.387 -0.077 1
1 176 . 8 1 1 A 21 21 ALA HA H 21 4.290 4.407 -0.117 1
1 180 . 8 1 1 A 21 21 ALA C C 21 177.600 178.607 -1.007 1
1 181 . 8 1 1 A 21 21 ALA CA C 21 52.400 53.349 -0.949 1
1 182 . 8 1 1 A 21 21 ALA CB C 21 19.000 20.551 -1.551 1
1 183 . 8 1 1 A 21 21 ALA N N 21 127.700 128.131 -0.431 1
1 184 . 8 1 1 A 22 22 LEU H H 22 8.150 7.934 0.216 1
1 185 . 8 1 1 A 22 22 LEU HA H 22 4.280 4.280 0.000 1
1 195 . 8 1 1 A 22 22 LEU C C 22 177.400 176.089 1.311 1
1 196 . 8 1 1 A 22 22 LEU CA C 22 55.200 54.859 0.341 1
1 197 . 8 1 1 A 22 22 LEU CB C 22 42.200 42.183 0.017 1
1 201 . 8 1 1 A 22 22 LEU N N 22 121.800 116.615 5.185 1
1 202 . 8 1 1 A 23 23 ARG H H 23 8.240 8.019 0.221 1
1 203 . 8 1 1 A 23 23 ARG HA H 23 4.290 4.027 0.263 1
1 211 . 8 1 1 A 23 23 ARG C C 23 176.300 176.226 0.074 1
1 212 . 8 1 1 A 23 23 ARG CA C 23 56.000 56.901 -0.901 1
1 213 . 8 1 1 A 23 23 ARG CB C 23 30.600 28.645 1.955 1
1 216 . 8 1 1 A 23 23 ARG N N 23 122.000 118.875 3.125 1
1 218 . 8 1 1 A 24 24 LYS H H 24 8.370 8.094 0.276 1
1 219 . 8 1 1 A 24 24 LYS HA H 24 4.330 4.293 0.037 1
1 228 . 8 1 1 A 24 24 LYS C C 24 176.800 176.034 0.766 1
1 229 . 8 1 1 A 24 24 LYS CA C 24 56.400 57.511 -1.111 1
1 230 . 8 1 1 A 24 24 LYS CB C 24 32.700 33.016 -0.316 1
1 234 . 8 1 1 A 24 24 LYS N N 24 122.900 119.843 3.057 1
1 235 . 8 1 1 A 25 25 THR H H 25 8.100 7.553 0.547 1
1 236 . 8 1 1 A 25 25 THR HA H 25 4.290 4.705 -0.415 1
1 241 . 8 1 1 A 25 25 THR C C 25 174.600 172.954 1.646 1
1 242 . 8 1 1 A 25 25 THR CA C 25 61.500 59.632 1.868 1
1 243 . 8 1 1 A 25 25 THR CB C 25 69.800 71.448 -1.648 1
1 245 . 8 1 1 A 25 25 THR N N 25 115.500 110.704 4.796 1
1 246 . 8 1 1 A 26 26 LYS H H 26 8.370 8.645 -0.275 1
1 247 . 8 1 1 A 26 26 LYS HA H 26 4.270 4.287 -0.017 1
1 256 . 8 1 1 A 26 26 LYS C C 26 176.600 176.901 -0.301 1
1 257 . 8 1 1 A 26 26 LYS CA C 26 56.600 56.544 0.056 1
1 258 . 8 1 1 A 26 26 LYS CB C 26 32.700 32.877 -0.177 1
1 262 . 8 1 1 A 26 26 LYS N N 26 123.700 123.058 0.642 1
1 263 . 8 1 1 A 27 27 GLN H H 27 8.390 8.918 -0.528 1
1 264 . 8 1 1 A 27 27 GLN HA H 27 4.240 4.549 -0.309 1
1 271 . 8 1 1 A 27 27 GLN C C 27 175.900 176.226 -0.326 1
1 272 . 8 1 1 A 27 27 GLN CA C 27 56.100 56.303 -0.203 1
1 273 . 8 1 1 A 27 27 GLN CB C 27 29.300 29.930 -0.630 1
1 275 . 8 1 1 A 27 27 GLN N N 27 121.700 118.693 3.007 1
1 277 . 8 1 1 A 28 28 ALA H H 28 8.330 7.774 0.556 1
1 278 . 8 1 1 A 28 28 ALA HA H 28 4.240 4.514 -0.274 1
1 282 . 8 1 1 A 28 28 ALA C C 28 177.700 177.345 0.355 1
1 283 . 8 1 1 A 28 28 ALA CA C 28 52.500 51.631 0.869 1
1 284 . 8 1 1 A 28 28 ALA CB C 28 19.100 22.749 -3.649 1
1 285 . 8 1 1 A 28 28 ALA N N 28 125.400 119.552 5.848 1
1 286 . 8 1 1 A 29 29 ALA H H 29 8.250 9.020 -0.770 1
1 287 . 8 1 1 A 29 29 ALA HA H 29 4.230 4.024 0.206 1
1 291 . 8 1 1 A 29 29 ALA C C 29 178.000 179.337 -1.337 1
1 292 . 8 1 1 A 29 29 ALA CA C 29 52.500 54.577 -2.077 1
1 293 . 8 1 1 A 29 29 ALA CB C 29 19.100 18.414 0.686 1
1 294 . 8 1 1 A 29 29 ALA N N 29 123.000 125.624 -2.624 1
1 295 . 8 1 1 A 30 30 GLU H H 30 8.260 8.553 -0.293 1
1 296 . 8 1 1 A 30 30 GLU HA H 30 4.220 4.054 0.166 1
1 301 . 8 1 1 A 30 30 GLU C C 30 176.500 177.899 -1.399 1
1 302 . 8 1 1 A 30 30 GLU CA C 30 56.400 59.256 -2.856 1
1 303 . 8 1 1 A 30 30 GLU CB C 30 29.500 29.063 0.437 1
1 305 . 8 1 1 A 30 30 GLU N N 30 119.700 116.925 2.775 1
1 306 . 8 1 1 A 31 31 LYS H H 31 8.230 7.533 0.697 1
1 307 . 8 1 1 A 31 31 LYS HA H 31 4.280 4.320 -0.040 1
1 316 . 8 1 1 A 31 31 LYS C C 31 176.500 176.710 -0.210 1
1 317 . 8 1 1 A 31 31 LYS CA C 31 56.400 57.028 -0.628 1
1 318 . 8 1 1 A 31 31 LYS CB C 31 32.800 33.458 -0.658 1
1 322 . 8 1 1 A 31 31 LYS N N 31 122.700 117.101 5.599 1
1 323 . 8 1 1 A 32 32 ILE H H 32 8.140 7.665 0.475 1
1 324 . 8 1 1 A 32 32 ILE HA H 32 4.110 4.079 0.031 1
1 334 . 8 1 1 A 32 32 ILE C C 32 176.400 176.056 0.344 1
1 335 . 8 1 1 A 32 32 ILE CA C 32 61.200 62.384 -1.184 1
1 336 . 8 1 1 A 32 32 ILE CB C 32 38.600 38.448 0.152 1
1 340 . 8 1 1 A 32 32 ILE N N 32 122.300 121.062 1.238 1
1 341 . 8 1 1 A 33 33 SER H H 33 8.230 8.878 -0.648 1
1 342 . 8 1 1 A 33 33 SER HA H 33 4.400 4.468 -0.068 1
1 345 . 8 1 1 A 33 33 SER C C 33 174.800 175.770 -0.970 1
1 346 . 8 1 1 A 33 33 SER CA C 33 58.300 58.645 -0.345 1
1 347 . 8 1 1 A 33 33 SER CB C 33 63.700 63.917 -0.217 1
1 348 . 8 1 1 A 33 33 SER N N 33 119.600 122.671 -3.071 1
1 349 . 8 1 1 A 34 34 ALA H H 34 8.430 7.804 0.626 1
1 350 . 8 1 1 A 34 34 ALA HA H 34 4.220 3.918 0.302 1
1 354 . 8 1 1 A 34 34 ALA C C 34 179.500 179.464 0.036 1
1 355 . 8 1 1 A 34 34 ALA CA C 34 53.500 55.172 -1.672 1
1 356 . 8 1 1 A 34 34 ALA CB C 34 18.800 18.604 0.196 1
1 357 . 8 1 1 A 34 34 ALA N N 34 126.000 122.981 3.019 1
1 358 . 8 1 1 A 35 35 ASP H H 35 8.380 8.589 -0.209 1
1 359 . 8 1 1 A 35 35 ASP HA H 35 4.520 4.331 0.189 1
1 362 . 8 1 1 A 35 35 ASP C C 35 176.500 179.262 -2.762 1
1 363 . 8 1 1 A 35 35 ASP CA C 35 54.800 55.781 -0.981 1
1 364 . 8 1 1 A 35 35 ASP CB C 35 40.200 39.133 1.067 1
1 365 . 8 1 1 A 35 35 ASP N N 35 118.200 116.798 1.402 1
1 366 . 8 1 1 A 36 36 LYS H H 36 8.000 7.958 0.042 1
1 367 . 8 1 1 A 36 36 LYS HA H 36 4.270 4.060 0.210 1
1 376 . 8 1 1 A 36 36 LYS C C 36 177.000 177.149 -0.149 1
1 377 . 8 1 1 A 36 36 LYS CA C 36 56.800 58.757 -1.957 1
1 378 . 8 1 1 A 36 36 LYS CB C 36 32.900 31.744 1.156 1
1 382 . 8 1 1 A 36 36 LYS N N 36 120.900 119.490 1.410 1
1 383 . 8 1 1 A 37 37 ILE H H 37 7.970 7.460 0.510 1
1 384 . 8 1 1 A 37 37 ILE HA H 37 4.020 4.010 0.010 1
1 394 . 8 1 1 A 37 37 ILE C C 37 176.100 175.087 1.013 1
1 395 . 8 1 1 A 37 37 ILE CA C 37 61.300 61.629 -0.329 1
1 396 . 8 1 1 A 37 37 ILE CB C 37 38.100 37.177 0.923 1
1 400 . 8 1 1 A 37 37 ILE N N 37 121.800 120.979 0.821 1
1 401 . 8 1 1 A 38 38 SER H H 38 7.980 8.513 -0.533 1
1 402 . 8 1 1 A 38 38 SER HA H 38 4.540 4.688 -0.148 1
1 405 . 8 1 1 A 38 38 SER C C 38 174.700 175.601 -0.901 1
1 406 . 8 1 1 A 38 38 SER CA C 38 58.200 57.743 0.457 1
1 407 . 8 1 1 A 38 38 SER CB C 38 64.400 64.464 -0.064 1
1 408 . 8 1 1 A 38 38 SER N N 38 119.000 124.391 -5.391 1
1 409 . 8 1 1 A 39 39 LYS H H 39 8.690 9.100 -0.410 1
1 410 . 8 1 1 A 39 39 LYS HA H 39 3.400 3.816 -0.416 1
1 419 . 8 1 1 A 39 39 LYS C C 39 177.400 178.186 -0.786 1
1 420 . 8 1 1 A 39 39 LYS CA C 39 59.800 60.496 -0.696 1
1 421 . 8 1 1 A 39 39 LYS CB C 39 32.400 32.178 0.222 1
1 425 . 8 1 1 A 39 39 LYS N N 39 124.200 124.846 -0.646 1
1 426 . 8 1 1 A 40 40 GLU H H 40 8.280 8.411 -0.131 1
1 427 . 8 1 1 A 40 40 GLU HA H 40 3.840 4.081 -0.241 1
1 432 . 8 1 1 A 40 40 GLU C C 40 178.400 178.833 -0.433 1
1 433 . 8 1 1 A 40 40 GLU CA C 40 59.400 59.228 0.172 1
1 434 . 8 1 1 A 40 40 GLU CB C 40 28.300 29.485 -1.185 1
1 436 . 8 1 1 A 40 40 GLU N N 40 116.300 117.370 -1.070 1
1 437 . 8 1 1 A 41 41 ALA H H 41 7.890 7.861 0.029 1
1 438 . 8 1 1 A 41 41 ALA HA H 41 3.910 4.176 -0.266 1
1 442 . 8 1 1 A 41 41 ALA C C 41 179.900 180.325 -0.425 1
1 443 . 8 1 1 A 41 41 ALA CA C 41 54.700 55.269 -0.569 1
1 444 . 8 1 1 A 41 41 ALA CB C 41 17.900 18.220 -0.320 1
1 445 . 8 1 1 A 41 41 ALA N N 41 122.300 122.485 -0.185 1
1 446 . 8 1 1 A 42 42 LEU H H 42 7.490 7.927 -0.437 1
1 447 . 8 1 1 A 42 42 LEU HA H 42 3.480 4.115 -0.635 1
1 457 . 8 1 1 A 42 42 LEU C C 42 178.900 178.655 0.245 1
1 458 . 8 1 1 A 42 42 LEU CA C 42 59.800 58.138 1.662 1
1 459 . 8 1 1 A 42 42 LEU CB C 42 42.300 41.477 0.823 1
1 463 . 8 1 1 A 42 42 LEU N N 42 121.000 119.378 1.622 1
1 464 . 8 1 1 A 43 43 LEU H H 43 8.290 8.017 0.273 1
1 465 . 8 1 1 A 43 43 LEU HA H 43 3.780 3.856 -0.076 1
1 475 . 8 1 1 A 43 43 LEU C C 43 179.400 179.027 0.373 1
1 476 . 8 1 1 A 43 43 LEU CA C 43 57.600 58.029 -0.429 1
1 477 . 8 1 1 A 43 43 LEU CB C 43 40.900 41.436 -0.536 1
1 481 . 8 1 1 A 43 43 LEU N N 43 119.200 118.534 0.666 1
1 482 . 8 1 1 A 44 44 GLU H H 44 8.330 8.258 0.072 1
1 483 . 8 1 1 A 44 44 GLU HA H 44 4.050 3.901 0.149 1
1 488 . 8 1 1 A 44 44 GLU C C 44 178.600 179.336 -0.736 1
1 489 . 8 1 1 A 44 44 GLU CA C 44 58.900 59.346 -0.446 1
1 490 . 8 1 1 A 44 44 GLU CB C 44 28.300 29.475 -1.175 1
1 492 . 8 1 1 A 44 44 GLU N N 44 119.600 117.533 2.067 1
1 493 . 8 1 1 A 45 45 CYS H H 45 7.690 8.240 -0.550 1
1 494 . 8 1 1 A 45 45 CYS HA H 45 4.120 4.015 0.105 1
1 497 . 8 1 1 A 45 45 CYS C C 45 176.100 176.793 -0.693 1
1 498 . 8 1 1 A 45 45 CYS CA C 45 62.500 62.948 -0.448 1
1 499 . 8 1 1 A 45 45 CYS CB C 45 26.200 26.095 0.105 1
1 500 . 8 1 1 A 45 45 CYS N N 45 120.900 118.753 2.147 1
1 501 . 8 1 1 A 46 46 ALA H H 46 8.540 7.911 0.629 1
1 502 . 8 1 1 A 46 46 ALA HA H 46 3.900 3.994 -0.094 1
1 506 . 8 1 1 A 46 46 ALA C C 46 179.200 178.997 0.203 1
1 507 . 8 1 1 A 46 46 ALA CA C 46 55.500 55.309 0.191 1
1 508 . 8 1 1 A 46 46 ALA CB C 46 16.800 18.345 -1.545 1
1 509 . 8 1 1 A 46 46 ALA N N 46 121.500 121.937 -0.437 1
1 510 . 8 1 1 A 47 47 ASP H H 47 8.460 8.281 0.179 1
1 511 . 8 1 1 A 47 47 ASP HA H 47 4.340 4.459 -0.119 1
1 514 . 8 1 1 A 47 47 ASP C C 47 178.800 178.557 0.243 1
1 515 . 8 1 1 A 47 47 ASP CA C 47 56.600 57.155 -0.555 1
1 516 . 8 1 1 A 47 47 ASP CB C 47 39.800 42.068 -2.268 1
1 517 . 8 1 1 A 47 47 ASP N N 47 119.000 118.481 0.519 1
1 518 . 8 1 1 A 48 48 LEU H H 48 8.040 7.581 0.459 1
1 519 . 8 1 1 A 48 48 LEU HA H 48 4.110 3.980 0.130 1
1 529 . 8 1 1 A 48 48 LEU C C 48 180.000 179.709 0.291 1
1 530 . 8 1 1 A 48 48 LEU CA C 48 58.000 58.231 -0.231 1
1 531 . 8 1 1 A 48 48 LEU CB C 48 41.700 41.496 0.204 1
1 535 . 8 1 1 A 48 48 LEU N N 48 123.000 119.385 3.615 1
1 536 . 8 1 1 A 49 49 LEU H H 49 8.300 7.804 0.496 1
1 537 . 8 1 1 A 49 49 LEU HA H 49 4.110 4.011 0.099 1
1 547 . 8 1 1 A 49 49 LEU C C 49 177.200 178.682 -1.482 1
1 548 . 8 1 1 A 49 49 LEU CA C 49 57.600 57.819 -0.219 1
1 549 . 8 1 1 A 49 49 LEU CB C 49 41.200 41.781 -0.581 1
1 553 . 8 1 1 A 49 49 LEU N N 49 120.900 120.063 0.837 1
1 554 . 8 1 1 A 50 50 SER H H 50 8.660 7.891 0.769 1
1 555 . 8 1 1 A 50 50 SER HA H 50 4.000 4.197 -0.197 1
1 558 . 8 1 1 A 50 50 SER C C 50 176.800 176.676 0.124 1
1 559 . 8 1 1 A 50 50 SER CA C 50 62.500 61.652 0.848 1
1 560 . 8 1 1 A 50 50 SER CB C 50 62.600 62.228 0.372 1
1 561 . 8 1 1 A 50 50 SER N N 50 113.300 113.096 0.204 1
1 562 . 8 1 1 A 51 51 SER H H 51 7.980 8.223 -0.243 1
1 563 . 8 1 1 A 51 51 SER HA H 51 4.220 4.070 0.150 1
1 566 . 8 1 1 A 51 51 SER C C 51 176.300 177.208 -0.908 1
1 567 . 8 1 1 A 51 51 SER CA C 51 61.200 61.577 -0.377 1
1 568 . 8 1 1 A 51 51 SER CB C 51 62.700 62.949 -0.249 1
1 569 . 8 1 1 A 51 51 SER N N 51 115.900 117.028 -1.128 1
1 570 . 8 1 1 A 52 52 ALA H H 52 8.030 7.892 0.138 1
1 571 . 8 1 1 A 52 52 ALA HA H 52 4.130 4.174 -0.044 1
1 575 . 8 1 1 A 52 52 ALA C C 52 178.500 180.323 -1.823 1
1 576 . 8 1 1 A 52 52 ALA CA C 52 54.500 54.945 -0.445 1
1 577 . 8 1 1 A 52 52 ALA CB C 52 18.000 18.256 -0.256 1
1 578 . 8 1 1 A 52 52 ALA N N 52 125.400 123.020 2.380 1
1 579 . 8 1 1 A 53 53 LEU H H 53 7.710 8.013 -0.303 1
1 580 . 8 1 1 A 53 53 LEU HA H 53 4.180 4.121 0.059 1
1 590 . 8 1 1 A 53 53 LEU C C 53 177.700 178.174 -0.474 1
1 591 . 8 1 1 A 53 53 LEU CA C 53 56.500 57.320 -0.820 1
1 592 . 8 1 1 A 53 53 LEU CB C 53 42.400 41.621 0.779 1
1 596 . 8 1 1 A 53 53 LEU N N 53 113.800 118.329 -4.529 1
1 597 . 8 1 1 A 54 54 THR H H 54 7.550 7.275 0.275 1
1 598 . 8 1 1 A 54 54 THR HA H 54 4.420 4.372 0.048 1
1 603 . 8 1 1 A 54 54 THR C C 54 174.100 173.256 0.844 1
1 604 . 8 1 1 A 54 54 THR CA C 54 61.600 62.136 -0.536 1
1 605 . 8 1 1 A 54 54 THR CB C 54 69.300 69.403 -0.103 1
1 607 . 8 1 1 A 54 54 THR N N 54 107.700 106.319 1.381 1
1 608 . 8 1 1 A 55 55 GLU H H 55 7.750 7.638 0.112 1
1 609 . 8 1 1 A 55 55 GLU HA H 55 4.760 4.904 -0.144 1
1 614 . 8 1 1 A 55 55 GLU CA C 55 53.400 53.617 -0.217 1
1 615 . 8 1 1 A 55 55 GLU CB C 55 30.100 32.162 -2.062 1
1 617 . 8 1 1 A 55 55 GLU N N 55 122.800 118.311 4.489 1
1 618 . 8 1 1 A 56 56 PRO HA H 56 4.670 4.785 -0.115 1
1 625 . 8 1 1 A 56 56 PRO C C 56 176.200 176.445 -0.245 1
1 626 . 8 1 1 A 56 56 PRO CA C 56 62.900 62.744 0.156 1
1 627 . 8 1 1 A 56 56 PRO CB C 56 29.200 31.616 -2.416 1
1 630 . 8 1 1 A 57 57 VAL H H 57 8.010 8.367 -0.357 1
1 631 . 8 1 1 A 57 57 VAL HA H 57 4.590 4.921 -0.331 1
1 639 . 8 1 1 A 57 57 VAL CA C 57 58.600 58.265 0.335 1
1 640 . 8 1 1 A 57 57 VAL CB C 57 32.800 34.757 -1.957 1
1 643 . 8 1 1 A 57 57 VAL N N 57 121.400 117.389 4.011 1
1 644 . 8 1 1 A 58 58 PRO HA H 58 4.450 4.741 -0.291 1
1 651 . 8 1 1 A 58 58 PRO C C 58 177.500 177.987 -0.487 1
1 652 . 8 1 1 A 58 58 PRO CA C 58 62.600 62.704 -0.104 1
1 653 . 8 1 1 A 58 58 PRO CB C 58 32.200 31.789 0.411 1
1 656 . 8 1 1 A 59 59 ASN H H 59 8.890 8.816 0.074 1
1 657 . 8 1 1 A 59 59 ASN HA H 59 4.330 4.361 -0.031 1
1 662 . 8 1 1 A 59 59 ASN C C 59 177.600 177.637 -0.037 1
1 663 . 8 1 1 A 59 59 ASN CA C 59 56.300 56.295 0.005 1
1 664 . 8 1 1 A 59 59 ASN CB C 59 38.400 38.141 0.259 1
1 665 . 8 1 1 A 59 59 ASN N N 59 122.200 122.170 0.030 1
1 667 . 8 1 1 A 60 60 SER H H 60 8.660 8.128 0.532 1
1 668 . 8 1 1 A 60 60 SER HA H 60 4.010 4.068 -0.058 1
1 671 . 8 1 1 A 60 60 SER C C 60 176.200 175.987 0.213 1
1 672 . 8 1 1 A 60 60 SER CA C 60 60.800 61.645 -0.845 1
1 673 . 8 1 1 A 60 60 SER CB C 60 61.500 62.776 -1.276 1
1 674 . 8 1 1 A 60 60 SER N N 60 113.200 117.066 -3.866 1
1 675 . 8 1 1 A 61 61 GLN H H 61 7.420 7.948 -0.528 1
1 676 . 8 1 1 A 61 61 GLN HA H 61 4.280 3.997 0.283 1
1 683 . 8 1 1 A 61 61 GLN C C 61 178.600 178.669 -0.069 1
1 684 . 8 1 1 A 61 61 GLN CA C 61 57.900 58.833 -0.933 1
1 685 . 8 1 1 A 61 61 GLN CB C 61 28.600 28.104 0.496 1
1 687 . 8 1 1 A 61 61 GLN N N 61 122.200 121.076 1.124 1
1 689 . 8 1 1 A 62 62 LEU H H 62 7.430 7.838 -0.408 1
1 690 . 8 1 1 A 62 62 LEU HA H 62 3.850 4.017 -0.167 1
1 700 . 8 1 1 A 62 62 LEU C C 62 178.800 178.905 -0.105 1
1 701 . 8 1 1 A 62 62 LEU CA C 62 57.900 58.047 -0.147 1
1 702 . 8 1 1 A 62 62 LEU CB C 62 42.100 42.161 -0.061 1
1 706 . 8 1 1 A 62 62 LEU N N 62 120.600 119.983 0.617 1
1 707 . 8 1 1 A 63 63 VAL H H 63 8.200 8.095 0.105 1
1 708 . 8 1 1 A 63 63 VAL HA H 63 3.370 3.307 0.063 1
1 716 . 8 1 1 A 63 63 VAL C C 63 178.000 177.496 0.504 1
1 717 . 8 1 1 A 63 63 VAL CA C 63 66.600 66.780 -0.180 1
1 718 . 8 1 1 A 63 63 VAL CB C 63 31.700 31.052 0.648 1
1 721 . 8 1 1 A 63 63 VAL N N 63 118.200 117.553 0.647 1
1 722 . 8 1 1 A 64 64 ASP H H 64 7.960 8.245 -0.285 1
1 723 . 8 1 1 A 64 64 ASP HA H 64 4.460 4.222 0.238 1
1 726 . 8 1 1 A 64 64 ASP C C 64 178.100 178.509 -0.409 1
1 727 . 8 1 1 A 64 64 ASP CA C 64 57.700 57.255 0.445 1
1 728 . 8 1 1 A 64 64 ASP CB C 64 39.800 41.482 -1.682 1
1 729 . 8 1 1 A 64 64 ASP N N 64 120.200 120.114 0.086 1
1 730 . 8 1 1 A 65 65 THR H H 65 8.380 8.379 0.001 1
1 731 . 8 1 1 A 65 65 THR HA H 65 3.970 3.908 0.062 1
1 736 . 8 1 1 A 65 65 THR C C 65 176.500 177.112 -0.612 1
1 737 . 8 1 1 A 65 65 THR CA C 65 66.500 66.653 -0.153 1
1 738 . 8 1 1 A 65 65 THR CB C 65 67.800 67.963 -0.163 1
1 740 . 8 1 1 A 65 65 THR N N 65 118.100 115.255 2.845 1
1 741 . 8 1 1 A 66 66 GLY H H 66 8.900 8.158 0.742 1
1 742 . 8 1 1 A 66 66 GLY HA2 H 66 3.630 3.642 -0.012 1
1 743 . 8 1 1 A 66 66 GLY HA3 H 66 3.630 3.673 -0.043 1
1 744 . 8 1 1 A 66 66 GLY C C 66 174.200 176.531 -2.331 1
1 745 . 8 1 1 A 66 66 GLY CA C 66 47.500 47.065 0.435 1
1 746 . 8 1 1 A 66 66 GLY N N 66 110.500 107.560 2.940 1
1 747 . 8 1 1 A 67 67 HIS H H 67 8.650 7.412 1.238 1
1 748 . 8 1 1 A 67 67 HIS HA H 67 4.220 4.653 -0.433 1
1 752 . 8 1 1 A 67 67 HIS C C 67 176.900 177.812 -0.912 1
1 753 . 8 1 1 A 67 67 HIS CA C 67 59.000 58.104 0.896 1
1 754 . 8 1 1 A 67 67 HIS CB C 67 27.800 29.502 -1.702 1
1 756 . 8 1 1 A 67 67 HIS N N 67 120.100 120.296 -0.196 1
1 757 . 8 1 1 A 68 68 GLN H H 68 7.860 8.269 -0.409 1
1 758 . 8 1 1 A 68 68 GLN HA H 68 3.990 4.049 -0.059 1
1 765 . 8 1 1 A 68 68 GLN C C 68 177.800 178.063 -0.263 1
1 766 . 8 1 1 A 68 68 GLN CA C 68 58.800 58.584 0.216 1
1 767 . 8 1 1 A 68 68 GLN CB C 68 28.200 27.497 0.703 1
1 769 . 8 1 1 A 68 68 GLN N N 68 121.400 116.968 4.432 1
1 771 . 8 1 1 A 69 69 LEU H H 69 8.300 8.156 0.144 1
1 772 . 8 1 1 A 69 69 LEU HA H 69 4.330 3.964 0.366 1
1 782 . 8 1 1 A 69 69 LEU C C 69 179.300 179.500 -0.200 1
1 783 . 8 1 1 A 69 69 LEU CA C 69 58.200 57.989 0.211 1
1 784 . 8 1 1 A 69 69 LEU CB C 69 40.500 41.559 -1.059 1
1 788 . 8 1 1 A 69 69 LEU N N 69 120.300 121.904 -1.604 1
1 789 . 8 1 1 A 70 70 LEU H H 70 8.460 7.986 0.474 1
1 790 . 8 1 1 A 70 70 LEU HA H 70 3.880 3.975 -0.095 1
1 800 . 8 1 1 A 70 70 LEU C C 70 179.100 179.500 -0.400 1
1 801 . 8 1 1 A 70 70 LEU CA C 70 58.300 58.097 0.203 1
1 802 . 8 1 1 A 70 70 LEU CB C 70 41.500 41.042 0.458 1
1 806 . 8 1 1 A 70 70 LEU N N 70 121.200 119.162 2.038 1
1 807 . 8 1 1 A 71 71 ASP H H 71 8.140 8.003 0.137 1
1 808 . 8 1 1 A 71 71 ASP HA H 71 4.420 4.406 0.014 1
1 811 . 8 1 1 A 71 71 ASP C C 71 180.000 178.475 1.525 1
1 812 . 8 1 1 A 71 71 ASP CA C 71 57.300 57.376 -0.076 1
1 813 . 8 1 1 A 71 71 ASP CB C 71 39.300 41.177 -1.877 1
1 814 . 8 1 1 A 71 71 ASP N N 71 121.100 119.479 1.621 1
1 815 . 8 1 1 A 72 72 TYR H H 72 8.320 8.708 -0.388 1
1 816 . 8 1 1 A 72 72 TYR HA H 72 4.550 4.522 0.028 1
1 823 . 8 1 1 A 72 72 TYR C C 72 179.100 178.650 0.450 1
1 824 . 8 1 1 A 72 72 TYR CA C 72 60.500 60.725 -0.225 1
1 825 . 8 1 1 A 72 72 TYR CB C 72 37.600 38.211 -0.611 1
1 828 . 8 1 1 A 72 72 TYR N N 72 120.300 118.064 2.236 1
1 829 . 8 1 1 A 73 73 CYS H H 73 8.850 8.666 0.184 1
1 830 . 8 1 1 A 73 73 CYS HA H 73 4.380 4.629 -0.249 1
1 834 . 8 1 1 A 73 73 CYS C C 73 177.300 177.263 0.037 1
1 835 . 8 1 1 A 73 73 CYS CA C 73 64.400 63.422 0.978 1
1 836 . 8 1 1 A 73 73 CYS CB C 73 27.600 26.413 1.187 1
1 837 . 8 1 1 A 73 73 CYS N N 73 116.800 118.687 -1.887 1
1 838 . 8 1 1 A 74 74 SER H H 74 8.410 8.275 0.135 1
1 839 . 8 1 1 A 74 74 SER HA H 74 4.290 4.302 -0.012 1
1 842 . 8 1 1 A 74 74 SER C C 74 176.300 176.760 -0.460 1
1 843 . 8 1 1 A 74 74 SER CA C 74 61.400 61.133 0.267 1
1 844 . 8 1 1 A 74 74 SER CB C 74 62.600 63.133 -0.533 1
1 845 . 8 1 1 A 74 74 SER N N 74 115.900 116.154 -0.254 1
1 846 . 8 1 1 A 75 75 GLY H H 75 7.790 8.095 -0.305 1
1 847 . 8 1 1 A 75 75 GLY HA2 H 75 4.320 3.704 0.616 1
1 848 . 8 1 1 A 75 75 GLY HA3 H 75 3.900 3.707 0.193 1
1 849 . 8 1 1 A 75 75 GLY C C 75 174.600 175.240 -0.640 1
1 850 . 8 1 1 A 75 75 GLY CA C 75 45.600 46.989 -1.389 1
1 851 . 8 1 1 A 75 75 GLY N N 75 107.500 107.193 0.307 1
1 852 . 8 1 1 A 76 76 TYR H H 76 8.040 8.468 -0.428 1
1 853 . 8 1 1 A 76 76 TYR HA H 76 4.310 3.985 0.325 1
1 860 . 8 1 1 A 76 76 TYR C C 76 176.200 177.741 -1.541 1
1 861 . 8 1 1 A 76 76 TYR CA C 76 60.000 61.029 -1.029 1
1 862 . 8 1 1 A 76 76 TYR CB C 76 40.700 38.477 2.223 1
1 865 . 8 1 1 A 76 76 TYR N N 76 121.900 123.462 -1.562 1
1 866 . 8 1 1 A 77 77 VAL H H 77 7.540 8.267 -0.727 1
1 867 . 8 1 1 A 77 77 VAL HA H 77 3.450 3.462 -0.012 1
1 875 . 8 1 1 A 77 77 VAL C C 77 175.500 177.334 -1.834 1
1 876 . 8 1 1 A 77 77 VAL CA C 77 65.500 64.305 1.195 1
1 877 . 8 1 1 A 77 77 VAL CB C 77 31.600 31.199 0.401 1
1 880 . 8 1 1 A 77 77 VAL N N 77 116.600 119.454 -2.854 1
1 881 . 8 1 1 A 78 78 ASP H H 78 7.580 8.130 -0.550 1
1 882 . 8 1 1 A 78 78 ASP HA H 78 4.380 4.365 0.015 1
1 885 . 8 1 1 A 78 78 ASP C C 78 177.000 177.247 -0.247 1
1 886 . 8 1 1 A 78 78 ASP CA C 78 55.800 57.383 -1.583 1
1 887 . 8 1 1 A 78 78 ASP CB C 78 39.900 41.409 -1.509 1
1 888 . 8 1 1 A 78 78 ASP N N 78 116.400 120.579 -4.179 1
1 889 . 8 1 1 A 79 79 CYS H H 79 8.040 7.728 0.312 1
1 890 . 8 1 1 A 79 79 CYS HA H 79 4.110 4.449 -0.339 1
1 893 . 8 1 1 A 79 79 CYS C C 79 174.200 174.366 -0.166 1
1 894 . 8 1 1 A 79 79 CYS CA C 79 58.600 57.704 0.896 1
1 895 . 8 1 1 A 79 79 CYS CB C 79 27.200 28.073 -0.873 1
1 896 . 8 1 1 A 79 79 CYS N N 79 117.000 114.622 2.378 1
1 897 . 8 1 1 A 80 80 ILE H H 80 6.960 7.098 -0.138 1
1 898 . 8 1 1 A 80 80 ILE HA H 80 4.120 4.089 0.031 1
1 908 . 8 1 1 A 80 80 ILE CA C 80 58.700 59.368 -0.668 1
1 909 . 8 1 1 A 80 80 ILE CB C 80 38.500 37.832 0.668 1
1 913 . 8 1 1 A 80 80 ILE N N 80 123.200 122.845 0.355 1
1 914 . 8 1 1 A 81 81 PRO HA H 81 4.340 4.312 0.028 1
1 921 . 8 1 1 A 81 81 PRO C C 81 178.000 176.536 1.464 1
1 922 . 8 1 1 A 81 81 PRO CA C 81 64.700 65.841 -1.141 1
1 923 . 8 1 1 A 81 81 PRO CB C 81 32.600 31.617 0.983 1
1 926 . 8 1 1 A 82 82 GLN H H 82 7.560 8.522 -0.962 1
1 927 . 8 1 1 A 82 82 GLN HA H 82 4.600 4.363 0.237 1
1 934 . 8 1 1 A 82 82 GLN C C 82 177.400 176.514 0.886 1
1 935 . 8 1 1 A 82 82 GLN CA C 82 55.600 56.012 -0.412 1
1 936 . 8 1 1 A 82 82 GLN CB C 82 28.800 29.294 -0.494 1
1 938 . 8 1 1 A 82 82 GLN N N 82 115.900 117.122 -1.222 1
1 940 . 8 1 1 A 83 83 THR H H 83 8.880 8.551 0.329 1
1 941 . 8 1 1 A 83 83 THR HA H 83 3.750 3.924 -0.174 1
1 946 . 8 1 1 A 83 83 THR C C 83 176.300 176.503 -0.203 1
1 947 . 8 1 1 A 83 83 THR CA C 83 66.500 66.661 -0.161 1
1 948 . 8 1 1 A 83 83 THR CB C 83 68.700 68.846 -0.146 1
1 950 . 8 1 1 A 83 83 THR N N 83 122.700 119.500 3.200 1
1 951 . 8 1 1 A 84 84 ARG H H 84 8.990 8.179 0.811 1
1 952 . 8 1 1 A 84 84 ARG HA H 84 4.250 4.050 0.200 1
1 960 . 8 1 1 A 84 84 ARG C C 84 178.900 178.845 0.055 1
1 961 . 8 1 1 A 84 84 ARG CA C 84 59.100 59.551 -0.451 1
1 962 . 8 1 1 A 84 84 ARG CB C 84 29.300 29.985 -0.685 1
1 965 . 8 1 1 A 84 84 ARG N N 84 120.100 121.599 -1.499 1
1 967 . 8 1 1 A 85 85 ASN H H 85 7.270 8.213 -0.943 1
1 968 . 8 1 1 A 85 85 ASN HA H 85 4.810 4.644 0.166 1
1 973 . 8 1 1 A 85 85 ASN C C 85 176.800 177.843 -1.043 1
1 974 . 8 1 1 A 85 85 ASN CA C 85 54.800 56.432 -1.632 1
1 975 . 8 1 1 A 85 85 ASN CB C 85 37.600 38.265 -0.665 1
1 976 . 8 1 1 A 85 85 ASN N N 85 117.400 118.380 -0.980 1
1 978 . 8 1 1 A 86 86 LYS H H 86 8.340 8.254 0.086 1
1 979 . 8 1 1 A 86 86 LYS HA H 86 3.890 4.061 -0.171 1
1 988 . 8 1 1 A 86 86 LYS C C 86 178.600 179.083 -0.483 1
1 989 . 8 1 1 A 86 86 LYS CA C 86 60.800 59.019 1.781 1
1 990 . 8 1 1 A 86 86 LYS CB C 86 32.700 32.130 0.570 1
1 994 . 8 1 1 A 86 86 LYS N N 86 124.200 120.887 3.313 1
1 995 . 8 1 1 A 87 87 PHE H H 87 8.120 8.846 -0.726 1
1 996 . 8 1 1 A 87 87 PHE HA H 87 4.260 4.171 0.089 1
1 1004 . 8 1 1 A 87 87 PHE C C 87 178.100 177.543 0.557 1
1 1005 . 8 1 1 A 87 87 PHE CA C 87 61.300 61.660 -0.360 1
1 1006 . 8 1 1 A 87 87 PHE CB C 87 38.200 39.294 -1.094 1
1 1010 . 8 1 1 A 87 87 PHE N N 87 118.300 121.047 -2.747 1
1 1011 . 8 1 1 A 88 88 ALA H H 88 7.860 8.408 -0.548 1
1 1012 . 8 1 1 A 88 88 ALA HA H 88 4.200 4.377 -0.177 1
1 1016 . 8 1 1 A 88 88 ALA C C 88 180.600 179.651 0.949 1
1 1017 . 8 1 1 A 88 88 ALA CA C 88 54.900 55.143 -0.243 1
1 1018 . 8 1 1 A 88 88 ALA CB C 88 18.100 17.762 0.338 1
1 1019 . 8 1 1 A 88 88 ALA N N 88 121.700 121.065 0.635 1
1 1020 . 8 1 1 A 89 89 PHE H H 89 8.690 8.668 0.022 1
1 1021 . 8 1 1 A 89 89 PHE HA H 89 4.080 4.155 -0.075 1
1 1029 . 8 1 1 A 89 89 PHE C C 89 176.300 177.529 -1.229 1
1 1030 . 8 1 1 A 89 89 PHE CA C 89 62.000 61.094 0.906 1
1 1031 . 8 1 1 A 89 89 PHE CB C 89 39.800 39.425 0.375 1
1 1035 . 8 1 1 A 89 89 PHE N N 89 120.100 120.351 -0.251 1
1 1036 . 8 1 1 A 90 90 ARG H H 90 8.560 8.113 0.447 1
1 1037 . 8 1 1 A 90 90 ARG HA H 90 3.790 3.867 -0.077 1
1 1045 . 8 1 1 A 90 90 ARG C C 90 179.600 178.421 1.179 1
1 1046 . 8 1 1 A 90 90 ARG CA C 90 60.000 59.720 0.280 1
1 1047 . 8 1 1 A 90 90 ARG CB C 90 30.000 30.219 -0.219 1
1 1050 . 8 1 1 A 90 90 ARG N N 90 118.000 117.964 0.036 1
1 1052 . 8 1 1 A 91 91 GLU H H 91 8.120 8.199 -0.079 1
1 1053 . 8 1 1 A 91 91 GLU HA H 91 3.980 3.914 0.066 1
1 1058 . 8 1 1 A 91 91 GLU C C 91 178.400 178.900 -0.500 1
1 1059 . 8 1 1 A 91 91 GLU CA C 91 58.900 59.211 -0.311 1
1 1060 . 8 1 1 A 91 91 GLU CB C 91 28.800 29.136 -0.336 1
1 1062 . 8 1 1 A 91 91 GLU N N 91 119.300 118.145 1.155 1
1 1063 . 8 1 1 A 92 92 ALA H H 92 7.820 7.600 0.220 1
1 1064 . 8 1 1 A 92 92 ALA HA H 92 4.050 3.979 0.071 1
1 1068 . 8 1 1 A 92 92 ALA C C 92 179.800 179.746 0.054 1
1 1069 . 8 1 1 A 92 92 ALA CA C 92 55.000 55.148 -0.148 1
1 1070 . 8 1 1 A 92 92 ALA CB C 92 18.000 18.306 -0.306 1
1 1071 . 8 1 1 A 92 92 ALA N N 92 123.400 122.291 1.109 1
1 1072 . 8 1 1 A 93 93 VAL H H 93 8.430 7.943 0.487 1
1 1073 . 8 1 1 A 93 93 VAL HA H 93 3.250 3.309 -0.059 1
1 1081 . 8 1 1 A 93 93 VAL C C 93 177.900 178.030 -0.130 1
1 1082 . 8 1 1 A 93 93 VAL CA C 93 66.800 66.731 0.069 1
1 1083 . 8 1 1 A 93 93 VAL CB C 93 31.300 31.166 0.134 1
1 1086 . 8 1 1 A 93 93 VAL N N 93 119.900 118.613 1.287 1
1 1087 . 8 1 1 A 94 94 SER H H 94 7.990 8.157 -0.167 1
1 1088 . 8 1 1 A 94 94 SER HA H 94 4.230 3.966 0.264 1
1 1091 . 8 1 1 A 94 94 SER C C 94 177.200 176.598 0.602 1
1 1092 . 8 1 1 A 94 94 SER CA C 94 61.600 61.460 0.140 1
1 1093 . 8 1 1 A 94 94 SER CB C 94 62.700 62.919 -0.219 1
1 1094 . 8 1 1 A 94 94 SER N N 94 116.000 116.613 -0.613 1
1 1095 . 8 1 1 A 95 95 LYS H H 95 7.710 7.673 0.037 1
1 1096 . 8 1 1 A 95 95 LYS HA H 95 4.020 4.062 -0.042 1
1 1105 . 8 1 1 A 95 95 LYS C C 95 179.400 179.249 0.151 1
1 1106 . 8 1 1 A 95 95 LYS CA C 95 59.600 59.108 0.492 1
1 1107 . 8 1 1 A 95 95 LYS CB C 95 32.300 32.279 0.021 1
1 1111 . 8 1 1 A 95 95 LYS N N 95 121.400 121.814 -0.414 1
1 1112 . 8 1 1 A 96 96 LEU H H 96 8.270 8.013 0.257 1
1 1113 . 8 1 1 A 96 96 LEU HA H 96 4.040 3.911 0.129 1
1 1123 . 8 1 1 A 96 96 LEU C C 96 177.700 178.260 -0.560 1
1 1124 . 8 1 1 A 96 96 LEU CA C 96 58.600 58.248 0.352 1
1 1125 . 8 1 1 A 96 96 LEU CB C 96 41.000 41.749 -0.749 1
1 1129 . 8 1 1 A 96 96 LEU N N 96 124.800 121.299 3.501 1
1 1130 . 8 1 1 A 97 97 GLU H H 97 8.500 8.447 0.053 1
1 1131 . 8 1 1 A 97 97 GLU HA H 97 3.760 4.045 -0.285 1
1 1136 . 8 1 1 A 97 97 GLU C C 97 179.100 179.302 -0.202 1
1 1137 . 8 1 1 A 97 97 GLU CA C 97 59.900 59.075 0.825 1
1 1138 . 8 1 1 A 97 97 GLU CB C 97 28.700 29.265 -0.565 1
1 1140 . 8 1 1 A 97 97 GLU N N 97 119.000 117.399 1.601 1
1 1141 . 8 1 1 A 98 98 LEU H H 98 7.740 8.343 -0.603 1
1 1142 . 8 1 1 A 98 98 LEU HA H 98 4.110 3.971 0.139 1
1 1152 . 8 1 1 A 98 98 LEU C C 98 179.700 179.061 0.639 1
1 1153 . 8 1 1 A 98 98 LEU CA C 98 57.900 57.840 0.060 1
1 1154 . 8 1 1 A 98 98 LEU CB C 98 41.800 41.584 0.216 1
1 1158 . 8 1 1 A 98 98 LEU N N 98 119.200 121.162 -1.962 1
1 1159 . 8 1 1 A 99 99 SER H H 99 8.290 8.119 0.171 1
1 1160 . 8 1 1 A 99 99 SER HA H 99 4.220 4.165 0.055 1
1 1163 . 8 1 1 A 99 99 SER C C 99 176.600 176.663 -0.063 1
1 1164 . 8 1 1 A 99 99 SER CA C 99 62.400 62.399 0.001 1
1 1165 . 8 1 1 A 99 99 SER CB C 99 63.200 62.717 0.483 1
1 1166 . 8 1 1 A 99 99 SER N N 99 116.300 113.754 2.546 1
1 1167 . 8 1 1 A 100 100 LEU H H 100 8.490 8.272 0.218 1
1 1168 . 8 1 1 A 100 100 LEU HA H 100 3.960 3.964 -0.004 1
1 1178 . 8 1 1 A 100 100 LEU C C 100 179.300 179.740 -0.440 1
1 1179 . 8 1 1 A 100 100 LEU CA C 100 57.700 57.923 -0.223 1
1 1180 . 8 1 1 A 100 100 LEU CB C 100 41.300 41.178 0.122 1
1 1184 . 8 1 1 A 100 100 LEU N N 100 120.900 122.480 -1.580 1
1 1185 . 8 1 1 A 101 101 GLN H H 101 7.680 8.649 -0.969 1
1 1186 . 8 1 1 A 101 101 GLN HA H 101 4.100 4.021 0.079 1
1 1193 . 8 1 1 A 101 101 GLN C C 101 178.700 177.755 0.945 1
1 1194 . 8 1 1 A 101 101 GLN CA C 101 58.800 58.854 -0.054 1
1 1195 . 8 1 1 A 101 101 GLN CB C 101 27.900 27.744 0.156 1
1 1197 . 8 1 1 A 101 101 GLN N N 101 119.100 118.092 1.008 1
1 1199 . 8 1 1 A 102 102 GLU H H 102 7.850 8.104 -0.254 1
1 1200 . 8 1 1 A 102 102 GLU HA H 102 4.050 4.119 -0.069 1
1 1205 . 8 1 1 A 102 102 GLU C C 102 179.100 179.018 0.082 1
1 1206 . 8 1 1 A 102 102 GLU CA C 102 58.400 59.209 -0.809 1
1 1207 . 8 1 1 A 102 102 GLU CB C 102 28.600 29.227 -0.627 1
1 1209 . 8 1 1 A 102 102 GLU N N 102 118.400 118.900 -0.500 1
1 1210 . 8 1 1 A 103 103 LEU H H 103 8.080 8.233 -0.153 1
1 1211 . 8 1 1 A 103 103 LEU HA H 103 4.020 3.971 0.049 1
1 1221 . 8 1 1 A 103 103 LEU C C 103 178.200 178.386 -0.186 1
1 1222 . 8 1 1 A 103 103 LEU CA C 103 57.000 58.297 -1.297 1
1 1223 . 8 1 1 A 103 103 LEU CB C 103 41.900 41.716 0.184 1
1 1227 . 8 1 1 A 103 103 LEU N N 103 120.600 123.324 -2.724 1
1 1228 . 8 1 1 A 104 104 GLN H H 104 7.900 8.410 -0.510 1
1 1229 . 8 1 1 A 104 104 GLN HA H 104 4.090 4.125 -0.035 1
1 1236 . 8 1 1 A 104 104 GLN C C 104 177.300 176.968 0.332 1
1 1237 . 8 1 1 A 104 104 GLN CA C 104 58.100 58.093 0.007 1
1 1238 . 8 1 1 A 104 104 GLN CB C 104 29.400 27.515 1.885 1
1 1240 . 8 1 1 A 104 104 GLN N N 104 117.700 116.739 0.961 1
1 1242 . 8 1 1 A 105 105 VAL H H 105 7.620 7.515 0.105 1
1 1243 . 8 1 1 A 105 105 VAL HA H 105 4.190 4.207 -0.017 1
1 1251 . 8 1 1 A 105 105 VAL C C 105 176.800 177.864 -1.064 1
1 1252 . 8 1 1 A 105 105 VAL CA C 105 62.600 62.770 -0.170 1
1 1253 . 8 1 1 A 105 105 VAL CB C 105 32.000 32.844 -0.844 1
1 1256 . 8 1 1 A 105 105 VAL N N 105 114.900 116.338 -1.438 1
1 1257 . 8 1 1 A 106 106 SER H H 106 7.900 8.246 -0.346 1
1 1258 . 8 1 1 A 106 106 SER HA H 106 4.460 4.448 0.012 1
1 1261 . 8 1 1 A 106 106 SER C C 106 175.000 176.647 -1.647 1
1 1262 . 8 1 1 A 106 106 SER CA C 106 58.900 60.422 -1.522 1
1 1263 . 8 1 1 A 106 106 SER CB C 106 63.900 63.705 0.195 1
1 1264 . 8 1 1 A 106 106 SER N N 106 116.900 118.303 -1.403 1
1 1265 . 8 1 1 A 107 107 SER H H 107 8.230 8.071 0.159 1
1 1266 . 8 1 1 A 107 107 SER HA H 107 4.390 4.096 0.294 1
1 1269 . 8 1 1 A 107 107 SER C C 107 174.600 174.719 -0.119 1
1 1270 . 8 1 1 A 107 107 SER CA C 107 58.400 62.182 -3.782 1
1 1271 . 8 1 1 A 107 107 SER CB C 107 63.600 63.025 0.575 1
1 1272 . 8 1 1 A 107 107 SER N N 107 117.500 119.763 -2.263 1
1 1273 . 8 1 1 A 108 108 ALA H H 108 8.080 7.785 0.295 1
1 1274 . 8 1 1 A 108 108 ALA HA H 108 4.280 3.927 0.353 1
1 1278 . 8 1 1 A 108 108 ALA C C 108 177.500 177.968 -0.468 1
1 1279 . 8 1 1 A 108 108 ALA CA C 108 52.700 55.126 -2.426 1
1 1280 . 8 1 1 A 108 108 ALA CB C 108 19.200 17.129 2.071 1
1 1281 . 8 1 1 A 108 108 ALA N N 108 124.900 120.983 3.917 1
1 1282 . 8 1 1 A 109 109 ALA H H 109 8.080 8.502 -0.422 1
1 1283 . 8 1 1 A 109 109 ALA HA H 109 4.280 4.279 0.001 1
1 1287 . 8 1 1 A 109 109 ALA C C 109 177.700 178.247 -0.547 1
1 1288 . 8 1 1 A 109 109 ALA CA C 109 52.400 52.034 0.366 1
1 1289 . 8 1 1 A 109 109 ALA CB C 109 19.400 19.170 0.230 1
1 1290 . 8 1 1 A 109 109 ALA N N 109 123.000 120.419 2.581 1
1 1291 . 8 1 1 A 110 110 ALA H H 110 8.300 8.088 0.212 1
1 1292 . 8 1 1 A 110 110 ALA HA H 110 4.280 3.917 0.363 1
1 1296 . 8 1 1 A 110 110 ALA C C 110 178.200 177.199 1.001 1
1 1297 . 8 1 1 A 110 110 ALA CA C 110 52.700 55.162 -2.462 1
1 1298 . 8 1 1 A 110 110 ALA CB C 110 19.200 17.668 1.532 1
1 1299 . 8 1 1 A 110 110 ALA N N 110 123.200 118.450 4.750 1
1 1300 . 8 1 1 A 111 111 GLY H H 111 8.300 8.263 0.037 1
1 1301 . 8 1 1 A 111 111 GLY HA2 H 111 3.930 4.120 -0.190 1
1 1302 . 8 1 1 A 111 111 GLY HA3 H 111 3.940 4.121 -0.181 1
1 1303 . 8 1 1 A 111 111 GLY C C 111 173.700 172.372 1.328 1
1 1304 . 8 1 1 A 111 111 GLY CA C 111 45.100 45.607 -0.507 1
1 1305 . 8 1 1 A 111 111 GLY N N 111 108.000 103.138 4.862 1
1 1306 . 8 1 1 A 112 112 VAL H H 112 7.930 8.336 -0.406 1
1 1307 . 8 1 1 A 112 112 VAL HA H 112 4.420 4.577 -0.157 1
1 1315 . 8 1 1 A 112 112 VAL CA C 112 60.000 58.878 1.122 1
1 1316 . 8 1 1 A 112 112 VAL CB C 112 32.200 35.381 -3.181 1
1 1319 . 8 1 1 A 112 112 VAL N N 112 120.400 126.256 -5.856 1
1 1320 . 8 1 1 A 113 113 PRO HA H 113 4.370 4.285 0.085 1
1 1327 . 8 1 1 A 113 113 PRO C C 113 177.300 178.068 -0.768 1
1 1328 . 8 1 1 A 113 113 PRO CA C 113 63.900 63.836 0.064 1
1 1329 . 8 1 1 A 113 113 PRO CB C 113 31.800 31.291 0.509 1
1 1332 . 8 1 1 A 114 114 GLY H H 114 8.570 8.878 -0.308 1
1 1333 . 8 1 1 A 114 114 GLY HA2 H 114 3.880 3.959 -0.079 1
1 1334 . 8 1 1 A 114 114 GLY HA3 H 114 4.120 3.960 0.160 1
1 1335 . 8 1 1 A 114 114 GLY C C 114 174.900 175.151 -0.251 1
1 1336 . 8 1 1 A 114 114 GLY CA C 114 45.200 45.974 -0.774 1
1 1337 . 8 1 1 A 114 114 GLY N N 114 109.000 113.171 -4.171 1
1 1338 . 8 1 1 A 115 115 THR H H 115 7.900 7.415 0.485 1
1 1339 . 8 1 1 A 115 115 THR HA H 115 4.400 4.082 0.318 1
1 1344 . 8 1 1 A 115 115 THR C C 115 174.300 173.989 0.311 1
1 1345 . 8 1 1 A 115 115 THR CA C 115 61.700 64.382 -2.682 1
1 1346 . 8 1 1 A 115 115 THR CB C 115 69.700 69.683 0.017 1
1 1348 . 8 1 1 A 115 115 THR N N 115 111.400 115.643 -4.243 1
1 1349 . 8 1 1 A 116 116 ASN H H 116 8.450 7.783 0.667 1
1 1350 . 8 1 1 A 116 116 ASN HA H 116 4.970 5.240 -0.270 1
1 1355 . 8 1 1 A 116 116 ASN CA C 116 51.500 50.377 1.123 1
1 1356 . 8 1 1 A 116 116 ASN CB C 116 38.900 40.587 -1.687 1
1 1357 . 8 1 1 A 116 116 ASN N N 116 123.100 114.834 8.266 1
1 1359 . 8 1 1 A 117 117 PRO HA H 117 4.370 4.293 0.077 1
1 1366 . 8 1 1 A 117 117 PRO C C 117 178.400 178.004 0.396 1
1 1367 . 8 1 1 A 117 117 PRO CA C 117 64.800 64.697 0.103 1
1 1368 . 8 1 1 A 117 117 PRO CB C 117 32.100 31.826 0.274 1
1 1371 . 8 1 1 A 118 118 VAL H H 118 7.750 7.515 0.235 1
1 1372 . 8 1 1 A 118 118 VAL HA H 118 3.810 3.758 0.052 1
1 1380 . 8 1 1 A 118 118 VAL C C 118 178.300 178.144 0.156 1
1 1381 . 8 1 1 A 118 118 VAL CA C 118 65.200 65.477 -0.277 1
1 1382 . 8 1 1 A 118 118 VAL CB C 118 31.500 31.400 0.100 1
1 1385 . 8 1 1 A 118 118 VAL N N 118 118.300 116.422 1.878 1
1 1386 . 8 1 1 A 119 119 LEU H H 119 7.540 7.959 -0.419 1
1 1387 . 8 1 1 A 119 119 LEU HA H 119 4.030 3.928 0.102 1
1 1397 . 8 1 1 A 119 119 LEU C C 119 178.900 179.497 -0.597 1
1 1398 . 8 1 1 A 119 119 LEU CA C 119 57.800 58.139 -0.339 1
1 1399 . 8 1 1 A 119 119 LEU CB C 119 40.700 40.856 -0.156 1
1 1403 . 8 1 1 A 119 119 LEU N N 119 119.700 120.278 -0.578 1
1 1404 . 8 1 1 A 120 120 ASN H H 120 8.080 8.212 -0.132 1
1 1405 . 8 1 1 A 120 120 ASN HA H 120 4.420 4.371 0.049 1
1 1410 . 8 1 1 A 120 120 ASN C C 120 178.100 177.666 0.434 1
1 1411 . 8 1 1 A 120 120 ASN CA C 120 56.100 56.913 -0.813 1
1 1412 . 8 1 1 A 120 120 ASN CB C 120 37.800 38.713 -0.913 1
1 1413 . 8 1 1 A 120 120 ASN N N 120 117.700 118.103 -0.403 1
1 1415 . 8 1 1 A 121 121 ASN H H 121 8.120 8.144 -0.024 1
1 1416 . 8 1 1 A 121 121 ASN HA H 121 4.490 4.435 0.055 1
1 1421 . 8 1 1 A 121 121 ASN C C 121 178.000 178.235 -0.235 1
1 1422 . 8 1 1 A 121 121 ASN CA C 121 56.100 56.388 -0.288 1
1 1423 . 8 1 1 A 121 121 ASN CB C 121 37.800 38.281 -0.481 1
1 1424 . 8 1 1 A 121 121 ASN N N 121 120.000 117.747 2.253 1
1 1426 . 8 1 1 A 122 122 LEU H H 122 8.180 8.189 -0.009 1
1 1427 . 8 1 1 A 122 122 LEU HA H 122 4.050 3.885 0.165 1
1 1437 . 8 1 1 A 122 122 LEU C C 122 173.800 178.893 -5.093 1
1 1438 . 8 1 1 A 122 122 LEU CA C 122 58.500 57.892 0.608 1
1 1439 . 8 1 1 A 122 122 LEU CB C 122 41.900 41.942 -0.042 1
1 1443 . 8 1 1 A 122 122 LEU N N 122 122.600 120.536 2.064 1
1 1444 . 8 1 1 A 123 123 LEU H H 123 8.260 8.112 0.148 1
1 1445 . 8 1 1 A 123 123 LEU HA H 123 3.850 3.965 -0.115 1
1 1455 . 8 1 1 A 123 123 LEU C C 123 178.900 178.407 0.493 1
1 1456 . 8 1 1 A 123 123 LEU CA C 123 58.500 58.176 0.324 1
1 1457 . 8 1 1 A 123 123 LEU CB C 123 41.200 41.549 -0.349 1
1 1461 . 8 1 1 A 123 123 LEU N N 123 119.700 120.457 -0.757 1
1 1462 . 8 1 1 A 124 124 SER H H 124 7.950 8.311 -0.361 1
1 1463 . 8 1 1 A 124 124 SER HA H 124 4.240 4.085 0.155 1
1 1466 . 8 1 1 A 124 124 SER C C 124 177.500 177.209 0.291 1
1 1467 . 8 1 1 A 124 124 SER CA C 124 61.600 61.941 -0.341 1
1 1468 . 8 1 1 A 124 124 SER CB C 124 62.600 62.836 -0.236 1
1 1469 . 8 1 1 A 124 124 SER N N 124 113.400 113.751 -0.351 1
1 1470 . 8 1 1 A 125 125 CYS H H 125 8.040 8.386 -0.346 1
1 1471 . 8 1 1 A 125 125 CYS HA H 125 4.350 4.113 0.237 1
1 1474 . 8 1 1 A 125 125 CYS C C 125 176.800 176.910 -0.110 1
1 1475 . 8 1 1 A 125 125 CYS CA C 125 62.600 63.909 -1.309 1
1 1476 . 8 1 1 A 125 125 CYS CB C 125 27.100 26.998 0.102 1
1 1477 . 8 1 1 A 125 125 CYS N N 125 119.800 119.816 -0.016 1
1 1478 . 8 1 1 A 126 126 VAL H H 126 8.290 8.484 -0.194 1
1 1479 . 8 1 1 A 126 126 VAL HA H 126 3.430 3.385 0.045 1
1 1487 . 8 1 1 A 126 126 VAL C C 126 177.800 177.758 0.042 1
1 1488 . 8 1 1 A 126 126 VAL CA C 126 67.100 66.943 0.157 1
1 1489 . 8 1 1 A 126 126 VAL CB C 126 31.400 31.419 -0.019 1
1 1492 . 8 1 1 A 126 126 VAL N N 126 121.900 120.623 1.277 1
1 1493 . 8 1 1 A 127 127 GLN H H 127 8.200 8.183 0.017 1
1 1494 . 8 1 1 A 127 127 GLN HA H 127 3.970 3.908 0.062 1
1 1501 . 8 1 1 A 127 127 GLN C C 127 178.200 178.470 -0.270 1
1 1502 . 8 1 1 A 127 127 GLN CA C 127 58.700 58.773 -0.073 1
1 1503 . 8 1 1 A 127 127 GLN CB C 127 27.800 28.425 -0.625 1
1 1505 . 8 1 1 A 127 127 GLN N N 127 119.700 118.191 1.509 1
1 1507 . 8 1 1 A 128 128 GLU H H 128 7.880 8.024 -0.144 1
1 1508 . 8 1 1 A 128 128 GLU HA H 128 4.200 4.038 0.162 1
1 1513 . 8 1 1 A 128 128 GLU C C 128 178.400 178.702 -0.302 1
1 1514 . 8 1 1 A 128 128 GLU CA C 128 59.000 59.065 -0.065 1
1 1515 . 8 1 1 A 128 128 GLU CB C 128 28.400 29.326 -0.926 1
1 1517 . 8 1 1 A 128 128 GLU N N 128 119.800 119.532 0.268 1
1 1518 . 8 1 1 A 129 129 ILE H H 129 8.000 8.414 -0.414 1
1 1519 . 8 1 1 A 129 129 ILE HA H 129 3.460 3.593 -0.133 1
1 1529 . 8 1 1 A 129 129 ILE C C 129 176.800 178.087 -1.287 1
1 1530 . 8 1 1 A 129 129 ILE CA C 129 66.100 65.400 0.700 1
1 1531 . 8 1 1 A 129 129 ILE CB C 129 38.200 37.620 0.580 1
1 1535 . 8 1 1 A 129 129 ILE N N 129 119.500 120.279 -0.779 1
1 1536 . 8 1 1 A 130 130 SER H H 130 8.040 8.308 -0.268 1
1 1537 . 8 1 1 A 130 130 SER HA H 130 3.780 4.197 -0.417 1
1 1540 . 8 1 1 A 130 130 SER C C 130 176.200 175.890 0.310 1
1 1541 . 8 1 1 A 130 130 SER CA C 130 62.100 61.279 0.821 1
1 1542 . 8 1 1 A 130 130 SER CB C 130 62.600 62.677 -0.077 1
1 1543 . 8 1 1 A 130 130 SER N N 130 112.800 114.775 -1.975 1
1 1544 . 8 1 1 A 131 131 ASP H H 131 8.270 8.270 0.000 1
1 1545 . 8 1 1 A 131 131 ASP HA H 131 4.310 4.333 -0.023 1
1 1548 . 8 1 1 A 131 131 ASP C C 131 179.200 178.545 0.655 1
1 1549 . 8 1 1 A 131 131 ASP CA C 131 56.800 57.738 -0.938 1
1 1550 . 8 1 1 A 131 131 ASP CB C 131 40.900 41.651 -0.751 1
1 1551 . 8 1 1 A 131 131 ASP N N 131 119.600 121.405 -1.805 1
1 1552 . 8 1 1 A 132 132 VAL H H 132 8.470 8.302 0.168 1
1 1553 . 8 1 1 A 132 132 VAL HA H 132 3.520 3.712 -0.192 1
1 1561 . 8 1 1 A 132 132 VAL C C 132 178.700 178.520 0.180 1
1 1562 . 8 1 1 A 132 132 VAL CA C 132 66.500 66.582 -0.082 1
1 1563 . 8 1 1 A 132 132 VAL CB C 132 31.500 31.682 -0.182 1
1 1566 . 8 1 1 A 132 132 VAL N N 132 118.100 119.147 -1.047 1
1 1567 . 8 1 1 A 133 133 VAL H H 133 8.140 8.105 0.035 1
1 1568 . 8 1 1 A 133 133 VAL HA H 133 3.770 3.649 0.121 1
1 1576 . 8 1 1 A 133 133 VAL C C 133 176.500 178.453 -1.953 1
1 1577 . 8 1 1 A 133 133 VAL CA C 133 65.100 66.720 -1.620 1
1 1578 . 8 1 1 A 133 133 VAL CB C 133 31.600 31.411 0.189 1
1 1581 . 8 1 1 A 133 133 VAL N N 133 117.000 120.513 -3.513 1
1 1582 . 8 1 1 A 134 134 GLN H H 134 7.490 7.979 -0.489 1
1 1583 . 8 1 1 A 134 134 GLN HA H 134 4.350 4.284 0.066 1
1 1590 . 8 1 1 A 134 134 GLN C C 134 175.400 177.033 -1.633 1
1 1591 . 8 1 1 A 134 134 GLN CA C 134 56.700 57.513 -0.813 1
1 1592 . 8 1 1 A 134 134 GLN CB C 134 30.500 28.413 2.087 1
1 1594 . 8 1 1 A 134 134 GLN N N 134 116.300 118.792 -2.492 1
1 1 . 9 1 1 A 2 2 GLY HA2 H 2 3.890 4.091 -0.201 1
1 2 . 9 1 1 A 2 2 GLY HA3 H 2 3.890 4.123 -0.233 1
1 3 . 9 1 1 A 2 2 GLY C C 2 174.200 172.462 1.738 1
1 4 . 9 1 1 A 2 2 GLY CA C 2 44.700 46.049 -1.349 1
1 5 . 9 1 1 A 3 3 HIS H H 3 8.380 8.935 -0.555 1
1 6 . 9 1 1 A 3 3 HIS HA H 3 4.610 5.052 -0.442 1
1 9 . 9 1 1 A 3 3 HIS C C 3 174.500 174.054 0.446 1
1 10 . 9 1 1 A 3 3 HIS CA C 3 55.200 54.748 0.452 1
1 11 . 9 1 1 A 3 3 HIS CB C 3 28.800 29.770 -0.970 1
1 12 . 9 1 1 A 3 3 HIS N N 3 117.600 125.074 -7.474 1
1 13 . 9 1 1 A 4 4 HIS H H 4 8.520 8.966 -0.446 1
1 14 . 9 1 1 A 4 4 HIS HA H 4 4.640 4.869 -0.229 1
1 17 . 9 1 1 A 4 4 HIS C C 4 174.200 173.837 0.363 1
1 18 . 9 1 1 A 4 4 HIS CA C 4 55.100 54.260 0.840 1
1 19 . 9 1 1 A 4 4 HIS CB C 4 28.900 30.195 -1.295 1
1 20 . 9 1 1 A 4 4 HIS N N 4 119.000 122.862 -3.862 1
1 21 . 9 1 1 A 5 5 HIS H H 5 8.530 8.791 -0.261 1
1 22 . 9 1 1 A 5 5 HIS HA H 5 4.410 4.720 -0.310 1
1 25 . 9 1 1 A 5 5 HIS CA C 5 54.900 54.856 0.044 1
1 26 . 9 1 1 A 5 5 HIS CB C 5 27.300 33.535 -6.235 1
1 27 . 9 1 1 A 5 5 HIS N N 5 121.600 121.428 0.172 1
1 28 . 9 1 1 A 6 6 HIS HA H 6 4.640 4.807 -0.167 1
1 31 . 9 1 1 A 6 6 HIS C C 6 174.100 173.938 0.162 1
1 32 . 9 1 1 A 6 6 HIS CA C 6 55.100 54.877 0.223 1
1 33 . 9 1 1 A 6 6 HIS CB C 6 29.100 28.014 1.086 1
1 34 . 9 1 1 A 7 7 HIS H H 7 8.690 8.579 0.111 1
1 35 . 9 1 1 A 7 7 HIS HA H 7 4.650 5.377 -0.727 1
1 38 . 9 1 1 A 7 7 HIS C C 7 174.200 173.475 0.725 1
1 39 . 9 1 1 A 7 7 HIS CA C 7 55.200 53.795 1.405 1
1 40 . 9 1 1 A 7 7 HIS CB C 7 29.300 30.974 -1.674 1
1 41 . 9 1 1 A 7 7 HIS N N 7 121.400 117.402 3.998 1
1 42 . 9 1 1 A 8 8 HIS H H 8 8.660 9.041 -0.381 1
1 43 . 9 1 1 A 8 8 HIS HA H 8 4.700 4.577 0.123 1
1 46 . 9 1 1 A 8 8 HIS C C 8 174.200 174.892 -0.692 1
1 47 . 9 1 1 A 8 8 HIS CA C 8 55.000 55.018 -0.018 1
1 48 . 9 1 1 A 8 8 HIS CB C 8 29.300 29.772 -0.472 1
1 49 . 9 1 1 A 8 8 HIS N N 8 120.400 125.555 -5.155 1
1 50 . 9 1 1 A 9 9 SER H H 9 8.490 8.104 0.386 1
1 51 . 9 1 1 A 9 9 SER HA H 9 4.390 4.269 0.121 1
1 54 . 9 1 1 A 9 9 SER C C 9 174.100 174.271 -0.171 1
1 55 . 9 1 1 A 9 9 SER CA C 9 58.300 59.794 -1.494 1
1 56 . 9 1 1 A 9 9 SER CB C 9 63.700 62.793 0.907 1
1 57 . 9 1 1 A 9 9 SER N N 9 118.100 122.640 -4.540 1
1 58 . 9 1 1 A 10 10 HIS H H 10 8.710 8.980 -0.270 1
1 59 . 9 1 1 A 10 10 HIS HA H 10 4.690 5.026 -0.336 1
1 63 . 9 1 1 A 10 10 HIS C C 10 174.200 174.172 0.028 1
1 64 . 9 1 1 A 10 10 HIS CA C 10 55.200 54.463 0.737 1
1 65 . 9 1 1 A 10 10 HIS CB C 10 28.800 30.867 -2.067 1
1 66 . 9 1 1 A 10 10 HIS N N 10 120.700 126.759 -6.059 1
1 67 . 9 1 1 A 11 11 MET H H 11 8.410 8.223 0.187 1
1 68 . 9 1 1 A 11 11 MET HA H 11 4.420 4.318 0.102 1
1 76 . 9 1 1 A 11 11 MET C C 11 175.800 175.728 0.072 1
1 77 . 9 1 1 A 11 11 MET CA C 11 55.100 54.668 0.432 1
1 78 . 9 1 1 A 11 11 MET CB C 11 32.800 33.727 -0.927 1
1 81 . 9 1 1 A 11 11 MET N N 11 122.300 126.757 -4.457 1
1 82 . 9 1 1 A 12 12 ALA H H 12 8.440 8.308 0.132 1
1 83 . 9 1 1 A 12 12 ALA HA H 12 4.280 3.870 0.410 1
1 87 . 9 1 1 A 12 12 ALA C C 12 177.400 178.191 -0.791 1
1 88 . 9 1 1 A 12 12 ALA CA C 12 52.400 53.417 -1.017 1
1 89 . 9 1 1 A 12 12 ALA CB C 12 18.800 18.445 0.355 1
1 90 . 9 1 1 A 12 12 ALA N N 12 125.900 124.564 1.336 1
1 91 . 9 1 1 A 13 13 ASN H H 13 8.440 8.935 -0.495 1
1 92 . 9 1 1 A 13 13 ASN HA H 13 4.660 4.382 0.278 1
1 97 . 9 1 1 A 13 13 ASN C C 13 175.900 175.014 0.886 1
1 98 . 9 1 1 A 13 13 ASN CA C 13 53.200 54.446 -1.246 1
1 99 . 9 1 1 A 13 13 ASN CB C 13 38.800 37.243 1.557 1
1 100 . 9 1 1 A 13 13 ASN N N 13 118.300 116.331 1.969 1
1 102 . 9 1 1 A 14 14 GLY H H 14 8.370 7.933 0.437 1
1 103 . 9 1 1 A 14 14 GLY HA2 H 14 3.920 3.841 0.079 1
1 104 . 9 1 1 A 14 14 GLY HA3 H 14 3.920 3.887 0.033 1
1 105 . 9 1 1 A 14 14 GLY C C 14 174.000 173.301 0.699 1
1 106 . 9 1 1 A 14 14 GLY CA C 14 45.200 46.985 -1.785 1
1 107 . 9 1 1 A 14 14 GLY N N 14 109.600 106.547 3.053 1
1 108 . 9 1 1 A 15 15 ALA H H 15 8.140 7.574 0.566 1
1 109 . 9 1 1 A 15 15 ALA HA H 15 4.280 4.772 -0.492 1
1 113 . 9 1 1 A 15 15 ALA C C 15 177.300 175.562 1.738 1
1 114 . 9 1 1 A 15 15 ALA CA C 15 52.500 51.392 1.108 1
1 115 . 9 1 1 A 15 15 ALA CB C 15 19.100 22.764 -3.664 1
1 116 . 9 1 1 A 15 15 ALA N N 15 123.800 123.699 0.101 1
1 117 . 9 1 1 A 16 16 ALA H H 16 8.030 8.448 -0.418 1
1 118 . 9 1 1 A 16 16 ALA HA H 16 4.280 4.179 0.101 1
1 122 . 9 1 1 A 16 16 ALA C C 16 178.400 178.737 -0.337 1
1 123 . 9 1 1 A 16 16 ALA CA C 16 52.600 53.373 -0.773 1
1 124 . 9 1 1 A 16 16 ALA CB C 16 19.100 18.723 0.377 1
1 125 . 9 1 1 A 16 16 ALA N N 16 122.300 122.223 0.077 1
1 126 . 9 1 1 A 17 17 GLY H H 17 8.320 8.981 -0.661 1
1 127 . 9 1 1 A 17 17 GLY HA2 H 17 3.960 4.005 -0.045 1
1 128 . 9 1 1 A 17 17 GLY HA3 H 17 3.960 4.007 -0.047 1
1 129 . 9 1 1 A 17 17 GLY C C 17 174.500 175.146 -0.646 1
1 130 . 9 1 1 A 17 17 GLY CA C 17 45.200 46.436 -1.236 1
1 131 . 9 1 1 A 17 17 GLY N N 17 107.800 110.590 -2.790 1
1 132 . 9 1 1 A 18 18 THR H H 18 7.970 8.158 -0.188 1
1 133 . 9 1 1 A 18 18 THR HA H 18 4.290 4.003 0.287 1
1 138 . 9 1 1 A 18 18 THR C C 18 174.600 176.539 -1.939 1
1 139 . 9 1 1 A 18 18 THR CA C 18 62.000 66.410 -4.410 1
1 140 . 9 1 1 A 18 18 THR CB C 18 69.700 68.581 1.119 1
1 142 . 9 1 1 A 18 18 THR N N 18 113.800 112.979 0.821 1
1 143 . 9 1 1 A 19 19 LYS H H 19 8.350 8.456 -0.106 1
1 144 . 9 1 1 A 19 19 LYS HA H 19 4.270 4.116 0.154 1
1 153 . 9 1 1 A 19 19 LYS C C 19 176.600 177.485 -0.885 1
1 154 . 9 1 1 A 19 19 LYS CA C 19 56.500 58.758 -2.258 1
1 155 . 9 1 1 A 19 19 LYS CB C 19 32.800 32.181 0.619 1
1 159 . 9 1 1 A 19 19 LYS N N 19 124.000 119.668 4.332 1
1 160 . 9 1 1 A 20 20 VAL H H 20 8.060 7.676 0.384 1
1 161 . 9 1 1 A 20 20 VAL HA H 20 3.990 4.293 -0.303 1
1 169 . 9 1 1 A 20 20 VAL C C 20 175.900 176.785 -0.885 1
1 170 . 9 1 1 A 20 20 VAL CA C 20 62.400 62.325 0.075 1
1 171 . 9 1 1 A 20 20 VAL CB C 20 32.600 32.039 0.561 1
1 174 . 9 1 1 A 20 20 VAL N N 20 121.700 119.019 2.681 1
1 175 . 9 1 1 A 21 21 ALA H H 21 8.310 7.834 0.476 1
1 176 . 9 1 1 A 21 21 ALA HA H 21 4.290 4.084 0.206 1
1 180 . 9 1 1 A 21 21 ALA C C 21 177.600 178.973 -1.373 1
1 181 . 9 1 1 A 21 21 ALA CA C 21 52.400 54.888 -2.488 1
1 182 . 9 1 1 A 21 21 ALA CB C 21 19.000 18.599 0.401 1
1 183 . 9 1 1 A 21 21 ALA N N 21 127.700 125.439 2.261 1
1 184 . 9 1 1 A 22 22 LEU H H 22 8.150 7.662 0.488 1
1 185 . 9 1 1 A 22 22 LEU HA H 22 4.280 4.312 -0.032 1
1 195 . 9 1 1 A 22 22 LEU C C 22 177.400 176.092 1.308 1
1 196 . 9 1 1 A 22 22 LEU CA C 22 55.200 54.686 0.514 1
1 197 . 9 1 1 A 22 22 LEU CB C 22 42.200 41.848 0.352 1
1 201 . 9 1 1 A 22 22 LEU N N 22 121.800 116.042 5.758 1
1 202 . 9 1 1 A 23 23 ARG H H 23 8.240 8.071 0.169 1
1 203 . 9 1 1 A 23 23 ARG HA H 23 4.290 3.998 0.292 1
1 211 . 9 1 1 A 23 23 ARG C C 23 176.300 176.389 -0.089 1
1 212 . 9 1 1 A 23 23 ARG CA C 23 56.000 57.342 -1.342 1
1 213 . 9 1 1 A 23 23 ARG CB C 23 30.600 29.572 1.028 1
1 216 . 9 1 1 A 23 23 ARG N N 23 122.000 118.748 3.252 1
1 218 . 9 1 1 A 24 24 LYS H H 24 8.370 8.086 0.284 1
1 219 . 9 1 1 A 24 24 LYS HA H 24 4.330 4.373 -0.043 1
1 228 . 9 1 1 A 24 24 LYS C C 24 176.800 176.591 0.209 1
1 229 . 9 1 1 A 24 24 LYS CA C 24 56.400 56.895 -0.495 1
1 230 . 9 1 1 A 24 24 LYS CB C 24 32.700 33.240 -0.540 1
1 234 . 9 1 1 A 24 24 LYS N N 24 122.900 118.536 4.364 1
1 235 . 9 1 1 A 25 25 THR H H 25 8.100 7.510 0.590 1
1 236 . 9 1 1 A 25 25 THR HA H 25 4.290 4.522 -0.232 1
1 241 . 9 1 1 A 25 25 THR C C 25 174.600 174.288 0.312 1
1 242 . 9 1 1 A 25 25 THR CA C 25 61.500 60.960 0.540 1
1 243 . 9 1 1 A 25 25 THR CB C 25 69.800 69.504 0.296 1
1 245 . 9 1 1 A 25 25 THR N N 25 115.500 110.388 5.112 1
1 246 . 9 1 1 A 26 26 LYS H H 26 8.370 9.066 -0.696 1
1 247 . 9 1 1 A 26 26 LYS HA H 26 4.270 4.669 -0.399 1
1 256 . 9 1 1 A 26 26 LYS C C 26 176.600 176.374 0.226 1
1 257 . 9 1 1 A 26 26 LYS CA C 26 56.600 54.172 2.428 1
1 258 . 9 1 1 A 26 26 LYS CB C 26 32.700 34.801 -2.101 1
1 262 . 9 1 1 A 26 26 LYS N N 26 123.700 125.963 -2.263 1
1 263 . 9 1 1 A 27 27 GLN H H 27 8.390 8.821 -0.431 1
1 264 . 9 1 1 A 27 27 GLN HA H 27 4.240 4.428 -0.188 1
1 271 . 9 1 1 A 27 27 GLN C C 27 175.900 174.811 1.089 1
1 272 . 9 1 1 A 27 27 GLN CA C 27 56.100 56.884 -0.784 1
1 273 . 9 1 1 A 27 27 GLN CB C 27 29.300 29.144 0.156 1
1 275 . 9 1 1 A 27 27 GLN N N 27 121.700 119.353 2.347 1
1 277 . 9 1 1 A 28 28 ALA H H 28 8.330 8.040 0.290 1
1 278 . 9 1 1 A 28 28 ALA HA H 28 4.240 4.650 -0.410 1
1 282 . 9 1 1 A 28 28 ALA C C 28 177.700 177.517 0.183 1
1 283 . 9 1 1 A 28 28 ALA CA C 28 52.500 50.392 2.108 1
1 284 . 9 1 1 A 28 28 ALA CB C 28 19.100 22.079 -2.979 1
1 285 . 9 1 1 A 28 28 ALA N N 28 125.400 119.403 5.997 1
1 286 . 9 1 1 A 29 29 ALA H H 29 8.250 8.957 -0.707 1
1 287 . 9 1 1 A 29 29 ALA HA H 29 4.230 3.968 0.262 1
1 291 . 9 1 1 A 29 29 ALA C C 29 178.000 179.703 -1.703 1
1 292 . 9 1 1 A 29 29 ALA CA C 29 52.500 55.408 -2.908 1
1 293 . 9 1 1 A 29 29 ALA CB C 29 19.100 18.216 0.884 1
1 294 . 9 1 1 A 29 29 ALA N N 29 123.000 122.894 0.106 1
1 295 . 9 1 1 A 30 30 GLU H H 30 8.260 8.156 0.104 1
1 296 . 9 1 1 A 30 30 GLU HA H 30 4.220 4.091 0.129 1
1 301 . 9 1 1 A 30 30 GLU C C 30 176.500 176.947 -0.447 1
1 302 . 9 1 1 A 30 30 GLU CA C 30 56.400 59.588 -3.188 1
1 303 . 9 1 1 A 30 30 GLU CB C 30 29.500 29.333 0.167 1
1 305 . 9 1 1 A 30 30 GLU N N 30 119.700 119.047 0.653 1
1 306 . 9 1 1 A 31 31 LYS H H 31 8.230 8.141 0.089 1
1 307 . 9 1 1 A 31 31 LYS HA H 31 4.280 4.530 -0.250 1
1 316 . 9 1 1 A 31 31 LYS C C 31 176.500 176.090 0.410 1
1 317 . 9 1 1 A 31 31 LYS CA C 31 56.400 55.504 0.896 1
1 318 . 9 1 1 A 31 31 LYS CB C 31 32.800 33.872 -1.072 1
1 322 . 9 1 1 A 31 31 LYS N N 31 122.700 119.455 3.245 1
1 323 . 9 1 1 A 32 32 ILE H H 32 8.140 7.274 0.866 1
1 324 . 9 1 1 A 32 32 ILE HA H 32 4.110 4.380 -0.270 1
1 334 . 9 1 1 A 32 32 ILE C C 32 176.400 176.146 0.254 1
1 335 . 9 1 1 A 32 32 ILE CA C 32 61.200 61.080 0.120 1
1 336 . 9 1 1 A 32 32 ILE CB C 32 38.600 36.040 2.560 1
1 340 . 9 1 1 A 32 32 ILE N N 32 122.300 122.277 0.023 1
1 341 . 9 1 1 A 33 33 SER H H 33 8.230 7.900 0.330 1
1 342 . 9 1 1 A 33 33 SER HA H 33 4.400 4.030 0.370 1
1 345 . 9 1 1 A 33 33 SER C C 33 174.800 176.533 -1.733 1
1 346 . 9 1 1 A 33 33 SER CA C 33 58.300 61.528 -3.228 1
1 347 . 9 1 1 A 33 33 SER CB C 33 63.700 62.867 0.833 1
1 348 . 9 1 1 A 33 33 SER N N 33 119.600 123.486 -3.886 1
1 349 . 9 1 1 A 34 34 ALA H H 34 8.430 8.258 0.172 1
1 350 . 9 1 1 A 34 34 ALA HA H 34 4.220 4.028 0.192 1
1 354 . 9 1 1 A 34 34 ALA C C 34 179.500 179.468 0.032 1
1 355 . 9 1 1 A 34 34 ALA CA C 34 53.500 55.196 -1.696 1
1 356 . 9 1 1 A 34 34 ALA CB C 34 18.800 18.618 0.182 1
1 357 . 9 1 1 A 34 34 ALA N N 34 126.000 122.833 3.167 1
1 358 . 9 1 1 A 35 35 ASP H H 35 8.380 7.759 0.621 1
1 359 . 9 1 1 A 35 35 ASP HA H 35 4.520 4.353 0.167 1
1 362 . 9 1 1 A 35 35 ASP C C 35 176.500 178.447 -1.947 1
1 363 . 9 1 1 A 35 35 ASP CA C 35 54.800 56.923 -2.123 1
1 364 . 9 1 1 A 35 35 ASP CB C 35 40.200 40.856 -0.656 1
1 365 . 9 1 1 A 35 35 ASP N N 35 118.200 118.262 -0.062 1
1 366 . 9 1 1 A 36 36 LYS H H 36 8.000 7.835 0.165 1
1 367 . 9 1 1 A 36 36 LYS HA H 36 4.270 4.033 0.237 1
1 376 . 9 1 1 A 36 36 LYS C C 36 177.000 177.200 -0.200 1
1 377 . 9 1 1 A 36 36 LYS CA C 36 56.800 58.811 -2.011 1
1 378 . 9 1 1 A 36 36 LYS CB C 36 32.900 31.827 1.073 1
1 382 . 9 1 1 A 36 36 LYS N N 36 120.900 118.837 2.063 1
1 383 . 9 1 1 A 37 37 ILE H H 37 7.970 7.569 0.401 1
1 384 . 9 1 1 A 37 37 ILE HA H 37 4.020 3.851 0.169 1
1 394 . 9 1 1 A 37 37 ILE C C 37 176.100 175.458 0.642 1
1 395 . 9 1 1 A 37 37 ILE CA C 37 61.300 62.387 -1.087 1
1 396 . 9 1 1 A 37 37 ILE CB C 37 38.100 37.956 0.144 1
1 400 . 9 1 1 A 37 37 ILE N N 37 121.800 121.484 0.316 1
1 401 . 9 1 1 A 38 38 SER H H 38 7.980 8.820 -0.840 1
1 402 . 9 1 1 A 38 38 SER HA H 38 4.540 4.676 -0.136 1
1 405 . 9 1 1 A 38 38 SER C C 38 174.700 175.628 -0.928 1
1 406 . 9 1 1 A 38 38 SER CA C 38 58.200 57.457 0.743 1
1 407 . 9 1 1 A 38 38 SER CB C 38 64.400 64.986 -0.586 1
1 408 . 9 1 1 A 38 38 SER N N 38 119.000 123.381 -4.381 1
1 409 . 9 1 1 A 39 39 LYS H H 39 8.690 9.021 -0.331 1
1 410 . 9 1 1 A 39 39 LYS HA H 39 3.400 3.686 -0.286 1
1 419 . 9 1 1 A 39 39 LYS C C 39 177.400 178.030 -0.630 1
1 420 . 9 1 1 A 39 39 LYS CA C 39 59.800 60.485 -0.685 1
1 421 . 9 1 1 A 39 39 LYS CB C 39 32.400 32.403 -0.003 1
1 425 . 9 1 1 A 39 39 LYS N N 39 124.200 125.066 -0.866 1
1 426 . 9 1 1 A 40 40 GLU H H 40 8.280 8.447 -0.167 1
1 427 . 9 1 1 A 40 40 GLU HA H 40 3.840 4.044 -0.204 1
1 432 . 9 1 1 A 40 40 GLU C C 40 178.400 178.923 -0.523 1
1 433 . 9 1 1 A 40 40 GLU CA C 40 59.400 59.427 -0.027 1
1 434 . 9 1 1 A 40 40 GLU CB C 40 28.300 28.760 -0.460 1
1 436 . 9 1 1 A 40 40 GLU N N 40 116.300 117.437 -1.137 1
1 437 . 9 1 1 A 41 41 ALA H H 41 7.890 8.213 -0.323 1
1 438 . 9 1 1 A 41 41 ALA HA H 41 3.910 4.115 -0.205 1
1 442 . 9 1 1 A 41 41 ALA C C 41 179.900 179.985 -0.085 1
1 443 . 9 1 1 A 41 41 ALA CA C 41 54.700 55.459 -0.759 1
1 444 . 9 1 1 A 41 41 ALA CB C 41 17.900 17.850 0.050 1
1 445 . 9 1 1 A 41 41 ALA N N 41 122.300 122.812 -0.512 1
1 446 . 9 1 1 A 42 42 LEU H H 42 7.490 7.987 -0.497 1
1 447 . 9 1 1 A 42 42 LEU HA H 42 3.480 3.996 -0.516 1
1 457 . 9 1 1 A 42 42 LEU C C 42 178.900 178.676 0.224 1
1 458 . 9 1 1 A 42 42 LEU CA C 42 59.800 57.726 2.074 1
1 459 . 9 1 1 A 42 42 LEU CB C 42 42.300 41.491 0.809 1
1 463 . 9 1 1 A 42 42 LEU N N 42 121.000 119.532 1.468 1
1 464 . 9 1 1 A 43 43 LEU H H 43 8.290 7.923 0.367 1
1 465 . 9 1 1 A 43 43 LEU HA H 43 3.780 3.876 -0.096 1
1 475 . 9 1 1 A 43 43 LEU C C 43 179.400 179.435 -0.035 1
1 476 . 9 1 1 A 43 43 LEU CA C 43 57.600 58.107 -0.507 1
1 477 . 9 1 1 A 43 43 LEU CB C 43 40.900 41.581 -0.681 1
1 481 . 9 1 1 A 43 43 LEU N N 43 119.200 118.370 0.830 1
1 482 . 9 1 1 A 44 44 GLU H H 44 8.330 8.319 0.011 1
1 483 . 9 1 1 A 44 44 GLU HA H 44 4.050 3.915 0.135 1
1 488 . 9 1 1 A 44 44 GLU C C 44 178.600 179.633 -1.033 1
1 489 . 9 1 1 A 44 44 GLU CA C 44 58.900 59.633 -0.733 1
1 490 . 9 1 1 A 44 44 GLU CB C 44 28.300 29.250 -0.950 1
1 492 . 9 1 1 A 44 44 GLU N N 44 119.600 117.394 2.206 1
1 493 . 9 1 1 A 45 45 CYS H H 45 7.690 7.833 -0.143 1
1 494 . 9 1 1 A 45 45 CYS HA H 45 4.120 4.000 0.120 1
1 497 . 9 1 1 A 45 45 CYS C C 45 176.100 176.789 -0.689 1
1 498 . 9 1 1 A 45 45 CYS CA C 45 62.500 62.853 -0.353 1
1 499 . 9 1 1 A 45 45 CYS CB C 45 26.200 26.331 -0.131 1
1 500 . 9 1 1 A 45 45 CYS N N 45 120.900 118.703 2.197 1
1 501 . 9 1 1 A 46 46 ALA H H 46 8.540 7.581 0.959 1
1 502 . 9 1 1 A 46 46 ALA HA H 46 3.900 4.014 -0.114 1
1 506 . 9 1 1 A 46 46 ALA C C 46 179.200 179.363 -0.163 1
1 507 . 9 1 1 A 46 46 ALA CA C 46 55.500 54.969 0.531 1
1 508 . 9 1 1 A 46 46 ALA CB C 46 16.800 18.287 -1.487 1
1 509 . 9 1 1 A 46 46 ALA N N 46 121.500 121.955 -0.455 1
1 510 . 9 1 1 A 47 47 ASP H H 47 8.460 8.360 0.100 1
1 511 . 9 1 1 A 47 47 ASP HA H 47 4.340 4.258 0.082 1
1 514 . 9 1 1 A 47 47 ASP C C 47 178.800 178.535 0.265 1
1 515 . 9 1 1 A 47 47 ASP CA C 47 56.600 57.784 -1.184 1
1 516 . 9 1 1 A 47 47 ASP CB C 47 39.800 41.938 -2.138 1
1 517 . 9 1 1 A 47 47 ASP N N 47 119.000 118.297 0.703 1
1 518 . 9 1 1 A 48 48 LEU H H 48 8.040 7.703 0.337 1
1 519 . 9 1 1 A 48 48 LEU HA H 48 4.110 3.975 0.135 1
1 529 . 9 1 1 A 48 48 LEU C C 48 180.000 179.378 0.622 1
1 530 . 9 1 1 A 48 48 LEU CA C 48 58.000 58.236 -0.236 1
1 531 . 9 1 1 A 48 48 LEU CB C 48 41.700 41.601 0.099 1
1 535 . 9 1 1 A 48 48 LEU N N 48 123.000 120.045 2.955 1
1 536 . 9 1 1 A 49 49 LEU H H 49 8.300 8.053 0.247 1
1 537 . 9 1 1 A 49 49 LEU HA H 49 4.110 3.867 0.243 1
1 547 . 9 1 1 A 49 49 LEU C C 49 177.200 178.849 -1.649 1
1 548 . 9 1 1 A 49 49 LEU CA C 49 57.600 57.840 -0.240 1
1 549 . 9 1 1 A 49 49 LEU CB C 49 41.200 41.785 -0.585 1
1 553 . 9 1 1 A 49 49 LEU N N 49 120.900 119.490 1.410 1
1 554 . 9 1 1 A 50 50 SER H H 50 8.660 8.166 0.494 1
1 555 . 9 1 1 A 50 50 SER HA H 50 4.000 4.202 -0.202 1
1 558 . 9 1 1 A 50 50 SER C C 50 176.800 177.305 -0.505 1
1 559 . 9 1 1 A 50 50 SER CA C 50 62.500 61.557 0.943 1
1 560 . 9 1 1 A 50 50 SER CB C 50 62.600 62.281 0.319 1
1 561 . 9 1 1 A 50 50 SER N N 50 113.300 113.276 0.024 1
1 562 . 9 1 1 A 51 51 SER H H 51 7.980 7.795 0.185 1
1 563 . 9 1 1 A 51 51 SER HA H 51 4.220 4.084 0.136 1
1 566 . 9 1 1 A 51 51 SER C C 51 176.300 176.639 -0.339 1
1 567 . 9 1 1 A 51 51 SER CA C 51 61.200 61.641 -0.441 1
1 568 . 9 1 1 A 51 51 SER CB C 51 62.700 62.890 -0.190 1
1 569 . 9 1 1 A 51 51 SER N N 51 115.900 116.376 -0.476 1
1 570 . 9 1 1 A 52 52 ALA H H 52 8.030 8.266 -0.236 1
1 571 . 9 1 1 A 52 52 ALA HA H 52 4.130 4.138 -0.008 1
1 575 . 9 1 1 A 52 52 ALA C C 52 178.500 178.731 -0.231 1
1 576 . 9 1 1 A 52 52 ALA CA C 52 54.500 54.548 -0.048 1
1 577 . 9 1 1 A 52 52 ALA CB C 52 18.000 18.150 -0.150 1
1 578 . 9 1 1 A 52 52 ALA N N 52 125.400 123.702 1.698 1
1 579 . 9 1 1 A 53 53 LEU H H 53 7.710 7.754 -0.044 1
1 580 . 9 1 1 A 53 53 LEU HA H 53 4.180 4.297 -0.117 1
1 590 . 9 1 1 A 53 53 LEU C C 53 177.700 177.645 0.055 1
1 591 . 9 1 1 A 53 53 LEU CA C 53 56.500 55.101 1.399 1
1 592 . 9 1 1 A 53 53 LEU CB C 53 42.400 41.769 0.631 1
1 596 . 9 1 1 A 53 53 LEU N N 53 113.800 117.180 -3.380 1
1 597 . 9 1 1 A 54 54 THR H H 54 7.550 7.550 0.000 1
1 598 . 9 1 1 A 54 54 THR HA H 54 4.420 4.510 -0.090 1
1 603 . 9 1 1 A 54 54 THR C C 54 174.100 174.925 -0.825 1
1 604 . 9 1 1 A 54 54 THR CA C 54 61.600 62.556 -0.956 1
1 605 . 9 1 1 A 54 54 THR CB C 54 69.300 69.951 -0.651 1
1 607 . 9 1 1 A 54 54 THR N N 54 107.700 107.783 -0.083 1
1 608 . 9 1 1 A 55 55 GLU H H 55 7.750 7.753 -0.003 1
1 609 . 9 1 1 A 55 55 GLU HA H 55 4.760 4.532 0.228 1
1 614 . 9 1 1 A 55 55 GLU CA C 55 53.400 54.703 -1.303 1
1 615 . 9 1 1 A 55 55 GLU CB C 55 30.100 30.179 -0.079 1
1 617 . 9 1 1 A 55 55 GLU N N 55 122.800 121.159 1.641 1
1 618 . 9 1 1 A 56 56 PRO HA H 56 4.670 4.771 -0.101 1
1 625 . 9 1 1 A 56 56 PRO C C 56 176.200 176.451 -0.251 1
1 626 . 9 1 1 A 56 56 PRO CA C 56 62.900 62.827 0.073 1
1 627 . 9 1 1 A 56 56 PRO CB C 56 29.200 31.675 -2.475 1
1 630 . 9 1 1 A 57 57 VAL H H 57 8.010 8.386 -0.376 1
1 631 . 9 1 1 A 57 57 VAL HA H 57 4.590 4.936 -0.346 1
1 639 . 9 1 1 A 57 57 VAL CA C 57 58.600 58.292 0.308 1
1 640 . 9 1 1 A 57 57 VAL CB C 57 32.800 34.918 -2.118 1
1 643 . 9 1 1 A 57 57 VAL N N 57 121.400 117.360 4.040 1
1 644 . 9 1 1 A 58 58 PRO HA H 58 4.450 4.616 -0.166 1
1 651 . 9 1 1 A 58 58 PRO C C 58 177.500 177.904 -0.404 1
1 652 . 9 1 1 A 58 58 PRO CA C 58 62.600 62.751 -0.151 1
1 653 . 9 1 1 A 58 58 PRO CB C 58 32.200 32.823 -0.623 1
1 656 . 9 1 1 A 59 59 ASN H H 59 8.890 9.263 -0.373 1
1 657 . 9 1 1 A 59 59 ASN HA H 59 4.330 4.444 -0.114 1
1 662 . 9 1 1 A 59 59 ASN C C 59 177.600 177.018 0.582 1
1 663 . 9 1 1 A 59 59 ASN CA C 59 56.300 56.094 0.206 1
1 664 . 9 1 1 A 59 59 ASN CB C 59 38.400 38.336 0.064 1
1 665 . 9 1 1 A 59 59 ASN N N 59 122.200 123.192 -0.992 1
1 667 . 9 1 1 A 60 60 SER H H 60 8.660 7.889 0.771 1
1 668 . 9 1 1 A 60 60 SER HA H 60 4.010 4.102 -0.092 1
1 671 . 9 1 1 A 60 60 SER C C 60 176.200 177.387 -1.187 1
1 672 . 9 1 1 A 60 60 SER CA C 60 60.800 61.478 -0.678 1
1 673 . 9 1 1 A 60 60 SER CB C 60 61.500 62.925 -1.425 1
1 674 . 9 1 1 A 60 60 SER N N 60 113.200 114.197 -0.997 1
1 675 . 9 1 1 A 61 61 GLN H H 61 7.420 8.140 -0.720 1
1 676 . 9 1 1 A 61 61 GLN HA H 61 4.280 3.987 0.293 1
1 683 . 9 1 1 A 61 61 GLN C C 61 178.600 178.302 0.298 1
1 684 . 9 1 1 A 61 61 GLN CA C 61 57.900 58.980 -1.080 1
1 685 . 9 1 1 A 61 61 GLN CB C 61 28.600 27.997 0.603 1
1 687 . 9 1 1 A 61 61 GLN N N 61 122.200 120.889 1.311 1
1 689 . 9 1 1 A 62 62 LEU H H 62 7.430 7.811 -0.381 1
1 690 . 9 1 1 A 62 62 LEU HA H 62 3.850 3.927 -0.077 1
1 700 . 9 1 1 A 62 62 LEU C C 62 178.800 179.195 -0.395 1
1 701 . 9 1 1 A 62 62 LEU CA C 62 57.900 58.087 -0.187 1
1 702 . 9 1 1 A 62 62 LEU CB C 62 42.100 42.011 0.089 1
1 706 . 9 1 1 A 62 62 LEU N N 62 120.600 120.036 0.564 1
1 707 . 9 1 1 A 63 63 VAL H H 63 8.200 7.998 0.202 1
1 708 . 9 1 1 A 63 63 VAL HA H 63 3.370 3.341 0.029 1
1 716 . 9 1 1 A 63 63 VAL C C 63 178.000 177.596 0.404 1
1 717 . 9 1 1 A 63 63 VAL CA C 63 66.600 66.872 -0.272 1
1 718 . 9 1 1 A 63 63 VAL CB C 63 31.700 31.225 0.475 1
1 721 . 9 1 1 A 63 63 VAL N N 63 118.200 117.507 0.693 1
1 722 . 9 1 1 A 64 64 ASP H H 64 7.960 8.217 -0.257 1
1 723 . 9 1 1 A 64 64 ASP HA H 64 4.460 4.415 0.045 1
1 726 . 9 1 1 A 64 64 ASP C C 64 178.100 178.333 -0.233 1
1 727 . 9 1 1 A 64 64 ASP CA C 64 57.700 57.201 0.499 1
1 728 . 9 1 1 A 64 64 ASP CB C 64 39.800 41.291 -1.491 1
1 729 . 9 1 1 A 64 64 ASP N N 64 120.200 119.914 0.286 1
1 730 . 9 1 1 A 65 65 THR H H 65 8.380 8.460 -0.080 1
1 731 . 9 1 1 A 65 65 THR HA H 65 3.970 3.974 -0.004 1
1 736 . 9 1 1 A 65 65 THR C C 65 176.500 177.224 -0.724 1
1 737 . 9 1 1 A 65 65 THR CA C 65 66.500 66.519 -0.019 1
1 738 . 9 1 1 A 65 65 THR CB C 65 67.800 67.941 -0.141 1
1 740 . 9 1 1 A 65 65 THR N N 65 118.100 116.017 2.083 1
1 741 . 9 1 1 A 66 66 GLY H H 66 8.900 8.209 0.691 1
1 742 . 9 1 1 A 66 66 GLY HA2 H 66 3.630 3.643 -0.013 1
1 743 . 9 1 1 A 66 66 GLY HA3 H 66 3.630 3.676 -0.046 1
1 744 . 9 1 1 A 66 66 GLY C C 66 174.200 176.596 -2.396 1
1 745 . 9 1 1 A 66 66 GLY CA C 66 47.500 47.189 0.311 1
1 746 . 9 1 1 A 66 66 GLY N N 66 110.500 107.441 3.059 1
1 747 . 9 1 1 A 67 67 HIS H H 67 8.650 7.580 1.070 1
1 748 . 9 1 1 A 67 67 HIS HA H 67 4.220 4.649 -0.429 1
1 752 . 9 1 1 A 67 67 HIS C C 67 176.900 177.737 -0.837 1
1 753 . 9 1 1 A 67 67 HIS CA C 67 59.000 58.134 0.866 1
1 754 . 9 1 1 A 67 67 HIS CB C 67 27.800 29.535 -1.735 1
1 756 . 9 1 1 A 67 67 HIS N N 67 120.100 120.200 -0.100 1
1 757 . 9 1 1 A 68 68 GLN H H 68 7.860 8.508 -0.648 1
1 758 . 9 1 1 A 68 68 GLN HA H 68 3.990 4.075 -0.085 1
1 765 . 9 1 1 A 68 68 GLN C C 68 177.800 177.953 -0.153 1
1 766 . 9 1 1 A 68 68 GLN CA C 68 58.800 58.599 0.201 1
1 767 . 9 1 1 A 68 68 GLN CB C 68 28.200 27.446 0.754 1
1 769 . 9 1 1 A 68 68 GLN N N 68 121.400 117.020 4.380 1
1 771 . 9 1 1 A 69 69 LEU H H 69 8.300 8.057 0.243 1
1 772 . 9 1 1 A 69 69 LEU HA H 69 4.330 3.992 0.338 1
1 782 . 9 1 1 A 69 69 LEU C C 69 179.300 179.427 -0.127 1
1 783 . 9 1 1 A 69 69 LEU CA C 69 58.200 57.997 0.203 1
1 784 . 9 1 1 A 69 69 LEU CB C 69 40.500 41.628 -1.128 1
1 788 . 9 1 1 A 69 69 LEU N N 69 120.300 121.967 -1.667 1
1 789 . 9 1 1 A 70 70 LEU H H 70 8.460 8.087 0.373 1
1 790 . 9 1 1 A 70 70 LEU HA H 70 3.880 3.978 -0.098 1
1 800 . 9 1 1 A 70 70 LEU C C 70 179.100 179.231 -0.131 1
1 801 . 9 1 1 A 70 70 LEU CA C 70 58.300 57.813 0.487 1
1 802 . 9 1 1 A 70 70 LEU CB C 70 41.500 41.011 0.489 1
1 806 . 9 1 1 A 70 70 LEU N N 70 121.200 119.049 2.151 1
1 807 . 9 1 1 A 71 71 ASP H H 71 8.140 8.334 -0.194 1
1 808 . 9 1 1 A 71 71 ASP HA H 71 4.420 4.373 0.047 1
1 811 . 9 1 1 A 71 71 ASP C C 71 180.000 178.339 1.661 1
1 812 . 9 1 1 A 71 71 ASP CA C 71 57.300 57.466 -0.166 1
1 813 . 9 1 1 A 71 71 ASP CB C 71 39.300 41.554 -2.254 1
1 814 . 9 1 1 A 71 71 ASP N N 71 121.100 119.523 1.577 1
1 815 . 9 1 1 A 72 72 TYR H H 72 8.320 8.668 -0.348 1
1 816 . 9 1 1 A 72 72 TYR HA H 72 4.550 4.506 0.044 1
1 823 . 9 1 1 A 72 72 TYR C C 72 179.100 178.658 0.442 1
1 824 . 9 1 1 A 72 72 TYR CA C 72 60.500 60.753 -0.253 1
1 825 . 9 1 1 A 72 72 TYR CB C 72 37.600 38.153 -0.553 1
1 828 . 9 1 1 A 72 72 TYR N N 72 120.300 117.647 2.653 1
1 829 . 9 1 1 A 73 73 CYS H H 73 8.850 8.659 0.191 1
1 830 . 9 1 1 A 73 73 CYS HA H 73 4.380 4.616 -0.236 1
1 834 . 9 1 1 A 73 73 CYS C C 73 177.300 177.284 0.016 1
1 835 . 9 1 1 A 73 73 CYS CA C 73 64.400 63.597 0.803 1
1 836 . 9 1 1 A 73 73 CYS CB C 73 27.600 26.722 0.878 1
1 837 . 9 1 1 A 73 73 CYS N N 73 116.800 118.638 -1.838 1
1 838 . 9 1 1 A 74 74 SER H H 74 8.410 8.496 -0.086 1
1 839 . 9 1 1 A 74 74 SER HA H 74 4.290 4.287 0.003 1
1 842 . 9 1 1 A 74 74 SER C C 74 176.300 177.134 -0.834 1
1 843 . 9 1 1 A 74 74 SER CA C 74 61.400 61.344 0.056 1
1 844 . 9 1 1 A 74 74 SER CB C 74 62.600 62.998 -0.398 1
1 845 . 9 1 1 A 74 74 SER N N 74 115.900 115.934 -0.034 1
1 846 . 9 1 1 A 75 75 GLY H H 75 7.790 8.130 -0.340 1
1 847 . 9 1 1 A 75 75 GLY HA2 H 75 4.320 3.688 0.632 1
1 848 . 9 1 1 A 75 75 GLY HA3 H 75 3.900 3.693 0.207 1
1 849 . 9 1 1 A 75 75 GLY C C 75 174.600 175.428 -0.828 1
1 850 . 9 1 1 A 75 75 GLY CA C 75 45.600 47.138 -1.538 1
1 851 . 9 1 1 A 75 75 GLY N N 75 107.500 107.678 -0.178 1
1 852 . 9 1 1 A 76 76 TYR H H 76 8.040 8.426 -0.386 1
1 853 . 9 1 1 A 76 76 TYR HA H 76 4.310 4.007 0.303 1
1 860 . 9 1 1 A 76 76 TYR C C 76 176.200 177.563 -1.363 1
1 861 . 9 1 1 A 76 76 TYR CA C 76 60.000 61.007 -1.007 1
1 862 . 9 1 1 A 76 76 TYR CB C 76 40.700 38.794 1.906 1
1 865 . 9 1 1 A 76 76 TYR N N 76 121.900 123.218 -1.318 1
1 866 . 9 1 1 A 77 77 VAL H H 77 7.540 8.309 -0.769 1
1 867 . 9 1 1 A 77 77 VAL HA H 77 3.450 3.267 0.183 1
1 875 . 9 1 1 A 77 77 VAL C C 77 175.500 177.049 -1.549 1
1 876 . 9 1 1 A 77 77 VAL CA C 77 65.500 64.864 0.636 1
1 877 . 9 1 1 A 77 77 VAL CB C 77 31.600 31.127 0.473 1
1 880 . 9 1 1 A 77 77 VAL N N 77 116.600 118.933 -2.333 1
1 881 . 9 1 1 A 78 78 ASP H H 78 7.580 7.625 -0.045 1
1 882 . 9 1 1 A 78 78 ASP HA H 78 4.380 4.424 -0.044 1
1 885 . 9 1 1 A 78 78 ASP C C 78 177.000 177.445 -0.445 1
1 886 . 9 1 1 A 78 78 ASP CA C 78 55.800 56.198 -0.398 1
1 887 . 9 1 1 A 78 78 ASP CB C 78 39.900 40.764 -0.864 1
1 888 . 9 1 1 A 78 78 ASP N N 78 116.400 120.470 -4.070 1
1 889 . 9 1 1 A 79 79 CYS H H 79 8.040 7.497 0.543 1
1 890 . 9 1 1 A 79 79 CYS HA H 79 4.110 4.337 -0.227 1
1 893 . 9 1 1 A 79 79 CYS C C 79 174.200 174.354 -0.154 1
1 894 . 9 1 1 A 79 79 CYS CA C 79 58.600 58.871 -0.271 1
1 895 . 9 1 1 A 79 79 CYS CB C 79 27.200 28.006 -0.806 1
1 896 . 9 1 1 A 79 79 CYS N N 79 117.000 116.584 0.416 1
1 897 . 9 1 1 A 80 80 ILE H H 80 6.960 7.005 -0.045 1
1 898 . 9 1 1 A 80 80 ILE HA H 80 4.120 4.072 0.048 1
1 908 . 9 1 1 A 80 80 ILE CA C 80 58.700 59.349 -0.649 1
1 909 . 9 1 1 A 80 80 ILE CB C 80 38.500 37.765 0.735 1
1 913 . 9 1 1 A 80 80 ILE N N 80 123.200 122.353 0.847 1
1 914 . 9 1 1 A 81 81 PRO HA H 81 4.340 4.271 0.069 1
1 921 . 9 1 1 A 81 81 PRO C C 81 178.000 176.385 1.615 1
1 922 . 9 1 1 A 81 81 PRO CA C 81 64.700 65.222 -0.522 1
1 923 . 9 1 1 A 81 81 PRO CB C 81 32.600 31.851 0.749 1
1 926 . 9 1 1 A 82 82 GLN H H 82 7.560 8.181 -0.621 1
1 927 . 9 1 1 A 82 82 GLN HA H 82 4.600 4.455 0.145 1
1 934 . 9 1 1 A 82 82 GLN C C 82 177.400 176.034 1.366 1
1 935 . 9 1 1 A 82 82 GLN CA C 82 55.600 55.708 -0.108 1
1 936 . 9 1 1 A 82 82 GLN CB C 82 28.800 29.000 -0.200 1
1 938 . 9 1 1 A 82 82 GLN N N 82 115.900 117.250 -1.350 1
1 940 . 9 1 1 A 83 83 THR H H 83 8.880 8.416 0.464 1
1 941 . 9 1 1 A 83 83 THR HA H 83 3.750 3.947 -0.197 1
1 946 . 9 1 1 A 83 83 THR C C 83 176.300 176.297 0.003 1
1 947 . 9 1 1 A 83 83 THR CA C 83 66.500 66.533 -0.033 1
1 948 . 9 1 1 A 83 83 THR CB C 83 68.700 68.792 -0.092 1
1 950 . 9 1 1 A 83 83 THR N N 83 122.700 119.590 3.110 1
1 951 . 9 1 1 A 84 84 ARG H H 84 8.990 8.240 0.750 1
1 952 . 9 1 1 A 84 84 ARG HA H 84 4.250 4.050 0.200 1
1 960 . 9 1 1 A 84 84 ARG C C 84 178.900 179.197 -0.297 1
1 961 . 9 1 1 A 84 84 ARG CA C 84 59.100 59.710 -0.610 1
1 962 . 9 1 1 A 84 84 ARG CB C 84 29.300 30.260 -0.960 1
1 965 . 9 1 1 A 84 84 ARG N N 84 120.100 121.595 -1.495 1
1 967 . 9 1 1 A 85 85 ASN H H 85 7.270 8.267 -0.997 1
1 968 . 9 1 1 A 85 85 ASN HA H 85 4.810 4.648 0.162 1
1 973 . 9 1 1 A 85 85 ASN C C 85 176.800 177.724 -0.924 1
1 974 . 9 1 1 A 85 85 ASN CA C 85 54.800 56.344 -1.544 1
1 975 . 9 1 1 A 85 85 ASN CB C 85 37.600 38.035 -0.435 1
1 976 . 9 1 1 A 85 85 ASN N N 85 117.400 118.426 -1.026 1
1 978 . 9 1 1 A 86 86 LYS H H 86 8.340 8.243 0.097 1
1 979 . 9 1 1 A 86 86 LYS HA H 86 3.890 4.005 -0.115 1
1 988 . 9 1 1 A 86 86 LYS C C 86 178.600 179.066 -0.466 1
1 989 . 9 1 1 A 86 86 LYS CA C 86 60.800 59.155 1.645 1
1 990 . 9 1 1 A 86 86 LYS CB C 86 32.700 32.172 0.528 1
1 994 . 9 1 1 A 86 86 LYS N N 86 124.200 120.676 3.524 1
1 995 . 9 1 1 A 87 87 PHE H H 87 8.120 8.673 -0.553 1
1 996 . 9 1 1 A 87 87 PHE HA H 87 4.260 4.168 0.092 1
1 1004 . 9 1 1 A 87 87 PHE C C 87 178.100 177.679 0.421 1
1 1005 . 9 1 1 A 87 87 PHE CA C 87 61.300 61.724 -0.424 1
1 1006 . 9 1 1 A 87 87 PHE CB C 87 38.200 39.219 -1.019 1
1 1010 . 9 1 1 A 87 87 PHE N N 87 118.300 120.835 -2.535 1
1 1011 . 9 1 1 A 88 88 ALA H H 88 7.860 8.298 -0.438 1
1 1012 . 9 1 1 A 88 88 ALA HA H 88 4.200 4.093 0.107 1
1 1016 . 9 1 1 A 88 88 ALA C C 88 180.600 179.756 0.844 1
1 1017 . 9 1 1 A 88 88 ALA CA C 88 54.900 55.051 -0.151 1
1 1018 . 9 1 1 A 88 88 ALA CB C 88 18.100 17.918 0.182 1
1 1019 . 9 1 1 A 88 88 ALA N N 88 121.700 120.895 0.805 1
1 1020 . 9 1 1 A 89 89 PHE H H 89 8.690 8.560 0.130 1
1 1021 . 9 1 1 A 89 89 PHE HA H 89 4.080 4.165 -0.085 1
1 1029 . 9 1 1 A 89 89 PHE C C 89 176.300 177.595 -1.295 1
1 1030 . 9 1 1 A 89 89 PHE CA C 89 62.000 61.173 0.827 1
1 1031 . 9 1 1 A 89 89 PHE CB C 89 39.800 39.203 0.597 1
1 1035 . 9 1 1 A 89 89 PHE N N 89 120.100 120.157 -0.057 1
1 1036 . 9 1 1 A 90 90 ARG H H 90 8.560 8.306 0.254 1
1 1037 . 9 1 1 A 90 90 ARG HA H 90 3.790 3.886 -0.096 1
1 1045 . 9 1 1 A 90 90 ARG C C 90 179.600 178.232 1.368 1
1 1046 . 9 1 1 A 90 90 ARG CA C 90 60.000 59.653 0.347 1
1 1047 . 9 1 1 A 90 90 ARG CB C 90 30.000 30.040 -0.040 1
1 1050 . 9 1 1 A 90 90 ARG N N 90 118.000 118.084 -0.084 1
1 1052 . 9 1 1 A 91 91 GLU H H 91 8.120 8.203 -0.083 1
1 1053 . 9 1 1 A 91 91 GLU HA H 91 3.980 3.934 0.046 1
1 1058 . 9 1 1 A 91 91 GLU C C 91 178.400 178.842 -0.442 1
1 1059 . 9 1 1 A 91 91 GLU CA C 91 58.900 59.203 -0.303 1
1 1060 . 9 1 1 A 91 91 GLU CB C 91 28.800 29.061 -0.261 1
1 1062 . 9 1 1 A 91 91 GLU N N 91 119.300 117.418 1.882 1
1 1063 . 9 1 1 A 92 92 ALA H H 92 7.820 7.609 0.211 1
1 1064 . 9 1 1 A 92 92 ALA HA H 92 4.050 3.959 0.091 1
1 1068 . 9 1 1 A 92 92 ALA C C 92 179.800 179.843 -0.043 1
1 1069 . 9 1 1 A 92 92 ALA CA C 92 55.000 55.102 -0.102 1
1 1070 . 9 1 1 A 92 92 ALA CB C 92 18.000 18.295 -0.295 1
1 1071 . 9 1 1 A 92 92 ALA N N 92 123.400 122.143 1.257 1
1 1072 . 9 1 1 A 93 93 VAL H H 93 8.430 8.044 0.386 1
1 1073 . 9 1 1 A 93 93 VAL HA H 93 3.250 3.315 -0.065 1
1 1081 . 9 1 1 A 93 93 VAL C C 93 177.900 177.702 0.198 1
1 1082 . 9 1 1 A 93 93 VAL CA C 93 66.800 66.681 0.119 1
1 1083 . 9 1 1 A 93 93 VAL CB C 93 31.300 31.117 0.183 1
1 1086 . 9 1 1 A 93 93 VAL N N 93 119.900 118.361 1.539 1
1 1087 . 9 1 1 A 94 94 SER H H 94 7.990 8.187 -0.197 1
1 1088 . 9 1 1 A 94 94 SER HA H 94 4.230 3.988 0.242 1
1 1091 . 9 1 1 A 94 94 SER C C 94 177.200 177.504 -0.304 1
1 1092 . 9 1 1 A 94 94 SER CA C 94 61.600 61.496 0.104 1
1 1093 . 9 1 1 A 94 94 SER CB C 94 62.700 62.804 -0.104 1
1 1094 . 9 1 1 A 94 94 SER N N 94 116.000 115.710 0.290 1
1 1095 . 9 1 1 A 95 95 LYS H H 95 7.710 7.804 -0.094 1
1 1096 . 9 1 1 A 95 95 LYS HA H 95 4.020 4.058 -0.038 1
1 1105 . 9 1 1 A 95 95 LYS C C 95 179.400 179.182 0.218 1
1 1106 . 9 1 1 A 95 95 LYS CA C 95 59.600 59.325 0.275 1
1 1107 . 9 1 1 A 95 95 LYS CB C 95 32.300 32.327 -0.027 1
1 1111 . 9 1 1 A 95 95 LYS N N 95 121.400 122.260 -0.860 1
1 1112 . 9 1 1 A 96 96 LEU H H 96 8.270 8.123 0.147 1
1 1113 . 9 1 1 A 96 96 LEU HA H 96 4.040 3.930 0.110 1
1 1123 . 9 1 1 A 96 96 LEU C C 96 177.700 178.258 -0.558 1
1 1124 . 9 1 1 A 96 96 LEU CA C 96 58.600 58.177 0.423 1
1 1125 . 9 1 1 A 96 96 LEU CB C 96 41.000 41.771 -0.771 1
1 1129 . 9 1 1 A 96 96 LEU N N 96 124.800 120.892 3.908 1
1 1130 . 9 1 1 A 97 97 GLU H H 97 8.500 8.340 0.160 1
1 1131 . 9 1 1 A 97 97 GLU HA H 97 3.760 4.094 -0.334 1
1 1136 . 9 1 1 A 97 97 GLU C C 97 179.100 179.528 -0.428 1
1 1137 . 9 1 1 A 97 97 GLU CA C 97 59.900 59.049 0.851 1
1 1138 . 9 1 1 A 97 97 GLU CB C 97 28.700 29.335 -0.635 1
1 1140 . 9 1 1 A 97 97 GLU N N 97 119.000 117.324 1.676 1
1 1141 . 9 1 1 A 98 98 LEU H H 98 7.740 8.207 -0.467 1
1 1142 . 9 1 1 A 98 98 LEU HA H 98 4.110 3.993 0.117 1
1 1152 . 9 1 1 A 98 98 LEU C C 98 179.700 179.507 0.193 1
1 1153 . 9 1 1 A 98 98 LEU CA C 98 57.900 58.022 -0.122 1
1 1154 . 9 1 1 A 98 98 LEU CB C 98 41.800 41.917 -0.117 1
1 1158 . 9 1 1 A 98 98 LEU N N 98 119.200 120.878 -1.678 1
1 1159 . 9 1 1 A 99 99 SER H H 99 8.290 8.166 0.124 1
1 1160 . 9 1 1 A 99 99 SER HA H 99 4.220 4.151 0.069 1
1 1163 . 9 1 1 A 99 99 SER C C 99 176.600 176.629 -0.029 1
1 1164 . 9 1 1 A 99 99 SER CA C 99 62.400 62.332 0.068 1
1 1165 . 9 1 1 A 99 99 SER CB C 99 63.200 62.667 0.533 1
1 1166 . 9 1 1 A 99 99 SER N N 99 116.300 114.218 2.082 1
1 1167 . 9 1 1 A 100 100 LEU H H 100 8.490 8.355 0.135 1
1 1168 . 9 1 1 A 100 100 LEU HA H 100 3.960 3.974 -0.014 1
1 1178 . 9 1 1 A 100 100 LEU C C 100 179.300 179.765 -0.465 1
1 1179 . 9 1 1 A 100 100 LEU CA C 100 57.700 57.945 -0.245 1
1 1180 . 9 1 1 A 100 100 LEU CB C 100 41.300 41.262 0.038 1
1 1184 . 9 1 1 A 100 100 LEU N N 100 120.900 121.708 -0.808 1
1 1185 . 9 1 1 A 101 101 GLN H H 101 7.680 8.431 -0.751 1
1 1186 . 9 1 1 A 101 101 GLN HA H 101 4.100 4.060 0.040 1
1 1193 . 9 1 1 A 101 101 GLN C C 101 178.700 177.910 0.790 1
1 1194 . 9 1 1 A 101 101 GLN CA C 101 58.800 58.638 0.162 1
1 1195 . 9 1 1 A 101 101 GLN CB C 101 27.900 27.886 0.014 1
1 1197 . 9 1 1 A 101 101 GLN N N 101 119.100 118.062 1.038 1
1 1199 . 9 1 1 A 102 102 GLU H H 102 7.850 8.232 -0.382 1
1 1200 . 9 1 1 A 102 102 GLU HA H 102 4.050 4.118 -0.068 1
1 1205 . 9 1 1 A 102 102 GLU C C 102 179.100 179.029 0.071 1
1 1206 . 9 1 1 A 102 102 GLU CA C 102 58.400 59.289 -0.889 1
1 1207 . 9 1 1 A 102 102 GLU CB C 102 28.600 29.104 -0.504 1
1 1209 . 9 1 1 A 102 102 GLU N N 102 118.400 119.392 -0.992 1
1 1210 . 9 1 1 A 103 103 LEU H H 103 8.080 8.254 -0.174 1
1 1211 . 9 1 1 A 103 103 LEU HA H 103 4.020 4.004 0.016 1
1 1221 . 9 1 1 A 103 103 LEU C C 103 178.200 178.391 -0.191 1
1 1222 . 9 1 1 A 103 103 LEU CA C 103 57.000 58.346 -1.346 1
1 1223 . 9 1 1 A 103 103 LEU CB C 103 41.900 41.718 0.182 1
1 1227 . 9 1 1 A 103 103 LEU N N 103 120.600 123.468 -2.868 1
1 1228 . 9 1 1 A 104 104 GLN H H 104 7.900 8.655 -0.755 1
1 1229 . 9 1 1 A 104 104 GLN HA H 104 4.090 4.215 -0.125 1
1 1236 . 9 1 1 A 104 104 GLN C C 104 177.300 176.802 0.498 1
1 1237 . 9 1 1 A 104 104 GLN CA C 104 58.100 57.778 0.322 1
1 1238 . 9 1 1 A 104 104 GLN CB C 104 29.400 27.407 1.993 1
1 1240 . 9 1 1 A 104 104 GLN N N 104 117.700 116.676 1.024 1
1 1242 . 9 1 1 A 105 105 VAL H H 105 7.620 7.356 0.264 1
1 1243 . 9 1 1 A 105 105 VAL HA H 105 4.190 4.442 -0.252 1
1 1251 . 9 1 1 A 105 105 VAL C C 105 176.800 176.041 0.759 1
1 1252 . 9 1 1 A 105 105 VAL CA C 105 62.600 61.671 0.929 1
1 1253 . 9 1 1 A 105 105 VAL CB C 105 32.000 33.298 -1.298 1
1 1256 . 9 1 1 A 105 105 VAL N N 105 114.900 115.240 -0.340 1
1 1257 . 9 1 1 A 106 106 SER H H 106 7.900 7.834 0.066 1
1 1258 . 9 1 1 A 106 106 SER HA H 106 4.460 4.733 -0.273 1
1 1261 . 9 1 1 A 106 106 SER C C 106 175.000 175.515 -0.515 1
1 1262 . 9 1 1 A 106 106 SER CA C 106 58.900 57.084 1.816 1
1 1263 . 9 1 1 A 106 106 SER CB C 106 63.900 63.488 0.412 1
1 1264 . 9 1 1 A 106 106 SER N N 106 116.900 117.692 -0.792 1
1 1265 . 9 1 1 A 107 107 SER H H 107 8.230 7.736 0.494 1
1 1266 . 9 1 1 A 107 107 SER HA H 107 4.390 4.166 0.224 1
1 1269 . 9 1 1 A 107 107 SER C C 107 174.600 175.377 -0.777 1
1 1270 . 9 1 1 A 107 107 SER CA C 107 58.400 61.082 -2.682 1
1 1271 . 9 1 1 A 107 107 SER CB C 107 63.600 63.283 0.317 1
1 1272 . 9 1 1 A 107 107 SER N N 107 117.500 115.456 2.044 1
1 1273 . 9 1 1 A 108 108 ALA H H 108 8.080 7.805 0.275 1
1 1274 . 9 1 1 A 108 108 ALA HA H 108 4.280 3.901 0.379 1
1 1278 . 9 1 1 A 108 108 ALA C C 108 177.500 176.641 0.859 1
1 1279 . 9 1 1 A 108 108 ALA CA C 108 52.700 55.205 -2.505 1
1 1280 . 9 1 1 A 108 108 ALA CB C 108 19.200 17.424 1.776 1
1 1281 . 9 1 1 A 108 108 ALA N N 108 124.900 120.220 4.680 1
1 1282 . 9 1 1 A 109 109 ALA H H 109 8.080 8.168 -0.088 1
1 1283 . 9 1 1 A 109 109 ALA HA H 109 4.280 4.196 0.084 1
1 1287 . 9 1 1 A 109 109 ALA C C 109 177.700 178.801 -1.101 1
1 1288 . 9 1 1 A 109 109 ALA CA C 109 52.400 52.916 -0.516 1
1 1289 . 9 1 1 A 109 109 ALA CB C 109 19.400 19.276 0.124 1
1 1290 . 9 1 1 A 109 109 ALA N N 109 123.000 121.143 1.857 1
1 1291 . 9 1 1 A 110 110 ALA H H 110 8.300 8.484 -0.184 1
1 1292 . 9 1 1 A 110 110 ALA HA H 110 4.280 4.080 0.200 1
1 1296 . 9 1 1 A 110 110 ALA C C 110 178.200 178.137 0.063 1
1 1297 . 9 1 1 A 110 110 ALA CA C 110 52.700 55.025 -2.325 1
1 1298 . 9 1 1 A 110 110 ALA CB C 110 19.200 19.519 -0.319 1
1 1299 . 9 1 1 A 110 110 ALA N N 110 123.200 126.187 -2.987 1
1 1300 . 9 1 1 A 111 111 GLY H H 111 8.300 7.422 0.878 1
1 1301 . 9 1 1 A 111 111 GLY HA2 H 111 3.930 4.145 -0.215 1
1 1302 . 9 1 1 A 111 111 GLY HA3 H 111 3.940 4.146 -0.206 1
1 1303 . 9 1 1 A 111 111 GLY C C 111 173.700 172.438 1.262 1
1 1304 . 9 1 1 A 111 111 GLY CA C 111 45.100 45.717 -0.617 1
1 1305 . 9 1 1 A 111 111 GLY N N 111 108.000 101.902 6.098 1
1 1306 . 9 1 1 A 112 112 VAL H H 112 7.930 8.835 -0.905 1
1 1307 . 9 1 1 A 112 112 VAL HA H 112 4.420 4.534 -0.114 1
1 1315 . 9 1 1 A 112 112 VAL CA C 112 60.000 58.953 1.047 1
1 1316 . 9 1 1 A 112 112 VAL CB C 112 32.200 34.086 -1.886 1
1 1319 . 9 1 1 A 112 112 VAL N N 112 120.400 124.918 -4.518 1
1 1320 . 9 1 1 A 113 113 PRO HA H 113 4.370 4.288 0.082 1
1 1327 . 9 1 1 A 113 113 PRO C C 113 177.300 178.129 -0.829 1
1 1328 . 9 1 1 A 113 113 PRO CA C 113 63.900 63.914 -0.014 1
1 1329 . 9 1 1 A 113 113 PRO CB C 113 31.800 31.259 0.541 1
1 1332 . 9 1 1 A 114 114 GLY H H 114 8.570 8.817 -0.247 1
1 1333 . 9 1 1 A 114 114 GLY HA2 H 114 3.880 3.964 -0.084 1
1 1334 . 9 1 1 A 114 114 GLY HA3 H 114 4.120 3.965 0.155 1
1 1335 . 9 1 1 A 114 114 GLY C C 114 174.900 174.950 -0.050 1
1 1336 . 9 1 1 A 114 114 GLY CA C 114 45.200 46.117 -0.917 1
1 1337 . 9 1 1 A 114 114 GLY N N 114 109.000 113.186 -4.186 1
1 1338 . 9 1 1 A 115 115 THR H H 115 7.900 7.332 0.568 1
1 1339 . 9 1 1 A 115 115 THR HA H 115 4.400 4.141 0.259 1
1 1344 . 9 1 1 A 115 115 THR C C 115 174.300 174.167 0.133 1
1 1345 . 9 1 1 A 115 115 THR CA C 115 61.700 64.256 -2.556 1
1 1346 . 9 1 1 A 115 115 THR CB C 115 69.700 69.950 -0.250 1
1 1348 . 9 1 1 A 115 115 THR N N 115 111.400 115.387 -3.987 1
1 1349 . 9 1 1 A 116 116 ASN H H 116 8.450 7.784 0.666 1
1 1350 . 9 1 1 A 116 116 ASN HA H 116 4.970 5.251 -0.281 1
1 1355 . 9 1 1 A 116 116 ASN CA C 116 51.500 50.428 1.072 1
1 1356 . 9 1 1 A 116 116 ASN CB C 116 38.900 40.733 -1.833 1
1 1357 . 9 1 1 A 116 116 ASN N N 116 123.100 114.880 8.220 1
1 1359 . 9 1 1 A 117 117 PRO HA H 117 4.370 4.233 0.137 1
1 1366 . 9 1 1 A 117 117 PRO C C 117 178.400 178.320 0.080 1
1 1367 . 9 1 1 A 117 117 PRO CA C 117 64.800 65.001 -0.201 1
1 1368 . 9 1 1 A 117 117 PRO CB C 117 32.100 31.734 0.366 1
1 1371 . 9 1 1 A 118 118 VAL H H 118 7.750 7.598 0.152 1
1 1372 . 9 1 1 A 118 118 VAL HA H 118 3.810 3.749 0.061 1
1 1380 . 9 1 1 A 118 118 VAL C C 118 178.300 178.093 0.207 1
1 1381 . 9 1 1 A 118 118 VAL CA C 118 65.200 65.784 -0.584 1
1 1382 . 9 1 1 A 118 118 VAL CB C 118 31.500 31.447 0.053 1
1 1385 . 9 1 1 A 118 118 VAL N N 118 118.300 116.307 1.993 1
1 1386 . 9 1 1 A 119 119 LEU H H 119 7.540 7.930 -0.390 1
1 1387 . 9 1 1 A 119 119 LEU HA H 119 4.030 3.848 0.182 1
1 1397 . 9 1 1 A 119 119 LEU C C 119 178.900 179.047 -0.147 1
1 1398 . 9 1 1 A 119 119 LEU CA C 119 57.800 58.185 -0.385 1
1 1399 . 9 1 1 A 119 119 LEU CB C 119 40.700 41.309 -0.609 1
1 1403 . 9 1 1 A 119 119 LEU N N 119 119.700 119.523 0.177 1
1 1404 . 9 1 1 A 120 120 ASN H H 120 8.080 8.046 0.034 1
1 1405 . 9 1 1 A 120 120 ASN HA H 120 4.420 4.522 -0.102 1
1 1410 . 9 1 1 A 120 120 ASN C C 120 178.100 178.593 -0.493 1
1 1411 . 9 1 1 A 120 120 ASN CA C 120 56.100 56.130 -0.030 1
1 1412 . 9 1 1 A 120 120 ASN CB C 120 37.800 38.004 -0.204 1
1 1413 . 9 1 1 A 120 120 ASN N N 120 117.700 117.031 0.669 1
1 1415 . 9 1 1 A 121 121 ASN H H 121 8.120 8.339 -0.219 1
1 1416 . 9 1 1 A 121 121 ASN HA H 121 4.490 4.535 -0.045 1
1 1421 . 9 1 1 A 121 121 ASN C C 121 178.000 178.368 -0.368 1
1 1422 . 9 1 1 A 121 121 ASN CA C 121 56.100 56.501 -0.401 1
1 1423 . 9 1 1 A 121 121 ASN CB C 121 37.800 38.052 -0.252 1
1 1424 . 9 1 1 A 121 121 ASN N N 121 120.000 119.526 0.474 1
1 1426 . 9 1 1 A 122 122 LEU H H 122 8.180 8.399 -0.219 1
1 1427 . 9 1 1 A 122 122 LEU HA H 122 4.050 3.927 0.123 1
1 1437 . 9 1 1 A 122 122 LEU C C 122 173.800 178.949 -5.149 1
1 1438 . 9 1 1 A 122 122 LEU CA C 122 58.500 58.053 0.447 1
1 1439 . 9 1 1 A 122 122 LEU CB C 122 41.900 41.496 0.404 1
1 1443 . 9 1 1 A 122 122 LEU N N 122 122.600 121.149 1.451 1
1 1444 . 9 1 1 A 123 123 LEU H H 123 8.260 7.834 0.426 1
1 1445 . 9 1 1 A 123 123 LEU HA H 123 3.850 3.965 -0.115 1
1 1455 . 9 1 1 A 123 123 LEU C C 123 178.900 178.443 0.457 1
1 1456 . 9 1 1 A 123 123 LEU CA C 123 58.500 58.072 0.428 1
1 1457 . 9 1 1 A 123 123 LEU CB C 123 41.200 41.257 -0.057 1
1 1461 . 9 1 1 A 123 123 LEU N N 123 119.700 120.930 -1.230 1
1 1462 . 9 1 1 A 124 124 SER H H 124 7.950 8.277 -0.327 1
1 1463 . 9 1 1 A 124 124 SER HA H 124 4.240 4.027 0.213 1
1 1466 . 9 1 1 A 124 124 SER C C 124 177.500 177.138 0.362 1
1 1467 . 9 1 1 A 124 124 SER CA C 124 61.600 61.687 -0.087 1
1 1468 . 9 1 1 A 124 124 SER CB C 124 62.600 62.882 -0.282 1
1 1469 . 9 1 1 A 124 124 SER N N 124 113.400 114.428 -1.028 1
1 1470 . 9 1 1 A 125 125 CYS H H 125 8.040 8.255 -0.215 1
1 1471 . 9 1 1 A 125 125 CYS HA H 125 4.350 4.129 0.221 1
1 1474 . 9 1 1 A 125 125 CYS C C 125 176.800 176.780 0.020 1
1 1475 . 9 1 1 A 125 125 CYS CA C 125 62.600 63.923 -1.323 1
1 1476 . 9 1 1 A 125 125 CYS CB C 125 27.100 26.952 0.148 1
1 1477 . 9 1 1 A 125 125 CYS N N 125 119.800 119.403 0.397 1
1 1478 . 9 1 1 A 126 126 VAL H H 126 8.290 8.500 -0.210 1
1 1479 . 9 1 1 A 126 126 VAL HA H 126 3.430 3.402 0.028 1
1 1487 . 9 1 1 A 126 126 VAL C C 126 177.800 177.752 0.048 1
1 1488 . 9 1 1 A 126 126 VAL CA C 126 67.100 66.884 0.216 1
1 1489 . 9 1 1 A 126 126 VAL CB C 126 31.400 31.466 -0.066 1
1 1492 . 9 1 1 A 126 126 VAL N N 126 121.900 120.687 1.213 1
1 1493 . 9 1 1 A 127 127 GLN H H 127 8.200 8.447 -0.247 1
1 1494 . 9 1 1 A 127 127 GLN HA H 127 3.970 3.967 0.003 1
1 1501 . 9 1 1 A 127 127 GLN C C 127 178.200 178.138 0.062 1
1 1502 . 9 1 1 A 127 127 GLN CA C 127 58.700 58.812 -0.112 1
1 1503 . 9 1 1 A 127 127 GLN CB C 127 27.800 28.560 -0.760 1
1 1505 . 9 1 1 A 127 127 GLN N N 127 119.700 118.435 1.265 1
1 1507 . 9 1 1 A 128 128 GLU H H 128 7.880 7.852 0.028 1
1 1508 . 9 1 1 A 128 128 GLU HA H 128 4.200 4.106 0.094 1
1 1513 . 9 1 1 A 128 128 GLU C C 128 178.400 178.641 -0.241 1
1 1514 . 9 1 1 A 128 128 GLU CA C 128 59.000 58.980 0.020 1
1 1515 . 9 1 1 A 128 128 GLU CB C 128 28.400 29.529 -1.129 1
1 1517 . 9 1 1 A 128 128 GLU N N 128 119.800 119.700 0.100 1
1 1518 . 9 1 1 A 129 129 ILE H H 129 8.000 8.427 -0.427 1
1 1519 . 9 1 1 A 129 129 ILE HA H 129 3.460 3.550 -0.090 1
1 1529 . 9 1 1 A 129 129 ILE C C 129 176.800 178.147 -1.347 1
1 1530 . 9 1 1 A 129 129 ILE CA C 129 66.100 65.380 0.720 1
1 1531 . 9 1 1 A 129 129 ILE CB C 129 38.200 37.581 0.619 1
1 1535 . 9 1 1 A 129 129 ILE N N 129 119.500 120.300 -0.800 1
1 1536 . 9 1 1 A 130 130 SER H H 130 8.040 8.352 -0.312 1
1 1537 . 9 1 1 A 130 130 SER HA H 130 3.780 4.215 -0.435 1
1 1540 . 9 1 1 A 130 130 SER C C 130 176.200 176.381 -0.181 1
1 1541 . 9 1 1 A 130 130 SER CA C 130 62.100 61.546 0.554 1
1 1542 . 9 1 1 A 130 130 SER CB C 130 62.600 62.184 0.416 1
1 1543 . 9 1 1 A 130 130 SER N N 130 112.800 114.751 -1.951 1
1 1544 . 9 1 1 A 131 131 ASP H H 131 8.270 7.826 0.444 1
1 1545 . 9 1 1 A 131 131 ASP HA H 131 4.310 4.425 -0.115 1
1 1548 . 9 1 1 A 131 131 ASP C C 131 179.200 178.574 0.626 1
1 1549 . 9 1 1 A 131 131 ASP CA C 131 56.800 57.532 -0.732 1
1 1550 . 9 1 1 A 131 131 ASP CB C 131 40.900 41.218 -0.318 1
1 1551 . 9 1 1 A 131 131 ASP N N 131 119.600 122.027 -2.427 1
1 1552 . 9 1 1 A 132 132 VAL H H 132 8.470 8.286 0.184 1
1 1553 . 9 1 1 A 132 132 VAL HA H 132 3.520 3.749 -0.229 1
1 1561 . 9 1 1 A 132 132 VAL C C 132 178.700 178.265 0.435 1
1 1562 . 9 1 1 A 132 132 VAL CA C 132 66.500 66.434 0.066 1
1 1563 . 9 1 1 A 132 132 VAL CB C 132 31.500 31.773 -0.273 1
1 1566 . 9 1 1 A 132 132 VAL N N 132 118.100 119.754 -1.654 1
1 1567 . 9 1 1 A 133 133 VAL H H 133 8.140 7.741 0.399 1
1 1568 . 9 1 1 A 133 133 VAL HA H 133 3.770 4.043 -0.273 1
1 1576 . 9 1 1 A 133 133 VAL C C 133 176.500 176.431 0.069 1
1 1577 . 9 1 1 A 133 133 VAL CA C 133 65.100 66.004 -0.904 1
1 1578 . 9 1 1 A 133 133 VAL CB C 133 31.600 31.430 0.170 1
1 1581 . 9 1 1 A 133 133 VAL N N 133 117.000 120.130 -3.130 1
1 1582 . 9 1 1 A 134 134 GLN H H 134 7.490 7.860 -0.370 1
1 1583 . 9 1 1 A 134 134 GLN HA H 134 4.350 4.532 -0.182 1
1 1590 . 9 1 1 A 134 134 GLN C C 134 175.400 175.319 0.081 1
1 1591 . 9 1 1 A 134 134 GLN CA C 134 56.700 55.588 1.112 1
1 1592 . 9 1 1 A 134 134 GLN CB C 134 30.500 29.241 1.259 1
1 1594 . 9 1 1 A 134 134 GLN N N 134 116.300 117.852 -1.552 1
1 1 . 10 1 1 A 2 2 GLY HA2 H 2 3.890 4.081 -0.191 1
1 2 . 10 1 1 A 2 2 GLY HA3 H 2 3.890 4.103 -0.213 1
1 3 . 10 1 1 A 2 2 GLY C C 2 174.200 171.968 2.232 1
1 4 . 10 1 1 A 2 2 GLY CA C 2 44.700 45.582 -0.882 1
1 5 . 10 1 1 A 3 3 HIS H H 3 8.380 8.740 -0.360 1
1 6 . 10 1 1 A 3 3 HIS HA H 3 4.610 4.884 -0.274 1
1 9 . 10 1 1 A 3 3 HIS C C 3 174.500 175.040 -0.540 1
1 10 . 10 1 1 A 3 3 HIS CA C 3 55.200 54.624 0.576 1
1 11 . 10 1 1 A 3 3 HIS CB C 3 28.800 29.085 -0.285 1
1 12 . 10 1 1 A 3 3 HIS N N 3 117.600 121.022 -3.422 1
1 13 . 10 1 1 A 4 4 HIS H H 4 8.520 8.005 0.515 1
1 14 . 10 1 1 A 4 4 HIS HA H 4 4.640 3.977 0.663 1
1 17 . 10 1 1 A 4 4 HIS C C 4 174.200 174.043 0.157 1
1 18 . 10 1 1 A 4 4 HIS CA C 4 55.100 58.299 -3.199 1
1 19 . 10 1 1 A 4 4 HIS CB C 4 28.900 27.297 1.603 1
1 20 . 10 1 1 A 4 4 HIS N N 4 119.000 117.943 1.057 1
1 21 . 10 1 1 A 5 5 HIS H H 5 8.530 8.131 0.399 1
1 22 . 10 1 1 A 5 5 HIS HA H 5 4.410 4.593 -0.183 1
1 25 . 10 1 1 A 5 5 HIS CA C 5 54.900 54.994 -0.094 1
1 26 . 10 1 1 A 5 5 HIS CB C 5 27.300 29.849 -2.549 1
1 27 . 10 1 1 A 5 5 HIS N N 5 121.600 120.132 1.468 1
1 28 . 10 1 1 A 6 6 HIS HA H 6 4.640 4.567 0.073 1
1 31 . 10 1 1 A 6 6 HIS C C 6 174.100 174.000 0.100 1
1 32 . 10 1 1 A 6 6 HIS CA C 6 55.100 54.261 0.839 1
1 33 . 10 1 1 A 6 6 HIS CB C 6 29.100 28.467 0.633 1
1 34 . 10 1 1 A 7 7 HIS H H 7 8.690 8.985 -0.295 1
1 35 . 10 1 1 A 7 7 HIS HA H 7 4.650 5.034 -0.384 1
1 38 . 10 1 1 A 7 7 HIS C C 7 174.200 173.879 0.321 1
1 39 . 10 1 1 A 7 7 HIS CA C 7 55.200 54.103 1.097 1
1 40 . 10 1 1 A 7 7 HIS CB C 7 29.300 31.272 -1.972 1
1 41 . 10 1 1 A 7 7 HIS N N 7 121.400 127.021 -5.621 1
1 42 . 10 1 1 A 8 8 HIS H H 8 8.660 8.460 0.200 1
1 43 . 10 1 1 A 8 8 HIS HA H 8 4.700 4.496 0.204 1
1 46 . 10 1 1 A 8 8 HIS C C 8 174.200 174.793 -0.593 1
1 47 . 10 1 1 A 8 8 HIS CA C 8 55.000 54.359 0.641 1
1 48 . 10 1 1 A 8 8 HIS CB C 8 29.300 33.143 -3.843 1
1 49 . 10 1 1 A 8 8 HIS N N 8 120.400 126.083 -5.683 1
1 50 . 10 1 1 A 9 9 SER H H 9 8.490 8.645 -0.155 1
1 51 . 10 1 1 A 9 9 SER HA H 9 4.390 4.648 -0.258 1
1 54 . 10 1 1 A 9 9 SER C C 9 174.100 174.233 -0.133 1
1 55 . 10 1 1 A 9 9 SER CA C 9 58.300 58.163 0.137 1
1 56 . 10 1 1 A 9 9 SER CB C 9 63.700 64.756 -1.056 1
1 57 . 10 1 1 A 9 9 SER N N 9 118.100 117.925 0.175 1
1 58 . 10 1 1 A 10 10 HIS H H 10 8.710 8.657 0.053 1
1 59 . 10 1 1 A 10 10 HIS HA H 10 4.690 5.344 -0.654 1
1 63 . 10 1 1 A 10 10 HIS C C 10 174.200 172.537 1.663 1
1 64 . 10 1 1 A 10 10 HIS CA C 10 55.200 53.874 1.326 1
1 65 . 10 1 1 A 10 10 HIS CB C 10 28.800 32.762 -3.962 1
1 66 . 10 1 1 A 10 10 HIS N N 10 120.700 116.725 3.975 1
1 67 . 10 1 1 A 11 11 MET H H 11 8.410 8.601 -0.191 1
1 68 . 10 1 1 A 11 11 MET HA H 11 4.420 4.520 -0.100 1
1 76 . 10 1 1 A 11 11 MET C C 11 175.800 175.931 -0.131 1
1 77 . 10 1 1 A 11 11 MET CA C 11 55.100 54.897 0.203 1
1 78 . 10 1 1 A 11 11 MET CB C 11 32.800 33.950 -1.150 1
1 81 . 10 1 1 A 11 11 MET N N 11 122.300 120.156 2.144 1
1 82 . 10 1 1 A 12 12 ALA H H 12 8.440 8.464 -0.024 1
1 83 . 10 1 1 A 12 12 ALA HA H 12 4.280 4.076 0.204 1
1 87 . 10 1 1 A 12 12 ALA C C 12 177.400 177.036 0.364 1
1 88 . 10 1 1 A 12 12 ALA CA C 12 52.400 54.308 -1.908 1
1 89 . 10 1 1 A 12 12 ALA CB C 12 18.800 18.249 0.551 1
1 90 . 10 1 1 A 12 12 ALA N N 12 125.900 120.476 5.424 1
1 91 . 10 1 1 A 13 13 ASN H H 13 8.440 8.595 -0.155 1
1 92 . 10 1 1 A 13 13 ASN HA H 13 4.660 5.559 -0.899 1
1 97 . 10 1 1 A 13 13 ASN C C 13 175.900 173.556 2.344 1
1 98 . 10 1 1 A 13 13 ASN CA C 13 53.200 51.470 1.730 1
1 99 . 10 1 1 A 13 13 ASN CB C 13 38.800 41.128 -2.328 1
1 100 . 10 1 1 A 13 13 ASN N N 13 118.300 116.264 2.036 1
1 102 . 10 1 1 A 14 14 GLY H H 14 8.370 9.232 -0.862 1
1 103 . 10 1 1 A 14 14 GLY HA2 H 14 3.920 3.968 -0.048 1
1 104 . 10 1 1 A 14 14 GLY HA3 H 14 3.920 3.977 -0.057 1
1 105 . 10 1 1 A 14 14 GLY C C 14 174.000 173.116 0.884 1
1 106 . 10 1 1 A 14 14 GLY CA C 14 45.200 47.291 -2.091 1
1 107 . 10 1 1 A 14 14 GLY N N 14 109.600 109.478 0.122 1
1 108 . 10 1 1 A 15 15 ALA H H 15 8.140 7.972 0.168 1
1 109 . 10 1 1 A 15 15 ALA HA H 15 4.280 4.330 -0.050 1
1 113 . 10 1 1 A 15 15 ALA C C 15 177.300 176.427 0.873 1
1 114 . 10 1 1 A 15 15 ALA CA C 15 52.500 52.206 0.294 1
1 115 . 10 1 1 A 15 15 ALA CB C 15 19.100 18.884 0.216 1
1 116 . 10 1 1 A 15 15 ALA N N 15 123.800 126.717 -2.917 1
1 117 . 10 1 1 A 16 16 ALA H H 16 8.030 8.296 -0.266 1
1 118 . 10 1 1 A 16 16 ALA HA H 16 4.280 4.859 -0.579 1
1 122 . 10 1 1 A 16 16 ALA C C 16 178.400 178.027 0.373 1
1 123 . 10 1 1 A 16 16 ALA CA C 16 52.600 50.576 2.024 1
1 124 . 10 1 1 A 16 16 ALA CB C 16 19.100 20.217 -1.117 1
1 125 . 10 1 1 A 16 16 ALA N N 16 122.300 126.715 -4.415 1
1 126 . 10 1 1 A 17 17 GLY H H 17 8.320 8.835 -0.515 1
1 127 . 10 1 1 A 17 17 GLY HA2 H 17 3.960 3.859 0.101 1
1 128 . 10 1 1 A 17 17 GLY HA3 H 17 3.960 3.859 0.101 1
1 129 . 10 1 1 A 17 17 GLY C C 17 174.500 175.709 -1.209 1
1 130 . 10 1 1 A 17 17 GLY CA C 17 45.200 46.413 -1.213 1
1 131 . 10 1 1 A 17 17 GLY N N 17 107.800 111.712 -3.912 1
1 132 . 10 1 1 A 18 18 THR H H 18 7.970 7.784 0.186 1
1 133 . 10 1 1 A 18 18 THR HA H 18 4.290 4.013 0.277 1
1 138 . 10 1 1 A 18 18 THR C C 18 174.600 176.647 -2.047 1
1 139 . 10 1 1 A 18 18 THR CA C 18 62.000 66.273 -4.273 1
1 140 . 10 1 1 A 18 18 THR CB C 18 69.700 68.654 1.046 1
1 142 . 10 1 1 A 18 18 THR N N 18 113.800 116.996 -3.196 1
1 143 . 10 1 1 A 19 19 LYS H H 19 8.350 8.812 -0.462 1
1 144 . 10 1 1 A 19 19 LYS HA H 19 4.270 4.177 0.093 1
1 153 . 10 1 1 A 19 19 LYS C C 19 176.600 177.109 -0.509 1
1 154 . 10 1 1 A 19 19 LYS CA C 19 56.500 58.260 -1.760 1
1 155 . 10 1 1 A 19 19 LYS CB C 19 32.800 31.599 1.201 1
1 159 . 10 1 1 A 19 19 LYS N N 19 124.000 119.671 4.329 1
1 160 . 10 1 1 A 20 20 VAL H H 20 8.060 7.705 0.355 1
1 161 . 10 1 1 A 20 20 VAL HA H 20 3.990 4.420 -0.430 1
1 169 . 10 1 1 A 20 20 VAL C C 20 175.900 176.288 -0.388 1
1 170 . 10 1 1 A 20 20 VAL CA C 20 62.400 61.964 0.436 1
1 171 . 10 1 1 A 20 20 VAL CB C 20 32.600 31.527 1.073 1
1 174 . 10 1 1 A 20 20 VAL N N 20 121.700 118.664 3.036 1
1 175 . 10 1 1 A 21 21 ALA H H 21 8.310 8.028 0.282 1
1 176 . 10 1 1 A 21 21 ALA HA H 21 4.290 4.044 0.246 1
1 180 . 10 1 1 A 21 21 ALA C C 21 177.600 178.919 -1.319 1
1 181 . 10 1 1 A 21 21 ALA CA C 21 52.400 54.566 -2.166 1
1 182 . 10 1 1 A 21 21 ALA CB C 21 19.000 18.673 0.327 1
1 183 . 10 1 1 A 21 21 ALA N N 21 127.700 125.637 2.063 1
1 184 . 10 1 1 A 22 22 LEU H H 22 8.150 7.627 0.523 1
1 185 . 10 1 1 A 22 22 LEU HA H 22 4.280 4.293 -0.013 1
1 195 . 10 1 1 A 22 22 LEU C C 22 177.400 177.093 0.307 1
1 196 . 10 1 1 A 22 22 LEU CA C 22 55.200 54.779 0.421 1
1 197 . 10 1 1 A 22 22 LEU CB C 22 42.200 41.019 1.181 1
1 201 . 10 1 1 A 22 22 LEU N N 22 121.800 116.079 5.721 1
1 202 . 10 1 1 A 23 23 ARG H H 23 8.240 7.718 0.522 1
1 203 . 10 1 1 A 23 23 ARG HA H 23 4.290 4.308 -0.018 1
1 211 . 10 1 1 A 23 23 ARG C C 23 176.300 175.928 0.372 1
1 212 . 10 1 1 A 23 23 ARG CA C 23 56.000 55.092 0.908 1
1 213 . 10 1 1 A 23 23 ARG CB C 23 30.600 28.745 1.855 1
1 216 . 10 1 1 A 23 23 ARG N N 23 122.000 122.537 -0.537 1
1 218 . 10 1 1 A 24 24 LYS H H 24 8.370 8.963 -0.593 1
1 219 . 10 1 1 A 24 24 LYS HA H 24 4.330 4.532 -0.202 1
1 228 . 10 1 1 A 24 24 LYS C C 24 176.800 176.537 0.263 1
1 229 . 10 1 1 A 24 24 LYS CA C 24 56.400 56.910 -0.510 1
1 230 . 10 1 1 A 24 24 LYS CB C 24 32.700 34.986 -2.286 1
1 234 . 10 1 1 A 24 24 LYS N N 24 122.900 126.752 -3.852 1
1 235 . 10 1 1 A 25 25 THR H H 25 8.100 7.573 0.527 1
1 236 . 10 1 1 A 25 25 THR HA H 25 4.290 4.954 -0.664 1
1 241 . 10 1 1 A 25 25 THR C C 25 174.600 173.690 0.910 1
1 242 . 10 1 1 A 25 25 THR CA C 25 61.500 59.283 2.217 1
1 243 . 10 1 1 A 25 25 THR CB C 25 69.800 72.209 -2.409 1
1 245 . 10 1 1 A 25 25 THR N N 25 115.500 109.109 6.391 1
1 246 . 10 1 1 A 26 26 LYS H H 26 8.370 8.505 -0.135 1
1 247 . 10 1 1 A 26 26 LYS HA H 26 4.270 4.312 -0.042 1
1 256 . 10 1 1 A 26 26 LYS C C 26 176.600 176.923 -0.323 1
1 257 . 10 1 1 A 26 26 LYS CA C 26 56.600 56.845 -0.245 1
1 258 . 10 1 1 A 26 26 LYS CB C 26 32.700 33.244 -0.544 1
1 262 . 10 1 1 A 26 26 LYS N N 26 123.700 121.137 2.563 1
1 263 . 10 1 1 A 27 27 GLN H H 27 8.390 8.901 -0.511 1
1 264 . 10 1 1 A 27 27 GLN HA H 27 4.240 4.599 -0.359 1
1 271 . 10 1 1 A 27 27 GLN C C 27 175.900 176.151 -0.251 1
1 272 . 10 1 1 A 27 27 GLN CA C 27 56.100 56.320 -0.220 1
1 273 . 10 1 1 A 27 27 GLN CB C 27 29.300 30.293 -0.993 1
1 275 . 10 1 1 A 27 27 GLN N N 27 121.700 118.584 3.116 1
1 277 . 10 1 1 A 28 28 ALA H H 28 8.330 7.877 0.453 1
1 278 . 10 1 1 A 28 28 ALA HA H 28 4.240 4.501 -0.261 1
1 282 . 10 1 1 A 28 28 ALA C C 28 177.700 177.211 0.489 1
1 283 . 10 1 1 A 28 28 ALA CA C 28 52.500 51.450 1.050 1
1 284 . 10 1 1 A 28 28 ALA CB C 28 19.100 22.367 -3.267 1
1 285 . 10 1 1 A 28 28 ALA N N 28 125.400 119.419 5.981 1
1 286 . 10 1 1 A 29 29 ALA H H 29 8.250 8.903 -0.653 1
1 287 . 10 1 1 A 29 29 ALA HA H 29 4.230 3.994 0.236 1
1 291 . 10 1 1 A 29 29 ALA C C 29 178.000 179.666 -1.666 1
1 292 . 10 1 1 A 29 29 ALA CA C 29 52.500 55.471 -2.971 1
1 293 . 10 1 1 A 29 29 ALA CB C 29 19.100 18.219 0.881 1
1 294 . 10 1 1 A 29 29 ALA N N 29 123.000 124.009 -1.009 1
1 295 . 10 1 1 A 30 30 GLU H H 30 8.260 8.353 -0.093 1
1 296 . 10 1 1 A 30 30 GLU HA H 30 4.220 4.040 0.180 1
1 301 . 10 1 1 A 30 30 GLU C C 30 176.500 178.021 -1.521 1
1 302 . 10 1 1 A 30 30 GLU CA C 30 56.400 59.555 -3.155 1
1 303 . 10 1 1 A 30 30 GLU CB C 30 29.500 29.429 0.071 1
1 305 . 10 1 1 A 30 30 GLU N N 30 119.700 118.891 0.809 1
1 306 . 10 1 1 A 31 31 LYS H H 31 8.230 8.029 0.201 1
1 307 . 10 1 1 A 31 31 LYS HA H 31 4.280 4.486 -0.206 1
1 316 . 10 1 1 A 31 31 LYS C C 31 176.500 176.776 -0.276 1
1 317 . 10 1 1 A 31 31 LYS CA C 31 56.400 56.899 -0.499 1
1 318 . 10 1 1 A 31 31 LYS CB C 31 32.800 33.510 -0.710 1
1 322 . 10 1 1 A 31 31 LYS N N 31 122.700 118.762 3.938 1
1 323 . 10 1 1 A 32 32 ILE H H 32 8.140 7.432 0.708 1
1 324 . 10 1 1 A 32 32 ILE HA H 32 4.110 4.252 -0.142 1
1 334 . 10 1 1 A 32 32 ILE C C 32 176.400 176.321 0.079 1
1 335 . 10 1 1 A 32 32 ILE CA C 32 61.200 60.886 0.314 1
1 336 . 10 1 1 A 32 32 ILE CB C 32 38.600 39.124 -0.524 1
1 340 . 10 1 1 A 32 32 ILE N N 32 122.300 120.711 1.589 1
1 341 . 10 1 1 A 33 33 SER H H 33 8.230 8.981 -0.751 1
1 342 . 10 1 1 A 33 33 SER HA H 33 4.400 4.222 0.178 1
1 345 . 10 1 1 A 33 33 SER C C 33 174.800 176.111 -1.311 1
1 346 . 10 1 1 A 33 33 SER CA C 33 58.300 60.992 -2.692 1
1 347 . 10 1 1 A 33 33 SER CB C 33 63.700 62.837 0.863 1
1 348 . 10 1 1 A 33 33 SER N N 33 119.600 120.002 -0.402 1
1 349 . 10 1 1 A 34 34 ALA H H 34 8.430 8.280 0.150 1
1 350 . 10 1 1 A 34 34 ALA HA H 34 4.220 4.010 0.210 1
1 354 . 10 1 1 A 34 34 ALA C C 34 179.500 180.026 -0.526 1
1 355 . 10 1 1 A 34 34 ALA CA C 34 53.500 55.206 -1.706 1
1 356 . 10 1 1 A 34 34 ALA CB C 34 18.800 18.574 0.226 1
1 357 . 10 1 1 A 34 34 ALA N N 34 126.000 123.651 2.349 1
1 358 . 10 1 1 A 35 35 ASP H H 35 8.380 8.201 0.179 1
1 359 . 10 1 1 A 35 35 ASP HA H 35 4.520 4.323 0.197 1
1 362 . 10 1 1 A 35 35 ASP C C 35 176.500 178.420 -1.920 1
1 363 . 10 1 1 A 35 35 ASP CA C 35 54.800 57.131 -2.331 1
1 364 . 10 1 1 A 35 35 ASP CB C 35 40.200 40.363 -0.163 1
1 365 . 10 1 1 A 35 35 ASP N N 35 118.200 117.625 0.575 1
1 366 . 10 1 1 A 36 36 LYS H H 36 8.000 7.720 0.280 1
1 367 . 10 1 1 A 36 36 LYS HA H 36 4.270 4.062 0.208 1
1 376 . 10 1 1 A 36 36 LYS C C 36 177.000 177.210 -0.210 1
1 377 . 10 1 1 A 36 36 LYS CA C 36 56.800 58.421 -1.621 1
1 378 . 10 1 1 A 36 36 LYS CB C 36 32.900 32.217 0.683 1
1 382 . 10 1 1 A 36 36 LYS N N 36 120.900 118.638 2.262 1
1 383 . 10 1 1 A 37 37 ILE H H 37 7.970 7.096 0.874 1
1 384 . 10 1 1 A 37 37 ILE HA H 37 4.020 3.907 0.113 1
1 394 . 10 1 1 A 37 37 ILE C C 37 176.100 175.936 0.164 1
1 395 . 10 1 1 A 37 37 ILE CA C 37 61.300 62.342 -1.042 1
1 396 . 10 1 1 A 37 37 ILE CB C 37 38.100 37.669 0.431 1
1 400 . 10 1 1 A 37 37 ILE N N 37 121.800 121.961 -0.161 1
1 401 . 10 1 1 A 38 38 SER H H 38 7.980 8.783 -0.803 1
1 402 . 10 1 1 A 38 38 SER HA H 38 4.540 4.990 -0.450 1
1 405 . 10 1 1 A 38 38 SER C C 38 174.700 174.984 -0.284 1
1 406 . 10 1 1 A 38 38 SER CA C 38 58.200 57.327 0.873 1
1 407 . 10 1 1 A 38 38 SER CB C 38 64.400 66.190 -1.790 1
1 408 . 10 1 1 A 38 38 SER N N 38 119.000 123.066 -4.066 1
1 409 . 10 1 1 A 39 39 LYS H H 39 8.690 8.990 -0.300 1
1 410 . 10 1 1 A 39 39 LYS HA H 39 3.400 3.596 -0.196 1
1 419 . 10 1 1 A 39 39 LYS C C 39 177.400 177.962 -0.562 1
1 420 . 10 1 1 A 39 39 LYS CA C 39 59.800 60.274 -0.474 1
1 421 . 10 1 1 A 39 39 LYS CB C 39 32.400 32.688 -0.288 1
1 425 . 10 1 1 A 39 39 LYS N N 39 124.200 124.627 -0.427 1
1 426 . 10 1 1 A 40 40 GLU H H 40 8.280 8.402 -0.122 1
1 427 . 10 1 1 A 40 40 GLU HA H 40 3.840 4.029 -0.189 1
1 432 . 10 1 1 A 40 40 GLU C C 40 178.400 178.868 -0.468 1
1 433 . 10 1 1 A 40 40 GLU CA C 40 59.400 59.425 -0.025 1
1 434 . 10 1 1 A 40 40 GLU CB C 40 28.300 28.756 -0.456 1
1 436 . 10 1 1 A 40 40 GLU N N 40 116.300 117.424 -1.124 1
1 437 . 10 1 1 A 41 41 ALA H H 41 7.890 8.191 -0.301 1
1 438 . 10 1 1 A 41 41 ALA HA H 41 3.910 4.125 -0.215 1
1 442 . 10 1 1 A 41 41 ALA C C 41 179.900 179.582 0.318 1
1 443 . 10 1 1 A 41 41 ALA CA C 41 54.700 55.245 -0.545 1
1 444 . 10 1 1 A 41 41 ALA CB C 41 17.900 18.222 -0.322 1
1 445 . 10 1 1 A 41 41 ALA N N 41 122.300 122.706 -0.406 1
1 446 . 10 1 1 A 42 42 LEU H H 42 7.490 7.479 0.011 1
1 447 . 10 1 1 A 42 42 LEU HA H 42 3.480 4.116 -0.636 1
1 457 . 10 1 1 A 42 42 LEU C C 42 178.900 178.540 0.360 1
1 458 . 10 1 1 A 42 42 LEU CA C 42 59.800 57.635 2.165 1
1 459 . 10 1 1 A 42 42 LEU CB C 42 42.300 41.516 0.784 1
1 463 . 10 1 1 A 42 42 LEU N N 42 121.000 119.215 1.785 1
1 464 . 10 1 1 A 43 43 LEU H H 43 8.290 8.211 0.079 1
1 465 . 10 1 1 A 43 43 LEU HA H 43 3.780 3.866 -0.086 1
1 475 . 10 1 1 A 43 43 LEU C C 43 179.400 179.211 0.189 1
1 476 . 10 1 1 A 43 43 LEU CA C 43 57.600 58.058 -0.458 1
1 477 . 10 1 1 A 43 43 LEU CB C 43 40.900 41.303 -0.403 1
1 481 . 10 1 1 A 43 43 LEU N N 43 119.200 118.339 0.861 1
1 482 . 10 1 1 A 44 44 GLU H H 44 8.330 8.385 -0.055 1
1 483 . 10 1 1 A 44 44 GLU HA H 44 4.050 3.944 0.106 1
1 488 . 10 1 1 A 44 44 GLU C C 44 178.600 179.045 -0.445 1
1 489 . 10 1 1 A 44 44 GLU CA C 44 58.900 59.202 -0.302 1
1 490 . 10 1 1 A 44 44 GLU CB C 44 28.300 29.591 -1.291 1
1 492 . 10 1 1 A 44 44 GLU N N 44 119.600 117.671 1.929 1
1 493 . 10 1 1 A 45 45 CYS H H 45 7.690 7.809 -0.119 1
1 494 . 10 1 1 A 45 45 CYS HA H 45 4.120 4.031 0.089 1
1 497 . 10 1 1 A 45 45 CYS C C 45 176.100 177.011 -0.911 1
1 498 . 10 1 1 A 45 45 CYS CA C 45 62.500 62.745 -0.245 1
1 499 . 10 1 1 A 45 45 CYS CB C 45 26.200 26.241 -0.041 1
1 500 . 10 1 1 A 45 45 CYS N N 45 120.900 118.924 1.976 1
1 501 . 10 1 1 A 46 46 ALA H H 46 8.540 7.764 0.776 1
1 502 . 10 1 1 A 46 46 ALA HA H 46 3.900 3.986 -0.086 1
1 506 . 10 1 1 A 46 46 ALA C C 46 179.200 178.973 0.227 1
1 507 . 10 1 1 A 46 46 ALA CA C 46 55.500 55.239 0.261 1
1 508 . 10 1 1 A 46 46 ALA CB C 46 16.800 18.058 -1.258 1
1 509 . 10 1 1 A 46 46 ALA N N 46 121.500 122.013 -0.513 1
1 510 . 10 1 1 A 47 47 ASP H H 47 8.460 8.531 -0.071 1
1 511 . 10 1 1 A 47 47 ASP HA H 47 4.340 4.457 -0.117 1
1 514 . 10 1 1 A 47 47 ASP C C 47 178.800 178.542 0.258 1
1 515 . 10 1 1 A 47 47 ASP CA C 47 56.600 57.081 -0.481 1
1 516 . 10 1 1 A 47 47 ASP CB C 47 39.800 42.229 -2.429 1
1 517 . 10 1 1 A 47 47 ASP N N 47 119.000 118.327 0.673 1
1 518 . 10 1 1 A 48 48 LEU H H 48 8.040 8.024 0.016 1
1 519 . 10 1 1 A 48 48 LEU HA H 48 4.110 3.881 0.229 1
1 529 . 10 1 1 A 48 48 LEU C C 48 180.000 179.556 0.444 1
1 530 . 10 1 1 A 48 48 LEU CA C 48 58.000 58.286 -0.286 1
1 531 . 10 1 1 A 48 48 LEU CB C 48 41.700 41.492 0.208 1
1 535 . 10 1 1 A 48 48 LEU N N 48 123.000 119.469 3.531 1
1 536 . 10 1 1 A 49 49 LEU H H 49 8.300 7.968 0.332 1
1 537 . 10 1 1 A 49 49 LEU HA H 49 4.110 3.831 0.279 1
1 547 . 10 1 1 A 49 49 LEU C C 49 177.200 178.720 -1.520 1
1 548 . 10 1 1 A 49 49 LEU CA C 49 57.600 58.072 -0.472 1
1 549 . 10 1 1 A 49 49 LEU CB C 49 41.200 41.833 -0.633 1
1 553 . 10 1 1 A 49 49 LEU N N 49 120.900 119.414 1.486 1
1 554 . 10 1 1 A 50 50 SER H H 50 8.660 8.041 0.619 1
1 555 . 10 1 1 A 50 50 SER HA H 50 4.000 4.188 -0.188 1
1 558 . 10 1 1 A 50 50 SER C C 50 176.800 176.756 0.044 1
1 559 . 10 1 1 A 50 50 SER CA C 50 62.500 61.562 0.938 1
1 560 . 10 1 1 A 50 50 SER CB C 50 62.600 62.290 0.310 1
1 561 . 10 1 1 A 50 50 SER N N 50 113.300 113.180 0.120 1
1 562 . 10 1 1 A 51 51 SER H H 51 7.980 8.120 -0.140 1
1 563 . 10 1 1 A 51 51 SER HA H 51 4.220 4.088 0.132 1
1 566 . 10 1 1 A 51 51 SER C C 51 176.300 177.261 -0.961 1
1 567 . 10 1 1 A 51 51 SER CA C 51 61.200 61.585 -0.385 1
1 568 . 10 1 1 A 51 51 SER CB C 51 62.700 62.859 -0.159 1
1 569 . 10 1 1 A 51 51 SER N N 51 115.900 117.005 -1.105 1
1 570 . 10 1 1 A 52 52 ALA H H 52 8.030 8.065 -0.035 1
1 571 . 10 1 1 A 52 52 ALA HA H 52 4.130 4.206 -0.076 1
1 575 . 10 1 1 A 52 52 ALA C C 52 178.500 180.032 -1.532 1
1 576 . 10 1 1 A 52 52 ALA CA C 52 54.500 55.010 -0.510 1
1 577 . 10 1 1 A 52 52 ALA CB C 52 18.000 18.141 -0.141 1
1 578 . 10 1 1 A 52 52 ALA N N 52 125.400 123.329 2.071 1
1 579 . 10 1 1 A 53 53 LEU H H 53 7.710 8.128 -0.418 1
1 580 . 10 1 1 A 53 53 LEU HA H 53 4.180 4.036 0.144 1
1 590 . 10 1 1 A 53 53 LEU C C 53 177.700 178.635 -0.935 1
1 591 . 10 1 1 A 53 53 LEU CA C 53 56.500 57.545 -1.045 1
1 592 . 10 1 1 A 53 53 LEU CB C 53 42.400 41.353 1.047 1
1 596 . 10 1 1 A 53 53 LEU N N 53 113.800 118.178 -4.378 1
1 597 . 10 1 1 A 54 54 THR H H 54 7.550 7.221 0.329 1
1 598 . 10 1 1 A 54 54 THR HA H 54 4.420 4.260 0.160 1
1 603 . 10 1 1 A 54 54 THR C C 54 174.100 173.889 0.211 1
1 604 . 10 1 1 A 54 54 THR CA C 54 61.600 62.818 -1.218 1
1 605 . 10 1 1 A 54 54 THR CB C 54 69.300 69.245 0.055 1
1 607 . 10 1 1 A 54 54 THR N N 54 107.700 108.896 -1.196 1
1 608 . 10 1 1 A 55 55 GLU H H 55 7.750 7.579 0.171 1
1 609 . 10 1 1 A 55 55 GLU HA H 55 4.760 5.006 -0.246 1
1 614 . 10 1 1 A 55 55 GLU CA C 55 53.400 53.550 -0.150 1
1 615 . 10 1 1 A 55 55 GLU CB C 55 30.100 31.449 -1.349 1
1 617 . 10 1 1 A 55 55 GLU N N 55 122.800 118.406 4.394 1
1 618 . 10 1 1 A 56 56 PRO HA H 56 4.670 4.574 0.096 1
1 625 . 10 1 1 A 56 56 PRO C C 56 176.200 176.354 -0.154 1
1 626 . 10 1 1 A 56 56 PRO CA C 56 62.900 63.252 -0.352 1
1 627 . 10 1 1 A 56 56 PRO CB C 56 29.200 31.846 -2.646 1
1 630 . 10 1 1 A 57 57 VAL H H 57 8.010 8.377 -0.367 1
1 631 . 10 1 1 A 57 57 VAL HA H 57 4.590 4.968 -0.378 1
1 639 . 10 1 1 A 57 57 VAL CA C 57 58.600 58.282 0.318 1
1 640 . 10 1 1 A 57 57 VAL CB C 57 32.800 34.908 -2.108 1
1 643 . 10 1 1 A 57 57 VAL N N 57 121.400 117.362 4.038 1
1 644 . 10 1 1 A 58 58 PRO HA H 58 4.450 4.619 -0.169 1
1 651 . 10 1 1 A 58 58 PRO C C 58 177.500 177.797 -0.297 1
1 652 . 10 1 1 A 58 58 PRO CA C 58 62.600 62.702 -0.102 1
1 653 . 10 1 1 A 58 58 PRO CB C 58 32.200 32.769 -0.569 1
1 656 . 10 1 1 A 59 59 ASN H H 59 8.890 9.033 -0.143 1
1 657 . 10 1 1 A 59 59 ASN HA H 59 4.330 4.431 -0.101 1
1 662 . 10 1 1 A 59 59 ASN C C 59 177.600 177.104 0.496 1
1 663 . 10 1 1 A 59 59 ASN CA C 59 56.300 56.092 0.208 1
1 664 . 10 1 1 A 59 59 ASN CB C 59 38.400 38.695 -0.295 1
1 665 . 10 1 1 A 59 59 ASN N N 59 122.200 123.195 -0.995 1
1 667 . 10 1 1 A 60 60 SER H H 60 8.660 8.292 0.368 1
1 668 . 10 1 1 A 60 60 SER HA H 60 4.010 4.114 -0.104 1
1 671 . 10 1 1 A 60 60 SER C C 60 176.200 176.072 0.128 1
1 672 . 10 1 1 A 60 60 SER CA C 60 60.800 61.270 -0.470 1
1 673 . 10 1 1 A 60 60 SER CB C 60 61.500 62.651 -1.151 1
1 674 . 10 1 1 A 60 60 SER N N 60 113.200 115.501 -2.301 1
1 675 . 10 1 1 A 61 61 GLN H H 61 7.420 8.106 -0.686 1
1 676 . 10 1 1 A 61 61 GLN HA H 61 4.280 4.006 0.274 1
1 683 . 10 1 1 A 61 61 GLN C C 61 178.600 178.432 0.168 1
1 684 . 10 1 1 A 61 61 GLN CA C 61 57.900 58.877 -0.977 1
1 685 . 10 1 1 A 61 61 GLN CB C 61 28.600 27.949 0.651 1
1 687 . 10 1 1 A 61 61 GLN N N 61 122.200 121.223 0.977 1
1 689 . 10 1 1 A 62 62 LEU H H 62 7.430 7.739 -0.309 1
1 690 . 10 1 1 A 62 62 LEU HA H 62 3.850 3.965 -0.115 1
1 700 . 10 1 1 A 62 62 LEU C C 62 178.800 179.059 -0.259 1
1 701 . 10 1 1 A 62 62 LEU CA C 62 57.900 58.000 -0.100 1
1 702 . 10 1 1 A 62 62 LEU CB C 62 42.100 42.300 -0.200 1
1 706 . 10 1 1 A 62 62 LEU N N 62 120.600 119.996 0.604 1
1 707 . 10 1 1 A 63 63 VAL H H 63 8.200 8.071 0.129 1
1 708 . 10 1 1 A 63 63 VAL HA H 63 3.370 3.292 0.078 1
1 716 . 10 1 1 A 63 63 VAL C C 63 178.000 176.571 1.429 1
1 717 . 10 1 1 A 63 63 VAL CA C 63 66.600 66.819 -0.219 1
1 718 . 10 1 1 A 63 63 VAL CB C 63 31.700 30.943 0.757 1
1 721 . 10 1 1 A 63 63 VAL N N 63 118.200 117.348 0.852 1
1 722 . 10 1 1 A 64 64 ASP H H 64 7.960 8.209 -0.249 1
1 723 . 10 1 1 A 64 64 ASP HA H 64 4.460 4.612 -0.152 1
1 726 . 10 1 1 A 64 64 ASP C C 64 178.100 178.926 -0.826 1
1 727 . 10 1 1 A 64 64 ASP CA C 64 57.700 56.892 0.808 1
1 728 . 10 1 1 A 64 64 ASP CB C 64 39.800 40.175 -0.375 1
1 729 . 10 1 1 A 64 64 ASP N N 64 120.200 120.093 0.107 1
1 730 . 10 1 1 A 65 65 THR H H 65 8.380 8.156 0.224 1
1 731 . 10 1 1 A 65 65 THR HA H 65 3.970 3.957 0.013 1
1 736 . 10 1 1 A 65 65 THR C C 65 176.500 177.292 -0.792 1
1 737 . 10 1 1 A 65 65 THR CA C 65 66.500 66.393 0.107 1
1 738 . 10 1 1 A 65 65 THR CB C 65 67.800 68.084 -0.284 1
1 740 . 10 1 1 A 65 65 THR N N 65 118.100 117.518 0.582 1
1 741 . 10 1 1 A 66 66 GLY H H 66 8.900 8.277 0.623 1
1 742 . 10 1 1 A 66 66 GLY HA2 H 66 3.630 3.558 0.072 1
1 743 . 10 1 1 A 66 66 GLY HA3 H 66 3.630 3.593 0.037 1
1 744 . 10 1 1 A 66 66 GLY C C 66 174.200 176.820 -2.620 1
1 745 . 10 1 1 A 66 66 GLY CA C 66 47.500 47.272 0.228 1
1 746 . 10 1 1 A 66 66 GLY N N 66 110.500 107.252 3.248 1
1 747 . 10 1 1 A 67 67 HIS H H 67 8.650 7.711 0.939 1
1 748 . 10 1 1 A 67 67 HIS HA H 67 4.220 4.578 -0.358 1
1 752 . 10 1 1 A 67 67 HIS C C 67 176.900 177.698 -0.798 1
1 753 . 10 1 1 A 67 67 HIS CA C 67 59.000 58.093 0.907 1
1 754 . 10 1 1 A 67 67 HIS CB C 67 27.800 29.866 -2.066 1
1 756 . 10 1 1 A 67 67 HIS N N 67 120.100 120.214 -0.114 1
1 757 . 10 1 1 A 68 68 GLN H H 68 7.860 7.968 -0.108 1
1 758 . 10 1 1 A 68 68 GLN HA H 68 3.990 4.083 -0.093 1
1 765 . 10 1 1 A 68 68 GLN C C 68 177.800 178.085 -0.285 1
1 766 . 10 1 1 A 68 68 GLN CA C 68 58.800 58.425 0.375 1
1 767 . 10 1 1 A 68 68 GLN CB C 68 28.200 28.397 -0.197 1
1 769 . 10 1 1 A 68 68 GLN N N 68 121.400 116.907 4.493 1
1 771 . 10 1 1 A 69 69 LEU H H 69 8.300 8.150 0.150 1
1 772 . 10 1 1 A 69 69 LEU HA H 69 4.330 3.992 0.338 1
1 782 . 10 1 1 A 69 69 LEU C C 69 179.300 179.504 -0.204 1
1 783 . 10 1 1 A 69 69 LEU CA C 69 58.200 58.139 0.061 1
1 784 . 10 1 1 A 69 69 LEU CB C 69 40.500 41.578 -1.078 1
1 788 . 10 1 1 A 69 69 LEU N N 69 120.300 121.270 -0.970 1
1 789 . 10 1 1 A 70 70 LEU H H 70 8.460 7.889 0.571 1
1 790 . 10 1 1 A 70 70 LEU HA H 70 3.880 3.986 -0.106 1
1 800 . 10 1 1 A 70 70 LEU C C 70 179.100 178.778 0.322 1
1 801 . 10 1 1 A 70 70 LEU CA C 70 58.300 58.141 0.159 1
1 802 . 10 1 1 A 70 70 LEU CB C 70 41.500 41.407 0.093 1
1 806 . 10 1 1 A 70 70 LEU N N 70 121.200 119.506 1.694 1
1 807 . 10 1 1 A 71 71 ASP H H 71 8.140 8.036 0.104 1
1 808 . 10 1 1 A 71 71 ASP HA H 71 4.420 4.397 0.023 1
1 811 . 10 1 1 A 71 71 ASP C C 71 180.000 178.351 1.649 1
1 812 . 10 1 1 A 71 71 ASP CA C 71 57.300 57.453 -0.153 1
1 813 . 10 1 1 A 71 71 ASP CB C 71 39.300 41.594 -2.294 1
1 814 . 10 1 1 A 71 71 ASP N N 71 121.100 119.113 1.987 1
1 815 . 10 1 1 A 72 72 TYR H H 72 8.320 8.711 -0.391 1
1 816 . 10 1 1 A 72 72 TYR HA H 72 4.550 4.455 0.095 1
1 823 . 10 1 1 A 72 72 TYR C C 72 179.100 178.846 0.254 1
1 824 . 10 1 1 A 72 72 TYR CA C 72 60.500 60.756 -0.256 1
1 825 . 10 1 1 A 72 72 TYR CB C 72 37.600 38.157 -0.557 1
1 828 . 10 1 1 A 72 72 TYR N N 72 120.300 117.696 2.604 1
1 829 . 10 1 1 A 73 73 CYS H H 73 8.850 8.652 0.198 1
1 830 . 10 1 1 A 73 73 CYS HA H 73 4.380 4.549 -0.169 1
1 834 . 10 1 1 A 73 73 CYS C C 73 177.300 177.032 0.268 1
1 835 . 10 1 1 A 73 73 CYS CA C 73 64.400 63.270 1.130 1
1 836 . 10 1 1 A 73 73 CYS CB C 73 27.600 26.969 0.631 1
1 837 . 10 1 1 A 73 73 CYS N N 73 116.800 118.679 -1.879 1
1 838 . 10 1 1 A 74 74 SER H H 74 8.410 8.353 0.057 1
1 839 . 10 1 1 A 74 74 SER HA H 74 4.290 4.289 0.001 1
1 842 . 10 1 1 A 74 74 SER C C 74 176.300 177.248 -0.948 1
1 843 . 10 1 1 A 74 74 SER CA C 74 61.400 61.378 0.022 1
1 844 . 10 1 1 A 74 74 SER CB C 74 62.600 62.835 -0.235 1
1 845 . 10 1 1 A 74 74 SER N N 74 115.900 116.178 -0.278 1
1 846 . 10 1 1 A 75 75 GLY H H 75 7.790 8.126 -0.336 1
1 847 . 10 1 1 A 75 75 GLY HA2 H 75 4.320 3.722 0.598 1
1 848 . 10 1 1 A 75 75 GLY HA3 H 75 3.900 3.727 0.173 1
1 849 . 10 1 1 A 75 75 GLY C C 75 174.600 175.405 -0.805 1
1 850 . 10 1 1 A 75 75 GLY CA C 75 45.600 47.209 -1.609 1
1 851 . 10 1 1 A 75 75 GLY N N 75 107.500 108.591 -1.091 1
1 852 . 10 1 1 A 76 76 TYR H H 76 8.040 8.366 -0.326 1
1 853 . 10 1 1 A 76 76 TYR HA H 76 4.310 4.063 0.247 1
1 860 . 10 1 1 A 76 76 TYR C C 76 176.200 177.469 -1.269 1
1 861 . 10 1 1 A 76 76 TYR CA C 76 60.000 61.076 -1.076 1
1 862 . 10 1 1 A 76 76 TYR CB C 76 40.700 38.492 2.208 1
1 865 . 10 1 1 A 76 76 TYR N N 76 121.900 123.232 -1.332 1
1 866 . 10 1 1 A 77 77 VAL H H 77 7.540 8.535 -0.995 1
1 867 . 10 1 1 A 77 77 VAL HA H 77 3.450 3.280 0.170 1
1 875 . 10 1 1 A 77 77 VAL C C 77 175.500 177.479 -1.979 1
1 876 . 10 1 1 A 77 77 VAL CA C 77 65.500 64.785 0.715 1
1 877 . 10 1 1 A 77 77 VAL CB C 77 31.600 31.223 0.377 1
1 880 . 10 1 1 A 77 77 VAL N N 77 116.600 119.467 -2.867 1
1 881 . 10 1 1 A 78 78 ASP H H 78 7.580 8.194 -0.614 1
1 882 . 10 1 1 A 78 78 ASP HA H 78 4.380 4.424 -0.044 1
1 885 . 10 1 1 A 78 78 ASP C C 78 177.000 177.131 -0.131 1
1 886 . 10 1 1 A 78 78 ASP CA C 78 55.800 56.582 -0.782 1
1 887 . 10 1 1 A 78 78 ASP CB C 78 39.900 40.988 -1.088 1
1 888 . 10 1 1 A 78 78 ASP N N 78 116.400 120.643 -4.243 1
1 889 . 10 1 1 A 79 79 CYS H H 79 8.040 7.707 0.333 1
1 890 . 10 1 1 A 79 79 CYS HA H 79 4.110 4.500 -0.390 1
1 893 . 10 1 1 A 79 79 CYS C C 79 174.200 174.234 -0.034 1
1 894 . 10 1 1 A 79 79 CYS CA C 79 58.600 57.789 0.811 1
1 895 . 10 1 1 A 79 79 CYS CB C 79 27.200 27.635 -0.435 1
1 896 . 10 1 1 A 79 79 CYS N N 79 117.000 115.292 1.708 1
1 897 . 10 1 1 A 80 80 ILE H H 80 6.960 7.216 -0.256 1
1 898 . 10 1 1 A 80 80 ILE HA H 80 4.120 3.957 0.163 1
1 908 . 10 1 1 A 80 80 ILE CA C 80 58.700 58.970 -0.270 1
1 909 . 10 1 1 A 80 80 ILE CB C 80 38.500 37.508 0.992 1
1 913 . 10 1 1 A 80 80 ILE N N 80 123.200 122.836 0.364 1
1 914 . 10 1 1 A 81 81 PRO HA H 81 4.340 4.265 0.075 1
1 921 . 10 1 1 A 81 81 PRO C C 81 178.000 176.500 1.500 1
1 922 . 10 1 1 A 81 81 PRO CA C 81 64.700 65.675 -0.975 1
1 923 . 10 1 1 A 81 81 PRO CB C 81 32.600 31.736 0.864 1
1 926 . 10 1 1 A 82 82 GLN H H 82 7.560 8.041 -0.481 1
1 927 . 10 1 1 A 82 82 GLN HA H 82 4.600 4.456 0.144 1
1 934 . 10 1 1 A 82 82 GLN C C 82 177.400 176.544 0.856 1
1 935 . 10 1 1 A 82 82 GLN CA C 82 55.600 55.959 -0.359 1
1 936 . 10 1 1 A 82 82 GLN CB C 82 28.800 29.344 -0.544 1
1 938 . 10 1 1 A 82 82 GLN N N 82 115.900 117.116 -1.216 1
1 940 . 10 1 1 A 83 83 THR H H 83 8.880 8.516 0.364 1
1 941 . 10 1 1 A 83 83 THR HA H 83 3.750 3.930 -0.180 1
1 946 . 10 1 1 A 83 83 THR C C 83 176.300 176.413 -0.113 1
1 947 . 10 1 1 A 83 83 THR CA C 83 66.500 66.374 0.126 1
1 948 . 10 1 1 A 83 83 THR CB C 83 68.700 68.805 -0.105 1
1 950 . 10 1 1 A 83 83 THR N N 83 122.700 119.585 3.115 1
1 951 . 10 1 1 A 84 84 ARG H H 84 8.990 8.233 0.757 1
1 952 . 10 1 1 A 84 84 ARG HA H 84 4.250 4.031 0.219 1
1 960 . 10 1 1 A 84 84 ARG C C 84 178.900 178.939 -0.039 1
1 961 . 10 1 1 A 84 84 ARG CA C 84 59.100 59.713 -0.613 1
1 962 . 10 1 1 A 84 84 ARG CB C 84 29.300 30.146 -0.846 1
1 965 . 10 1 1 A 84 84 ARG N N 84 120.100 121.505 -1.405 1
1 967 . 10 1 1 A 85 85 ASN H H 85 7.270 8.299 -1.029 1
1 968 . 10 1 1 A 85 85 ASN HA H 85 4.810 4.633 0.177 1
1 973 . 10 1 1 A 85 85 ASN C C 85 176.800 177.672 -0.872 1
1 974 . 10 1 1 A 85 85 ASN CA C 85 54.800 56.296 -1.496 1
1 975 . 10 1 1 A 85 85 ASN CB C 85 37.600 38.209 -0.609 1
1 976 . 10 1 1 A 85 85 ASN N N 85 117.400 118.211 -0.811 1
1 978 . 10 1 1 A 86 86 LYS H H 86 8.340 8.189 0.151 1
1 979 . 10 1 1 A 86 86 LYS HA H 86 3.890 4.036 -0.146 1
1 988 . 10 1 1 A 86 86 LYS C C 86 178.600 178.925 -0.325 1
1 989 . 10 1 1 A 86 86 LYS CA C 86 60.800 59.213 1.587 1
1 990 . 10 1 1 A 86 86 LYS CB C 86 32.700 32.150 0.550 1
1 994 . 10 1 1 A 86 86 LYS N N 86 124.200 120.677 3.523 1
1 995 . 10 1 1 A 87 87 PHE H H 87 8.120 8.679 -0.559 1
1 996 . 10 1 1 A 87 87 PHE HA H 87 4.260 4.196 0.064 1
1 1004 . 10 1 1 A 87 87 PHE C C 87 178.100 177.520 0.580 1
1 1005 . 10 1 1 A 87 87 PHE CA C 87 61.300 61.590 -0.290 1
1 1006 . 10 1 1 A 87 87 PHE CB C 87 38.200 39.003 -0.803 1
1 1010 . 10 1 1 A 87 87 PHE N N 87 118.300 121.004 -2.704 1
1 1011 . 10 1 1 A 88 88 ALA H H 88 7.860 8.168 -0.308 1
1 1012 . 10 1 1 A 88 88 ALA HA H 88 4.200 4.146 0.054 1
1 1016 . 10 1 1 A 88 88 ALA C C 88 180.600 179.868 0.732 1
1 1017 . 10 1 1 A 88 88 ALA CA C 88 54.900 55.016 -0.116 1
1 1018 . 10 1 1 A 88 88 ALA CB C 88 18.100 18.173 -0.073 1
1 1019 . 10 1 1 A 88 88 ALA N N 88 121.700 120.947 0.753 1
1 1020 . 10 1 1 A 89 89 PHE H H 89 8.690 8.572 0.118 1
1 1021 . 10 1 1 A 89 89 PHE HA H 89 4.080 4.122 -0.042 1
1 1029 . 10 1 1 A 89 89 PHE C C 89 176.300 177.795 -1.495 1
1 1030 . 10 1 1 A 89 89 PHE CA C 89 62.000 61.422 0.578 1
1 1031 . 10 1 1 A 89 89 PHE CB C 89 39.800 39.211 0.589 1
1 1035 . 10 1 1 A 89 89 PHE N N 89 120.100 119.889 0.211 1
1 1036 . 10 1 1 A 90 90 ARG H H 90 8.560 8.136 0.424 1
1 1037 . 10 1 1 A 90 90 ARG HA H 90 3.790 3.884 -0.094 1
1 1045 . 10 1 1 A 90 90 ARG C C 90 179.600 178.605 0.995 1
1 1046 . 10 1 1 A 90 90 ARG CA C 90 60.000 59.665 0.335 1
1 1047 . 10 1 1 A 90 90 ARG CB C 90 30.000 30.063 -0.063 1
1 1050 . 10 1 1 A 90 90 ARG N N 90 118.000 118.386 -0.386 1
1 1052 . 10 1 1 A 91 91 GLU H H 91 8.120 8.130 -0.010 1
1 1053 . 10 1 1 A 91 91 GLU HA H 91 3.980 3.963 0.017 1
1 1058 . 10 1 1 A 91 91 GLU C C 91 178.400 178.807 -0.407 1
1 1059 . 10 1 1 A 91 91 GLU CA C 91 58.900 59.356 -0.456 1
1 1060 . 10 1 1 A 91 91 GLU CB C 91 28.800 28.863 -0.063 1
1 1062 . 10 1 1 A 91 91 GLU N N 91 119.300 118.505 0.795 1
1 1063 . 10 1 1 A 92 92 ALA H H 92 7.820 7.797 0.023 1
1 1064 . 10 1 1 A 92 92 ALA HA H 92 4.050 3.989 0.061 1
1 1068 . 10 1 1 A 92 92 ALA C C 92 179.800 179.666 0.134 1
1 1069 . 10 1 1 A 92 92 ALA CA C 92 55.000 55.064 -0.064 1
1 1070 . 10 1 1 A 92 92 ALA CB C 92 18.000 18.432 -0.432 1
1 1071 . 10 1 1 A 92 92 ALA N N 92 123.400 122.392 1.008 1
1 1072 . 10 1 1 A 93 93 VAL H H 93 8.430 8.125 0.305 1
1 1073 . 10 1 1 A 93 93 VAL HA H 93 3.250 3.309 -0.059 1
1 1081 . 10 1 1 A 93 93 VAL C C 93 177.900 177.857 0.043 1
1 1082 . 10 1 1 A 93 93 VAL CA C 93 66.800 66.695 0.105 1
1 1083 . 10 1 1 A 93 93 VAL CB C 93 31.300 31.074 0.226 1
1 1086 . 10 1 1 A 93 93 VAL N N 93 119.900 118.246 1.654 1
1 1087 . 10 1 1 A 94 94 SER H H 94 7.990 7.801 0.189 1
1 1088 . 10 1 1 A 94 94 SER HA H 94 4.230 4.137 0.093 1
1 1091 . 10 1 1 A 94 94 SER C C 94 177.200 177.466 -0.266 1
1 1092 . 10 1 1 A 94 94 SER CA C 94 61.600 61.379 0.221 1
1 1093 . 10 1 1 A 94 94 SER CB C 94 62.700 62.871 -0.171 1
1 1094 . 10 1 1 A 94 94 SER N N 94 116.000 115.680 0.320 1
1 1095 . 10 1 1 A 95 95 LYS H H 95 7.710 7.633 0.077 1
1 1096 . 10 1 1 A 95 95 LYS HA H 95 4.020 4.046 -0.026 1
1 1105 . 10 1 1 A 95 95 LYS C C 95 179.400 179.189 0.211 1
1 1106 . 10 1 1 A 95 95 LYS CA C 95 59.600 59.351 0.249 1
1 1107 . 10 1 1 A 95 95 LYS CB C 95 32.300 32.378 -0.078 1
1 1111 . 10 1 1 A 95 95 LYS N N 95 121.400 122.221 -0.821 1
1 1112 . 10 1 1 A 96 96 LEU H H 96 8.270 8.117 0.153 1
1 1113 . 10 1 1 A 96 96 LEU HA H 96 4.040 3.916 0.124 1
1 1123 . 10 1 1 A 96 96 LEU C C 96 177.700 178.242 -0.542 1
1 1124 . 10 1 1 A 96 96 LEU CA C 96 58.600 58.248 0.352 1
1 1125 . 10 1 1 A 96 96 LEU CB C 96 41.000 41.767 -0.767 1
1 1129 . 10 1 1 A 96 96 LEU N N 96 124.800 120.868 3.932 1
1 1130 . 10 1 1 A 97 97 GLU H H 97 8.500 8.337 0.163 1
1 1131 . 10 1 1 A 97 97 GLU HA H 97 3.760 4.042 -0.282 1
1 1136 . 10 1 1 A 97 97 GLU C C 97 179.100 179.003 0.097 1
1 1137 . 10 1 1 A 97 97 GLU CA C 97 59.900 59.137 0.763 1
1 1138 . 10 1 1 A 97 97 GLU CB C 97 28.700 28.741 -0.041 1
1 1140 . 10 1 1 A 97 97 GLU N N 97 119.000 117.427 1.573 1
1 1141 . 10 1 1 A 98 98 LEU H H 98 7.740 8.070 -0.330 1
1 1142 . 10 1 1 A 98 98 LEU HA H 98 4.110 4.068 0.042 1
1 1152 . 10 1 1 A 98 98 LEU C C 98 179.700 178.677 1.023 1
1 1153 . 10 1 1 A 98 98 LEU CA C 98 57.900 58.054 -0.154 1
1 1154 . 10 1 1 A 98 98 LEU CB C 98 41.800 41.389 0.411 1
1 1158 . 10 1 1 A 98 98 LEU N N 98 119.200 122.866 -3.666 1
1 1159 . 10 1 1 A 99 99 SER H H 99 8.290 8.189 0.101 1
1 1160 . 10 1 1 A 99 99 SER HA H 99 4.220 4.112 0.108 1
1 1163 . 10 1 1 A 99 99 SER C C 99 176.600 176.564 0.036 1
1 1164 . 10 1 1 A 99 99 SER CA C 99 62.400 62.392 0.008 1
1 1165 . 10 1 1 A 99 99 SER CB C 99 63.200 62.723 0.477 1
1 1166 . 10 1 1 A 99 99 SER N N 99 116.300 116.566 -0.266 1
1 1167 . 10 1 1 A 100 100 LEU H H 100 8.490 8.265 0.225 1
1 1168 . 10 1 1 A 100 100 LEU HA H 100 3.960 3.951 0.009 1
1 1178 . 10 1 1 A 100 100 LEU C C 100 179.300 179.747 -0.447 1
1 1179 . 10 1 1 A 100 100 LEU CA C 100 57.700 57.951 -0.251 1
1 1180 . 10 1 1 A 100 100 LEU CB C 100 41.300 41.145 0.155 1
1 1184 . 10 1 1 A 100 100 LEU N N 100 120.900 122.167 -1.267 1
1 1185 . 10 1 1 A 101 101 GLN H H 101 7.680 8.536 -0.856 1
1 1186 . 10 1 1 A 101 101 GLN HA H 101 4.100 4.016 0.084 1
1 1193 . 10 1 1 A 101 101 GLN C C 101 178.700 177.755 0.945 1
1 1194 . 10 1 1 A 101 101 GLN CA C 101 58.800 58.850 -0.050 1
1 1195 . 10 1 1 A 101 101 GLN CB C 101 27.900 27.818 0.082 1
1 1197 . 10 1 1 A 101 101 GLN N N 101 119.100 118.144 0.956 1
1 1199 . 10 1 1 A 102 102 GLU H H 102 7.850 8.113 -0.263 1
1 1200 . 10 1 1 A 102 102 GLU HA H 102 4.050 4.124 -0.074 1
1 1205 . 10 1 1 A 102 102 GLU C C 102 179.100 178.884 0.216 1
1 1206 . 10 1 1 A 102 102 GLU CA C 102 58.400 59.290 -0.890 1
1 1207 . 10 1 1 A 102 102 GLU CB C 102 28.600 29.037 -0.437 1
1 1209 . 10 1 1 A 102 102 GLU N N 102 118.400 118.876 -0.476 1
1 1210 . 10 1 1 A 103 103 LEU H H 103 8.080 8.071 0.009 1
1 1211 . 10 1 1 A 103 103 LEU HA H 103 4.020 4.015 0.005 1
1 1221 . 10 1 1 A 103 103 LEU C C 103 178.200 178.330 -0.130 1
1 1222 . 10 1 1 A 103 103 LEU CA C 103 57.000 58.006 -1.006 1
1 1223 . 10 1 1 A 103 103 LEU CB C 103 41.900 41.843 0.057 1
1 1227 . 10 1 1 A 103 103 LEU N N 103 120.600 123.268 -2.668 1
1 1228 . 10 1 1 A 104 104 GLN H H 104 7.900 8.554 -0.654 1
1 1229 . 10 1 1 A 104 104 GLN HA H 104 4.090 4.110 -0.020 1
1 1236 . 10 1 1 A 104 104 GLN C C 104 177.300 177.053 0.247 1
1 1237 . 10 1 1 A 104 104 GLN CA C 104 58.100 57.811 0.289 1
1 1238 . 10 1 1 A 104 104 GLN CB C 104 29.400 27.267 2.133 1
1 1240 . 10 1 1 A 104 104 GLN N N 104 117.700 116.549 1.151 1
1 1242 . 10 1 1 A 105 105 VAL H H 105 7.620 7.305 0.315 1
1 1243 . 10 1 1 A 105 105 VAL HA H 105 4.190 4.175 0.015 1
1 1251 . 10 1 1 A 105 105 VAL C C 105 176.800 177.222 -0.422 1
1 1252 . 10 1 1 A 105 105 VAL CA C 105 62.600 63.249 -0.649 1
1 1253 . 10 1 1 A 105 105 VAL CB C 105 32.000 32.686 -0.686 1
1 1256 . 10 1 1 A 105 105 VAL N N 105 114.900 116.135 -1.235 1
1 1257 . 10 1 1 A 106 106 SER H H 106 7.900 7.978 -0.078 1
1 1258 . 10 1 1 A 106 106 SER HA H 106 4.460 4.890 -0.430 1
1 1261 . 10 1 1 A 106 106 SER C C 106 175.000 174.825 0.175 1
1 1262 . 10 1 1 A 106 106 SER CA C 106 58.900 57.889 1.011 1
1 1263 . 10 1 1 A 106 106 SER CB C 106 63.900 63.653 0.247 1
1 1264 . 10 1 1 A 106 106 SER N N 106 116.900 117.852 -0.952 1
1 1265 . 10 1 1 A 107 107 SER H H 107 8.230 7.699 0.531 1
1 1266 . 10 1 1 A 107 107 SER HA H 107 4.390 4.057 0.333 1
1 1269 . 10 1 1 A 107 107 SER C C 107 174.600 174.347 0.253 1
1 1270 . 10 1 1 A 107 107 SER CA C 107 58.400 61.707 -3.307 1
1 1271 . 10 1 1 A 107 107 SER CB C 107 63.600 63.086 0.514 1
1 1272 . 10 1 1 A 107 107 SER N N 107 117.500 118.285 -0.785 1
1 1273 . 10 1 1 A 108 108 ALA H H 108 8.080 7.913 0.167 1
1 1274 . 10 1 1 A 108 108 ALA HA H 108 4.280 3.972 0.308 1
1 1278 . 10 1 1 A 108 108 ALA C C 108 177.500 175.846 1.654 1
1 1279 . 10 1 1 A 108 108 ALA CA C 108 52.700 53.428 -0.728 1
1 1280 . 10 1 1 A 108 108 ALA CB C 108 19.200 17.983 1.217 1
1 1281 . 10 1 1 A 108 108 ALA N N 108 124.900 121.808 3.092 1
1 1282 . 10 1 1 A 109 109 ALA H H 109 8.080 7.378 0.702 1
1 1283 . 10 1 1 A 109 109 ALA HA H 109 4.280 4.701 -0.421 1
1 1287 . 10 1 1 A 109 109 ALA C C 109 177.700 177.536 0.164 1
1 1288 . 10 1 1 A 109 109 ALA CA C 109 52.400 50.578 1.822 1
1 1289 . 10 1 1 A 109 109 ALA CB C 109 19.400 21.202 -1.802 1
1 1290 . 10 1 1 A 109 109 ALA N N 109 123.000 119.481 3.519 1
1 1291 . 10 1 1 A 110 110 ALA H H 110 8.300 8.395 -0.095 1
1 1292 . 10 1 1 A 110 110 ALA HA H 110 4.280 4.522 -0.242 1
1 1296 . 10 1 1 A 110 110 ALA C C 110 178.200 177.248 0.952 1
1 1297 . 10 1 1 A 110 110 ALA CA C 110 52.700 51.548 1.152 1
1 1298 . 10 1 1 A 110 110 ALA CB C 110 19.200 18.188 1.012 1
1 1299 . 10 1 1 A 110 110 ALA N N 110 123.200 125.670 -2.470 1
1 1300 . 10 1 1 A 111 111 GLY H H 111 8.300 7.916 0.384 1
1 1301 . 10 1 1 A 111 111 GLY HA2 H 111 3.930 3.969 -0.039 1
1 1302 . 10 1 1 A 111 111 GLY HA3 H 111 3.940 3.972 -0.032 1
1 1303 . 10 1 1 A 111 111 GLY C C 111 173.700 174.448 -0.748 1
1 1304 . 10 1 1 A 111 111 GLY CA C 111 45.100 46.410 -1.310 1
1 1305 . 10 1 1 A 111 111 GLY N N 111 108.000 106.596 1.404 1
1 1306 . 10 1 1 A 112 112 VAL H H 112 7.930 7.802 0.128 1
1 1307 . 10 1 1 A 112 112 VAL HA H 112 4.420 4.349 0.071 1
1 1315 . 10 1 1 A 112 112 VAL CA C 112 60.000 58.928 1.072 1
1 1316 . 10 1 1 A 112 112 VAL CB C 112 32.200 33.817 -1.617 1
1 1319 . 10 1 1 A 112 112 VAL N N 112 120.400 120.420 -0.020 1
1 1320 . 10 1 1 A 113 113 PRO HA H 113 4.370 4.286 0.084 1
1 1327 . 10 1 1 A 113 113 PRO C C 113 177.300 178.041 -0.741 1
1 1328 . 10 1 1 A 113 113 PRO CA C 113 63.900 63.756 0.144 1
1 1329 . 10 1 1 A 113 113 PRO CB C 113 31.800 31.237 0.563 1
1 1332 . 10 1 1 A 114 114 GLY H H 114 8.570 8.886 -0.316 1
1 1333 . 10 1 1 A 114 114 GLY HA2 H 114 3.880 3.943 -0.063 1
1 1334 . 10 1 1 A 114 114 GLY HA3 H 114 4.120 3.945 0.175 1
1 1335 . 10 1 1 A 114 114 GLY C C 114 174.900 175.115 -0.215 1
1 1336 . 10 1 1 A 114 114 GLY CA C 114 45.200 46.087 -0.887 1
1 1337 . 10 1 1 A 114 114 GLY N N 114 109.000 112.857 -3.857 1
1 1338 . 10 1 1 A 115 115 THR H H 115 7.900 7.775 0.125 1
1 1339 . 10 1 1 A 115 115 THR HA H 115 4.400 4.001 0.399 1
1 1344 . 10 1 1 A 115 115 THR C C 115 174.300 174.178 0.122 1
1 1345 . 10 1 1 A 115 115 THR CA C 115 61.700 64.879 -3.179 1
1 1346 . 10 1 1 A 115 115 THR CB C 115 69.700 69.688 0.012 1
1 1348 . 10 1 1 A 115 115 THR N N 115 111.400 115.676 -4.276 1
1 1349 . 10 1 1 A 116 116 ASN H H 116 8.450 7.983 0.467 1
1 1350 . 10 1 1 A 116 116 ASN HA H 116 4.970 4.914 0.056 1
1 1355 . 10 1 1 A 116 116 ASN CA C 116 51.500 51.023 0.477 1
1 1356 . 10 1 1 A 116 116 ASN CB C 116 38.900 38.993 -0.093 1
1 1357 . 10 1 1 A 116 116 ASN N N 116 123.100 115.969 7.131 1
1 1359 . 10 1 1 A 117 117 PRO HA H 117 4.370 4.416 -0.046 1
1 1366 . 10 1 1 A 117 117 PRO C C 117 178.400 178.423 -0.023 1
1 1367 . 10 1 1 A 117 117 PRO CA C 117 64.800 64.435 0.365 1
1 1368 . 10 1 1 A 117 117 PRO CB C 117 32.100 31.861 0.239 1
1 1371 . 10 1 1 A 118 118 VAL H H 118 7.750 7.281 0.469 1
1 1372 . 10 1 1 A 118 118 VAL HA H 118 3.810 3.741 0.069 1
1 1380 . 10 1 1 A 118 118 VAL C C 118 178.300 178.036 0.264 1
1 1381 . 10 1 1 A 118 118 VAL CA C 118 65.200 65.163 0.037 1
1 1382 . 10 1 1 A 118 118 VAL CB C 118 31.500 31.245 0.255 1
1 1385 . 10 1 1 A 118 118 VAL N N 118 118.300 116.578 1.722 1
1 1386 . 10 1 1 A 119 119 LEU H H 119 7.540 8.096 -0.556 1
1 1387 . 10 1 1 A 119 119 LEU HA H 119 4.030 3.935 0.095 1
1 1397 . 10 1 1 A 119 119 LEU C C 119 178.900 179.858 -0.958 1
1 1398 . 10 1 1 A 119 119 LEU CA C 119 57.800 58.133 -0.333 1
1 1399 . 10 1 1 A 119 119 LEU CB C 119 40.700 40.740 -0.040 1
1 1403 . 10 1 1 A 119 119 LEU N N 119 119.700 120.361 -0.661 1
1 1404 . 10 1 1 A 120 120 ASN H H 120 8.080 8.140 -0.060 1
1 1405 . 10 1 1 A 120 120 ASN HA H 120 4.420 4.440 -0.020 1
1 1410 . 10 1 1 A 120 120 ASN C C 120 178.100 178.377 -0.277 1
1 1411 . 10 1 1 A 120 120 ASN CA C 120 56.100 56.371 -0.271 1
1 1412 . 10 1 1 A 120 120 ASN CB C 120 37.800 38.030 -0.230 1
1 1413 . 10 1 1 A 120 120 ASN N N 120 117.700 118.842 -1.142 1
1 1415 . 10 1 1 A 121 121 ASN H H 121 8.120 8.259 -0.139 1
1 1416 . 10 1 1 A 121 121 ASN HA H 121 4.490 4.435 0.055 1
1 1421 . 10 1 1 A 121 121 ASN C C 121 178.000 178.313 -0.313 1
1 1422 . 10 1 1 A 121 121 ASN CA C 121 56.100 56.385 -0.285 1
1 1423 . 10 1 1 A 121 121 ASN CB C 121 37.800 38.298 -0.498 1
1 1424 . 10 1 1 A 121 121 ASN N N 121 120.000 117.307 2.693 1
1 1426 . 10 1 1 A 122 122 LEU H H 122 8.180 8.322 -0.142 1
1 1427 . 10 1 1 A 122 122 LEU HA H 122 4.050 3.928 0.122 1
1 1437 . 10 1 1 A 122 122 LEU C C 122 173.800 178.882 -5.082 1
1 1438 . 10 1 1 A 122 122 LEU CA C 122 58.500 58.032 0.468 1
1 1439 . 10 1 1 A 122 122 LEU CB C 122 41.900 41.502 0.398 1
1 1443 . 10 1 1 A 122 122 LEU N N 122 122.600 120.548 2.052 1
1 1444 . 10 1 1 A 123 123 LEU H H 123 8.260 8.102 0.158 1
1 1445 . 10 1 1 A 123 123 LEU HA H 123 3.850 3.962 -0.112 1
1 1455 . 10 1 1 A 123 123 LEU C C 123 178.900 178.504 0.396 1
1 1456 . 10 1 1 A 123 123 LEU CA C 123 58.500 58.118 0.382 1
1 1457 . 10 1 1 A 123 123 LEU CB C 123 41.200 41.320 -0.120 1
1 1461 . 10 1 1 A 123 123 LEU N N 123 119.700 120.874 -1.174 1
1 1462 . 10 1 1 A 124 124 SER H H 124 7.950 8.296 -0.346 1
1 1463 . 10 1 1 A 124 124 SER HA H 124 4.240 4.068 0.172 1
1 1466 . 10 1 1 A 124 124 SER C C 124 177.500 177.184 0.316 1
1 1467 . 10 1 1 A 124 124 SER CA C 124 61.600 61.778 -0.178 1
1 1468 . 10 1 1 A 124 124 SER CB C 124 62.600 62.795 -0.195 1
1 1469 . 10 1 1 A 124 124 SER N N 124 113.400 114.006 -0.606 1
1 1470 . 10 1 1 A 125 125 CYS H H 125 8.040 8.286 -0.246 1
1 1471 . 10 1 1 A 125 125 CYS HA H 125 4.350 4.118 0.232 1
1 1474 . 10 1 1 A 125 125 CYS C C 125 176.800 177.004 -0.204 1
1 1475 . 10 1 1 A 125 125 CYS CA C 125 62.600 63.908 -1.308 1
1 1476 . 10 1 1 A 125 125 CYS CB C 125 27.100 26.795 0.305 1
1 1477 . 10 1 1 A 125 125 CYS N N 125 119.800 119.623 0.177 1
1 1478 . 10 1 1 A 126 126 VAL H H 126 8.290 8.580 -0.290 1
1 1479 . 10 1 1 A 126 126 VAL HA H 126 3.430 3.465 -0.035 1
1 1487 . 10 1 1 A 126 126 VAL C C 126 177.800 177.856 -0.056 1
1 1488 . 10 1 1 A 126 126 VAL CA C 126 67.100 66.753 0.347 1
1 1489 . 10 1 1 A 126 126 VAL CB C 126 31.400 31.577 -0.177 1
1 1492 . 10 1 1 A 126 126 VAL N N 126 121.900 120.585 1.315 1
1 1493 . 10 1 1 A 127 127 GLN H H 127 8.200 8.221 -0.021 1
1 1494 . 10 1 1 A 127 127 GLN HA H 127 3.970 4.057 -0.087 1
1 1501 . 10 1 1 A 127 127 GLN C C 127 178.200 178.434 -0.234 1
1 1502 . 10 1 1 A 127 127 GLN CA C 127 58.700 58.774 -0.074 1
1 1503 . 10 1 1 A 127 127 GLN CB C 127 27.800 28.346 -0.546 1
1 1505 . 10 1 1 A 127 127 GLN N N 127 119.700 117.898 1.802 1
1 1507 . 10 1 1 A 128 128 GLU H H 128 7.880 8.117 -0.237 1
1 1508 . 10 1 1 A 128 128 GLU HA H 128 4.200 4.030 0.170 1
1 1513 . 10 1 1 A 128 128 GLU C C 128 178.400 178.803 -0.403 1
1 1514 . 10 1 1 A 128 128 GLU CA C 128 59.000 59.109 -0.109 1
1 1515 . 10 1 1 A 128 128 GLU CB C 128 28.400 29.394 -0.994 1
1 1517 . 10 1 1 A 128 128 GLU N N 128 119.800 119.416 0.384 1
1 1518 . 10 1 1 A 129 129 ILE H H 129 8.000 8.264 -0.264 1
1 1519 . 10 1 1 A 129 129 ILE HA H 129 3.460 3.559 -0.099 1
1 1529 . 10 1 1 A 129 129 ILE C C 129 176.800 177.972 -1.172 1
1 1530 . 10 1 1 A 129 129 ILE CA C 129 66.100 65.433 0.667 1
1 1531 . 10 1 1 A 129 129 ILE CB C 129 38.200 37.381 0.819 1
1 1535 . 10 1 1 A 129 129 ILE N N 129 119.500 120.240 -0.740 1
1 1536 . 10 1 1 A 130 130 SER H H 130 8.040 8.337 -0.297 1
1 1537 . 10 1 1 A 130 130 SER HA H 130 3.780 4.196 -0.416 1
1 1540 . 10 1 1 A 130 130 SER C C 130 176.200 176.306 -0.106 1
1 1541 . 10 1 1 A 130 130 SER CA C 130 62.100 61.472 0.628 1
1 1542 . 10 1 1 A 130 130 SER CB C 130 62.600 62.334 0.266 1
1 1543 . 10 1 1 A 130 130 SER N N 130 112.800 114.882 -2.082 1
1 1544 . 10 1 1 A 131 131 ASP H H 131 8.270 8.176 0.094 1
1 1545 . 10 1 1 A 131 131 ASP HA H 131 4.310 4.413 -0.103 1
1 1548 . 10 1 1 A 131 131 ASP C C 131 179.200 178.634 0.566 1
1 1549 . 10 1 1 A 131 131 ASP CA C 131 56.800 57.734 -0.934 1
1 1550 . 10 1 1 A 131 131 ASP CB C 131 40.900 41.680 -0.780 1
1 1551 . 10 1 1 A 131 131 ASP N N 131 119.600 121.879 -2.279 1
1 1552 . 10 1 1 A 132 132 VAL H H 132 8.470 8.161 0.309 1
1 1553 . 10 1 1 A 132 132 VAL HA H 132 3.520 3.762 -0.242 1
1 1561 . 10 1 1 A 132 132 VAL C C 132 178.700 178.684 0.016 1
1 1562 . 10 1 1 A 132 132 VAL CA C 132 66.500 65.980 0.520 1
1 1563 . 10 1 1 A 132 132 VAL CB C 132 31.500 31.813 -0.313 1
1 1566 . 10 1 1 A 132 132 VAL N N 132 118.100 119.195 -1.095 1
1 1567 . 10 1 1 A 133 133 VAL H H 133 8.140 7.977 0.163 1
1 1568 . 10 1 1 A 133 133 VAL HA H 133 3.770 3.707 0.063 1
1 1576 . 10 1 1 A 133 133 VAL C C 133 176.500 178.694 -2.194 1
1 1577 . 10 1 1 A 133 133 VAL CA C 133 65.100 66.821 -1.721 1
1 1578 . 10 1 1 A 133 133 VAL CB C 133 31.600 31.540 0.060 1
1 1581 . 10 1 1 A 133 133 VAL N N 133 117.000 121.217 -4.217 1
1 1582 . 10 1 1 A 134 134 GLN H H 134 7.490 8.215 -0.725 1
1 1583 . 10 1 1 A 134 134 GLN HA H 134 4.350 4.095 0.255 1
1 1590 . 10 1 1 A 134 134 GLN C C 134 175.400 178.735 -3.335 1
1 1591 . 10 1 1 A 134 134 GLN CA C 134 56.700 58.789 -2.089 1
1 1592 . 10 1 1 A 134 134 GLN CB C 134 30.500 28.072 2.428 1
1 1594 . 10 1 1 A 134 134 GLN N N 134 116.300 118.806 -2.506 1
1 1 . 11 1 1 A 2 2 GLY HA2 H 2 3.890 3.767 0.123 1
1 2 . 11 1 1 A 2 2 GLY HA3 H 2 3.890 3.853 0.037 1
1 3 . 11 1 1 A 2 2 GLY C C 2 174.200 175.172 -0.972 1
1 4 . 11 1 1 A 2 2 GLY CA C 2 44.700 45.805 -1.105 1
1 5 . 11 1 1 A 3 3 HIS H H 3 8.380 8.160 0.220 1
1 6 . 11 1 1 A 3 3 HIS HA H 3 4.610 4.163 0.447 1
1 9 . 11 1 1 A 3 3 HIS C C 3 174.500 174.529 -0.029 1
1 10 . 11 1 1 A 3 3 HIS CA C 3 55.200 56.797 -1.597 1
1 11 . 11 1 1 A 3 3 HIS CB C 3 28.800 28.958 -0.158 1
1 12 . 11 1 1 A 3 3 HIS N N 3 117.600 119.960 -2.360 1
1 13 . 11 1 1 A 4 4 HIS H H 4 8.520 7.523 0.997 1
1 14 . 11 1 1 A 4 4 HIS HA H 4 4.640 4.362 0.278 1
1 17 . 11 1 1 A 4 4 HIS C C 4 174.200 176.176 -1.976 1
1 18 . 11 1 1 A 4 4 HIS CA C 4 55.100 57.143 -2.043 1
1 19 . 11 1 1 A 4 4 HIS CB C 4 28.900 29.895 -0.995 1
1 20 . 11 1 1 A 4 4 HIS N N 4 119.000 118.858 0.142 1
1 21 . 11 1 1 A 5 5 HIS H H 5 8.530 9.070 -0.540 1
1 22 . 11 1 1 A 5 5 HIS HA H 5 4.410 4.116 0.294 1
1 25 . 11 1 1 A 5 5 HIS CA C 5 54.900 59.387 -4.487 1
1 26 . 11 1 1 A 5 5 HIS CB C 5 27.300 30.315 -3.015 1
1 27 . 11 1 1 A 5 5 HIS N N 5 121.600 121.632 -0.032 1
1 28 . 11 1 1 A 6 6 HIS HA H 6 4.640 4.649 -0.009 1
1 31 . 11 1 1 A 6 6 HIS C C 6 174.100 174.867 -0.767 1
1 32 . 11 1 1 A 6 6 HIS CA C 6 55.100 55.810 -0.710 1
1 33 . 11 1 1 A 6 6 HIS CB C 6 29.100 29.438 -0.338 1
1 34 . 11 1 1 A 7 7 HIS H H 7 8.690 8.731 -0.041 1
1 35 . 11 1 1 A 7 7 HIS HA H 7 4.650 4.508 0.142 1
1 38 . 11 1 1 A 7 7 HIS C C 7 174.200 174.592 -0.392 1
1 39 . 11 1 1 A 7 7 HIS CA C 7 55.200 57.000 -1.800 1
1 40 . 11 1 1 A 7 7 HIS CB C 7 29.300 30.735 -1.435 1
1 41 . 11 1 1 A 7 7 HIS N N 7 121.400 123.218 -1.818 1
1 42 . 11 1 1 A 8 8 HIS H H 8 8.660 7.707 0.953 1
1 43 . 11 1 1 A 8 8 HIS HA H 8 4.700 4.832 -0.132 1
1 46 . 11 1 1 A 8 8 HIS C C 8 174.200 174.413 -0.213 1
1 47 . 11 1 1 A 8 8 HIS CA C 8 55.000 54.849 0.151 1
1 48 . 11 1 1 A 8 8 HIS CB C 8 29.300 29.958 -0.658 1
1 49 . 11 1 1 A 8 8 HIS N N 8 120.400 117.207 3.193 1
1 50 . 11 1 1 A 9 9 SER H H 9 8.490 8.838 -0.348 1
1 51 . 11 1 1 A 9 9 SER HA H 9 4.390 5.017 -0.627 1
1 54 . 11 1 1 A 9 9 SER C C 9 174.100 173.584 0.516 1
1 55 . 11 1 1 A 9 9 SER CA C 9 58.300 57.358 0.942 1
1 56 . 11 1 1 A 9 9 SER CB C 9 63.700 64.441 -0.741 1
1 57 . 11 1 1 A 9 9 SER N N 9 118.100 120.158 -2.058 1
1 58 . 11 1 1 A 10 10 HIS H H 10 8.710 8.788 -0.078 1
1 59 . 11 1 1 A 10 10 HIS HA H 10 4.690 5.141 -0.451 1
1 63 . 11 1 1 A 10 10 HIS C C 10 174.200 173.910 0.290 1
1 64 . 11 1 1 A 10 10 HIS CA C 10 55.200 55.327 -0.127 1
1 65 . 11 1 1 A 10 10 HIS CB C 10 28.800 33.025 -4.225 1
1 66 . 11 1 1 A 10 10 HIS N N 10 120.700 124.886 -4.186 1
1 67 . 11 1 1 A 11 11 MET H H 11 8.410 8.694 -0.284 1
1 68 . 11 1 1 A 11 11 MET HA H 11 4.420 4.385 0.035 1
1 76 . 11 1 1 A 11 11 MET C C 11 175.800 176.432 -0.632 1
1 77 . 11 1 1 A 11 11 MET CA C 11 55.100 54.899 0.201 1
1 78 . 11 1 1 A 11 11 MET CB C 11 32.800 33.071 -0.271 1
1 81 . 11 1 1 A 11 11 MET N N 11 122.300 125.414 -3.114 1
1 82 . 11 1 1 A 12 12 ALA H H 12 8.440 8.665 -0.225 1
1 83 . 11 1 1 A 12 12 ALA HA H 12 4.280 5.201 -0.921 1
1 87 . 11 1 1 A 12 12 ALA C C 12 177.400 175.983 1.417 1
1 88 . 11 1 1 A 12 12 ALA CA C 12 52.400 50.429 1.971 1
1 89 . 11 1 1 A 12 12 ALA CB C 12 18.800 22.523 -3.723 1
1 90 . 11 1 1 A 12 12 ALA N N 12 125.900 124.611 1.289 1
1 91 . 11 1 1 A 13 13 ASN H H 13 8.440 8.605 -0.165 1
1 92 . 11 1 1 A 13 13 ASN HA H 13 4.660 5.323 -0.663 1
1 97 . 11 1 1 A 13 13 ASN C C 13 175.900 174.679 1.221 1
1 98 . 11 1 1 A 13 13 ASN CA C 13 53.200 51.532 1.668 1
1 99 . 11 1 1 A 13 13 ASN CB C 13 38.800 42.020 -3.220 1
1 100 . 11 1 1 A 13 13 ASN N N 13 118.300 114.837 3.463 1
1 102 . 11 1 1 A 14 14 GLY H H 14 8.370 8.816 -0.446 1
1 103 . 11 1 1 A 14 14 GLY HA2 H 14 3.920 3.935 -0.015 1
1 104 . 11 1 1 A 14 14 GLY HA3 H 14 3.920 3.938 -0.018 1
1 105 . 11 1 1 A 14 14 GLY C C 14 174.000 175.435 -1.435 1
1 106 . 11 1 1 A 14 14 GLY CA C 14 45.200 46.694 -1.494 1
1 107 . 11 1 1 A 14 14 GLY N N 14 109.600 110.945 -1.345 1
1 108 . 11 1 1 A 15 15 ALA H H 15 8.140 8.032 0.108 1
1 109 . 11 1 1 A 15 15 ALA HA H 15 4.280 4.295 -0.015 1
1 113 . 11 1 1 A 15 15 ALA C C 15 177.300 177.516 -0.216 1
1 114 . 11 1 1 A 15 15 ALA CA C 15 52.500 52.205 0.295 1
1 115 . 11 1 1 A 15 15 ALA CB C 15 19.100 19.306 -0.206 1
1 116 . 11 1 1 A 15 15 ALA N N 15 123.800 121.220 2.580 1
1 117 . 11 1 1 A 16 16 ALA H H 16 8.030 7.377 0.653 1
1 118 . 11 1 1 A 16 16 ALA HA H 16 4.280 4.190 0.090 1
1 122 . 11 1 1 A 16 16 ALA C C 16 178.400 178.031 0.369 1
1 123 . 11 1 1 A 16 16 ALA CA C 16 52.600 52.373 0.227 1
1 124 . 11 1 1 A 16 16 ALA CB C 16 19.100 19.368 -0.268 1
1 125 . 11 1 1 A 16 16 ALA N N 16 122.300 122.224 0.076 1
1 126 . 11 1 1 A 17 17 GLY H H 17 8.320 8.291 0.029 1
1 127 . 11 1 1 A 17 17 GLY HA2 H 17 3.960 4.218 -0.258 1
1 128 . 11 1 1 A 17 17 GLY HA3 H 17 3.960 4.219 -0.259 1
1 129 . 11 1 1 A 17 17 GLY C C 17 174.500 174.968 -0.468 1
1 130 . 11 1 1 A 17 17 GLY CA C 17 45.200 45.763 -0.563 1
1 131 . 11 1 1 A 17 17 GLY N N 17 107.800 110.748 -2.948 1
1 132 . 11 1 1 A 18 18 THR H H 18 7.970 7.958 0.012 1
1 133 . 11 1 1 A 18 18 THR HA H 18 4.290 3.800 0.490 1
1 138 . 11 1 1 A 18 18 THR C C 18 174.600 176.386 -1.786 1
1 139 . 11 1 1 A 18 18 THR CA C 18 62.000 66.618 -4.618 1
1 140 . 11 1 1 A 18 18 THR CB C 18 69.700 68.739 0.961 1
1 142 . 11 1 1 A 18 18 THR N N 18 113.800 114.738 -0.938 1
1 143 . 11 1 1 A 19 19 LYS H H 19 8.350 8.365 -0.015 1
1 144 . 11 1 1 A 19 19 LYS HA H 19 4.270 4.061 0.209 1
1 153 . 11 1 1 A 19 19 LYS C C 19 176.600 177.678 -1.078 1
1 154 . 11 1 1 A 19 19 LYS CA C 19 56.500 58.750 -2.250 1
1 155 . 11 1 1 A 19 19 LYS CB C 19 32.800 32.118 0.682 1
1 159 . 11 1 1 A 19 19 LYS N N 19 124.000 119.754 4.246 1
1 160 . 11 1 1 A 20 20 VAL H H 20 8.060 7.549 0.511 1
1 161 . 11 1 1 A 20 20 VAL HA H 20 3.990 4.388 -0.398 1
1 169 . 11 1 1 A 20 20 VAL C C 20 175.900 176.345 -0.445 1
1 170 . 11 1 1 A 20 20 VAL CA C 20 62.400 61.965 0.435 1
1 171 . 11 1 1 A 20 20 VAL CB C 20 32.600 31.132 1.468 1
1 174 . 11 1 1 A 20 20 VAL N N 20 121.700 119.725 1.975 1
1 175 . 11 1 1 A 21 21 ALA H H 21 8.310 7.755 0.555 1
1 176 . 11 1 1 A 21 21 ALA HA H 21 4.290 4.019 0.271 1
1 180 . 11 1 1 A 21 21 ALA C C 21 177.600 178.822 -1.222 1
1 181 . 11 1 1 A 21 21 ALA CA C 21 52.400 55.359 -2.959 1
1 182 . 11 1 1 A 21 21 ALA CB C 21 19.000 18.874 0.126 1
1 183 . 11 1 1 A 21 21 ALA N N 21 127.700 125.931 1.769 1
1 184 . 11 1 1 A 22 22 LEU H H 22 8.150 7.634 0.516 1
1 185 . 11 1 1 A 22 22 LEU HA H 22 4.280 4.414 -0.134 1
1 195 . 11 1 1 A 22 22 LEU C C 22 177.400 176.036 1.364 1
1 196 . 11 1 1 A 22 22 LEU CA C 22 55.200 54.267 0.933 1
1 197 . 11 1 1 A 22 22 LEU CB C 22 42.200 41.934 0.266 1
1 201 . 11 1 1 A 22 22 LEU N N 22 121.800 115.152 6.648 1
1 202 . 11 1 1 A 23 23 ARG H H 23 8.240 8.105 0.135 1
1 203 . 11 1 1 A 23 23 ARG HA H 23 4.290 3.992 0.298 1
1 211 . 11 1 1 A 23 23 ARG C C 23 176.300 175.897 0.403 1
1 212 . 11 1 1 A 23 23 ARG CA C 23 56.000 57.385 -1.385 1
1 213 . 11 1 1 A 23 23 ARG CB C 23 30.600 26.797 3.803 1
1 216 . 11 1 1 A 23 23 ARG N N 23 122.000 115.371 6.629 1
1 218 . 11 1 1 A 24 24 LYS H H 24 8.370 7.971 0.399 1
1 219 . 11 1 1 A 24 24 LYS HA H 24 4.330 4.268 0.062 1
1 228 . 11 1 1 A 24 24 LYS C C 24 176.800 176.589 0.211 1
1 229 . 11 1 1 A 24 24 LYS CA C 24 56.400 57.864 -1.464 1
1 230 . 11 1 1 A 24 24 LYS CB C 24 32.700 33.308 -0.608 1
1 234 . 11 1 1 A 24 24 LYS N N 24 122.900 117.574 5.326 1
1 235 . 11 1 1 A 25 25 THR H H 25 8.100 7.592 0.508 1
1 236 . 11 1 1 A 25 25 THR HA H 25 4.290 4.313 -0.023 1
1 241 . 11 1 1 A 25 25 THR C C 25 174.600 174.499 0.101 1
1 242 . 11 1 1 A 25 25 THR CA C 25 61.500 61.876 -0.376 1
1 243 . 11 1 1 A 25 25 THR CB C 25 69.800 70.133 -0.333 1
1 245 . 11 1 1 A 25 25 THR N N 25 115.500 115.195 0.305 1
1 246 . 11 1 1 A 26 26 LYS H H 26 8.370 8.661 -0.291 1
1 247 . 11 1 1 A 26 26 LYS HA H 26 4.270 4.253 0.017 1
1 256 . 11 1 1 A 26 26 LYS C C 26 176.600 177.262 -0.662 1
1 257 . 11 1 1 A 26 26 LYS CA C 26 56.600 56.807 -0.207 1
1 258 . 11 1 1 A 26 26 LYS CB C 26 32.700 32.649 0.051 1
1 262 . 11 1 1 A 26 26 LYS N N 26 123.700 124.465 -0.765 1
1 263 . 11 1 1 A 27 27 GLN H H 27 8.390 9.048 -0.658 1
1 264 . 11 1 1 A 27 27 GLN HA H 27 4.240 4.541 -0.301 1
1 271 . 11 1 1 A 27 27 GLN C C 27 175.900 176.169 -0.269 1
1 272 . 11 1 1 A 27 27 GLN CA C 27 56.100 56.382 -0.282 1
1 273 . 11 1 1 A 27 27 GLN CB C 27 29.300 29.966 -0.666 1
1 275 . 11 1 1 A 27 27 GLN N N 27 121.700 120.762 0.938 1
1 277 . 11 1 1 A 28 28 ALA H H 28 8.330 7.664 0.666 1
1 278 . 11 1 1 A 28 28 ALA HA H 28 4.240 4.521 -0.281 1
1 282 . 11 1 1 A 28 28 ALA C C 28 177.700 177.936 -0.236 1
1 283 . 11 1 1 A 28 28 ALA CA C 28 52.500 51.437 1.063 1
1 284 . 11 1 1 A 28 28 ALA CB C 28 19.100 21.418 -2.318 1
1 285 . 11 1 1 A 28 28 ALA N N 28 125.400 120.313 5.087 1
1 286 . 11 1 1 A 29 29 ALA H H 29 8.250 9.024 -0.774 1
1 287 . 11 1 1 A 29 29 ALA HA H 29 4.230 3.945 0.285 1
1 291 . 11 1 1 A 29 29 ALA C C 29 178.000 179.448 -1.448 1
1 292 . 11 1 1 A 29 29 ALA CA C 29 52.500 55.174 -2.674 1
1 293 . 11 1 1 A 29 29 ALA CB C 29 19.100 18.367 0.733 1
1 294 . 11 1 1 A 29 29 ALA N N 29 123.000 127.063 -4.063 1
1 295 . 11 1 1 A 30 30 GLU H H 30 8.260 8.041 0.219 1
1 296 . 11 1 1 A 30 30 GLU HA H 30 4.220 4.127 0.093 1
1 301 . 11 1 1 A 30 30 GLU C C 30 176.500 177.600 -1.100 1
1 302 . 11 1 1 A 30 30 GLU CA C 30 56.400 58.379 -1.979 1
1 303 . 11 1 1 A 30 30 GLU CB C 30 29.500 29.379 0.121 1
1 305 . 11 1 1 A 30 30 GLU N N 30 119.700 117.925 1.775 1
1 306 . 11 1 1 A 31 31 LYS H H 31 8.230 7.960 0.270 1
1 307 . 11 1 1 A 31 31 LYS HA H 31 4.280 4.462 -0.182 1
1 316 . 11 1 1 A 31 31 LYS C C 31 176.500 177.057 -0.557 1
1 317 . 11 1 1 A 31 31 LYS CA C 31 56.400 57.506 -1.106 1
1 318 . 11 1 1 A 31 31 LYS CB C 31 32.800 33.384 -0.584 1
1 322 . 11 1 1 A 31 31 LYS N N 31 122.700 118.906 3.794 1
1 323 . 11 1 1 A 32 32 ILE H H 32 8.140 7.344 0.796 1
1 324 . 11 1 1 A 32 32 ILE HA H 32 4.110 3.997 0.113 1
1 334 . 11 1 1 A 32 32 ILE C C 32 176.400 176.304 0.096 1
1 335 . 11 1 1 A 32 32 ILE CA C 32 61.200 62.137 -0.937 1
1 336 . 11 1 1 A 32 32 ILE CB C 32 38.600 37.955 0.645 1
1 340 . 11 1 1 A 32 32 ILE N N 32 122.300 121.110 1.190 1
1 341 . 11 1 1 A 33 33 SER H H 33 8.230 8.947 -0.717 1
1 342 . 11 1 1 A 33 33 SER HA H 33 4.400 3.995 0.405 1
1 345 . 11 1 1 A 33 33 SER C C 33 174.800 176.687 -1.887 1
1 346 . 11 1 1 A 33 33 SER CA C 33 58.300 61.851 -3.551 1
1 347 . 11 1 1 A 33 33 SER CB C 33 63.700 62.844 0.856 1
1 348 . 11 1 1 A 33 33 SER N N 33 119.600 122.084 -2.484 1
1 349 . 11 1 1 A 34 34 ALA H H 34 8.430 8.426 0.004 1
1 350 . 11 1 1 A 34 34 ALA HA H 34 4.220 3.983 0.237 1
1 354 . 11 1 1 A 34 34 ALA C C 34 179.500 179.527 -0.027 1
1 355 . 11 1 1 A 34 34 ALA CA C 34 53.500 55.294 -1.794 1
1 356 . 11 1 1 A 34 34 ALA CB C 34 18.800 18.267 0.533 1
1 357 . 11 1 1 A 34 34 ALA N N 34 126.000 123.604 2.396 1
1 358 . 11 1 1 A 35 35 ASP H H 35 8.380 7.798 0.582 1
1 359 . 11 1 1 A 35 35 ASP HA H 35 4.520 4.289 0.231 1
1 362 . 11 1 1 A 35 35 ASP C C 35 176.500 178.533 -2.033 1
1 363 . 11 1 1 A 35 35 ASP CA C 35 54.800 57.046 -2.246 1
1 364 . 11 1 1 A 35 35 ASP CB C 35 40.200 41.200 -1.000 1
1 365 . 11 1 1 A 35 35 ASP N N 35 118.200 117.982 0.218 1
1 366 . 11 1 1 A 36 36 LYS H H 36 8.000 7.642 0.358 1
1 367 . 11 1 1 A 36 36 LYS HA H 36 4.270 4.088 0.182 1
1 376 . 11 1 1 A 36 36 LYS C C 36 177.000 177.047 -0.047 1
1 377 . 11 1 1 A 36 36 LYS CA C 36 56.800 58.789 -1.989 1
1 378 . 11 1 1 A 36 36 LYS CB C 36 32.900 31.672 1.228 1
1 382 . 11 1 1 A 36 36 LYS N N 36 120.900 118.308 2.592 1
1 383 . 11 1 1 A 37 37 ILE H H 37 7.970 7.297 0.673 1
1 384 . 11 1 1 A 37 37 ILE HA H 37 4.020 4.135 -0.115 1
1 394 . 11 1 1 A 37 37 ILE C C 37 176.100 174.995 1.105 1
1 395 . 11 1 1 A 37 37 ILE CA C 37 61.300 61.257 0.043 1
1 396 . 11 1 1 A 37 37 ILE CB C 37 38.100 36.690 1.410 1
1 400 . 11 1 1 A 37 37 ILE N N 37 121.800 120.936 0.864 1
1 401 . 11 1 1 A 38 38 SER H H 38 7.980 8.731 -0.751 1
1 402 . 11 1 1 A 38 38 SER HA H 38 4.540 4.721 -0.181 1
1 405 . 11 1 1 A 38 38 SER C C 38 174.700 175.768 -1.068 1
1 406 . 11 1 1 A 38 38 SER CA C 38 58.200 57.825 0.375 1
1 407 . 11 1 1 A 38 38 SER CB C 38 64.400 64.732 -0.332 1
1 408 . 11 1 1 A 38 38 SER N N 38 119.000 123.983 -4.983 1
1 409 . 11 1 1 A 39 39 LYS H H 39 8.690 9.152 -0.462 1
1 410 . 11 1 1 A 39 39 LYS HA H 39 3.400 3.858 -0.458 1
1 419 . 11 1 1 A 39 39 LYS C C 39 177.400 178.093 -0.693 1
1 420 . 11 1 1 A 39 39 LYS CA C 39 59.800 60.607 -0.807 1
1 421 . 11 1 1 A 39 39 LYS CB C 39 32.400 32.416 -0.016 1
1 425 . 11 1 1 A 39 39 LYS N N 39 124.200 125.129 -0.929 1
1 426 . 11 1 1 A 40 40 GLU H H 40 8.280 8.509 -0.229 1
1 427 . 11 1 1 A 40 40 GLU HA H 40 3.840 4.074 -0.234 1
1 432 . 11 1 1 A 40 40 GLU C C 40 178.400 178.723 -0.323 1
1 433 . 11 1 1 A 40 40 GLU CA C 40 59.400 59.306 0.094 1
1 434 . 11 1 1 A 40 40 GLU CB C 40 28.300 29.381 -1.081 1
1 436 . 11 1 1 A 40 40 GLU N N 40 116.300 117.535 -1.235 1
1 437 . 11 1 1 A 41 41 ALA H H 41 7.890 7.926 -0.036 1
1 438 . 11 1 1 A 41 41 ALA HA H 41 3.910 4.155 -0.245 1
1 442 . 11 1 1 A 41 41 ALA C C 41 179.900 180.116 -0.216 1
1 443 . 11 1 1 A 41 41 ALA CA C 41 54.700 55.214 -0.514 1
1 444 . 11 1 1 A 41 41 ALA CB C 41 17.900 18.453 -0.553 1
1 445 . 11 1 1 A 41 41 ALA N N 41 122.300 122.480 -0.180 1
1 446 . 11 1 1 A 42 42 LEU H H 42 7.490 7.904 -0.414 1
1 447 . 11 1 1 A 42 42 LEU HA H 42 3.480 3.965 -0.485 1
1 457 . 11 1 1 A 42 42 LEU C C 42 178.900 178.511 0.389 1
1 458 . 11 1 1 A 42 42 LEU CA C 42 59.800 57.708 2.092 1
1 459 . 11 1 1 A 42 42 LEU CB C 42 42.300 41.414 0.886 1
1 463 . 11 1 1 A 42 42 LEU N N 42 121.000 119.251 1.749 1
1 464 . 11 1 1 A 43 43 LEU H H 43 8.290 8.274 0.016 1
1 465 . 11 1 1 A 43 43 LEU HA H 43 3.780 3.801 -0.021 1
1 475 . 11 1 1 A 43 43 LEU C C 43 179.400 179.056 0.344 1
1 476 . 11 1 1 A 43 43 LEU CA C 43 57.600 58.161 -0.561 1
1 477 . 11 1 1 A 43 43 LEU CB C 43 40.900 41.683 -0.783 1
1 481 . 11 1 1 A 43 43 LEU N N 43 119.200 118.348 0.852 1
1 482 . 11 1 1 A 44 44 GLU H H 44 8.330 8.216 0.114 1
1 483 . 11 1 1 A 44 44 GLU HA H 44 4.050 3.913 0.137 1
1 488 . 11 1 1 A 44 44 GLU C C 44 178.600 178.817 -0.217 1
1 489 . 11 1 1 A 44 44 GLU CA C 44 58.900 59.257 -0.357 1
1 490 . 11 1 1 A 44 44 GLU CB C 44 28.300 29.525 -1.225 1
1 492 . 11 1 1 A 44 44 GLU N N 44 119.600 117.215 2.385 1
1 493 . 11 1 1 A 45 45 CYS H H 45 7.690 8.081 -0.391 1
1 494 . 11 1 1 A 45 45 CYS HA H 45 4.120 4.019 0.101 1
1 497 . 11 1 1 A 45 45 CYS C C 45 176.100 176.963 -0.863 1
1 498 . 11 1 1 A 45 45 CYS CA C 45 62.500 62.519 -0.019 1
1 499 . 11 1 1 A 45 45 CYS CB C 45 26.200 25.694 0.506 1
1 500 . 11 1 1 A 45 45 CYS N N 45 120.900 119.142 1.758 1
1 501 . 11 1 1 A 46 46 ALA H H 46 8.540 7.856 0.684 1
1 502 . 11 1 1 A 46 46 ALA HA H 46 3.900 3.985 -0.085 1
1 506 . 11 1 1 A 46 46 ALA C C 46 179.200 179.213 -0.013 1
1 507 . 11 1 1 A 46 46 ALA CA C 46 55.500 55.241 0.259 1
1 508 . 11 1 1 A 46 46 ALA CB C 46 16.800 18.560 -1.760 1
1 509 . 11 1 1 A 46 46 ALA N N 46 121.500 121.889 -0.389 1
1 510 . 11 1 1 A 47 47 ASP H H 47 8.460 8.408 0.052 1
1 511 . 11 1 1 A 47 47 ASP HA H 47 4.340 4.317 0.023 1
1 514 . 11 1 1 A 47 47 ASP C C 47 178.800 178.651 0.149 1
1 515 . 11 1 1 A 47 47 ASP CA C 47 56.600 57.552 -0.952 1
1 516 . 11 1 1 A 47 47 ASP CB C 47 39.800 42.317 -2.517 1
1 517 . 11 1 1 A 47 47 ASP N N 47 119.000 118.563 0.437 1
1 518 . 11 1 1 A 48 48 LEU H H 48 8.040 8.132 -0.092 1
1 519 . 11 1 1 A 48 48 LEU HA H 48 4.110 3.932 0.178 1
1 529 . 11 1 1 A 48 48 LEU C C 48 180.000 179.335 0.665 1
1 530 . 11 1 1 A 48 48 LEU CA C 48 58.000 58.151 -0.151 1
1 531 . 11 1 1 A 48 48 LEU CB C 48 41.700 41.450 0.250 1
1 535 . 11 1 1 A 48 48 LEU N N 48 123.000 120.135 2.865 1
1 536 . 11 1 1 A 49 49 LEU H H 49 8.300 7.695 0.605 1
1 537 . 11 1 1 A 49 49 LEU HA H 49 4.110 3.800 0.310 1
1 547 . 11 1 1 A 49 49 LEU C C 49 177.200 178.873 -1.673 1
1 548 . 11 1 1 A 49 49 LEU CA C 49 57.600 58.071 -0.471 1
1 549 . 11 1 1 A 49 49 LEU CB C 49 41.200 41.646 -0.446 1
1 553 . 11 1 1 A 49 49 LEU N N 49 120.900 119.040 1.860 1
1 554 . 11 1 1 A 50 50 SER H H 50 8.660 8.167 0.493 1
1 555 . 11 1 1 A 50 50 SER HA H 50 4.000 4.053 -0.053 1
1 558 . 11 1 1 A 50 50 SER C C 50 176.800 176.992 -0.192 1
1 559 . 11 1 1 A 50 50 SER CA C 50 62.500 61.639 0.861 1
1 560 . 11 1 1 A 50 50 SER CB C 50 62.600 62.888 -0.288 1
1 561 . 11 1 1 A 50 50 SER N N 50 113.300 114.161 -0.861 1
1 562 . 11 1 1 A 51 51 SER H H 51 7.980 8.160 -0.180 1
1 563 . 11 1 1 A 51 51 SER HA H 51 4.220 4.188 0.032 1
1 566 . 11 1 1 A 51 51 SER C C 51 176.300 176.943 -0.643 1
1 567 . 11 1 1 A 51 51 SER CA C 51 61.200 61.550 -0.350 1
1 568 . 11 1 1 A 51 51 SER CB C 51 62.700 62.627 0.073 1
1 569 . 11 1 1 A 51 51 SER N N 51 115.900 115.194 0.706 1
1 570 . 11 1 1 A 52 52 ALA H H 52 8.030 8.245 -0.215 1
1 571 . 11 1 1 A 52 52 ALA HA H 52 4.130 4.174 -0.044 1
1 575 . 11 1 1 A 52 52 ALA C C 52 178.500 179.508 -1.008 1
1 576 . 11 1 1 A 52 52 ALA CA C 52 54.500 54.781 -0.281 1
1 577 . 11 1 1 A 52 52 ALA CB C 52 18.000 18.239 -0.239 1
1 578 . 11 1 1 A 52 52 ALA N N 52 125.400 123.016 2.384 1
1 579 . 11 1 1 A 53 53 LEU H H 53 7.710 8.002 -0.292 1
1 580 . 11 1 1 A 53 53 LEU HA H 53 4.180 4.131 0.049 1
1 590 . 11 1 1 A 53 53 LEU C C 53 177.700 178.354 -0.654 1
1 591 . 11 1 1 A 53 53 LEU CA C 53 56.500 56.589 -0.089 1
1 592 . 11 1 1 A 53 53 LEU CB C 53 42.400 41.559 0.841 1
1 596 . 11 1 1 A 53 53 LEU N N 53 113.800 118.901 -5.101 1
1 597 . 11 1 1 A 54 54 THR H H 54 7.550 7.647 -0.097 1
1 598 . 11 1 1 A 54 54 THR HA H 54 4.420 4.409 0.011 1
1 603 . 11 1 1 A 54 54 THR C C 54 174.100 175.036 -0.936 1
1 604 . 11 1 1 A 54 54 THR CA C 54 61.600 63.302 -1.702 1
1 605 . 11 1 1 A 54 54 THR CB C 54 69.300 69.550 -0.250 1
1 607 . 11 1 1 A 54 54 THR N N 54 107.700 108.385 -0.685 1
1 608 . 11 1 1 A 55 55 GLU H H 55 7.750 7.161 0.589 1
1 609 . 11 1 1 A 55 55 GLU HA H 55 4.760 4.514 0.246 1
1 614 . 11 1 1 A 55 55 GLU CA C 55 53.400 54.948 -1.548 1
1 615 . 11 1 1 A 55 55 GLU CB C 55 30.100 29.974 0.126 1
1 617 . 11 1 1 A 55 55 GLU N N 55 122.800 120.984 1.816 1
1 618 . 11 1 1 A 56 56 PRO HA H 56 4.670 4.832 -0.162 1
1 625 . 11 1 1 A 56 56 PRO C C 56 176.200 176.493 -0.293 1
1 626 . 11 1 1 A 56 56 PRO CA C 56 62.900 62.604 0.296 1
1 627 . 11 1 1 A 56 56 PRO CB C 56 29.200 31.683 -2.483 1
1 630 . 11 1 1 A 57 57 VAL H H 57 8.010 8.376 -0.366 1
1 631 . 11 1 1 A 57 57 VAL HA H 57 4.590 4.972 -0.382 1
1 639 . 11 1 1 A 57 57 VAL CA C 57 58.600 58.285 0.315 1
1 640 . 11 1 1 A 57 57 VAL CB C 57 32.800 34.880 -2.080 1
1 643 . 11 1 1 A 57 57 VAL N N 57 121.400 117.392 4.008 1
1 644 . 11 1 1 A 58 58 PRO HA H 58 4.450 4.985 -0.535 1
1 651 . 11 1 1 A 58 58 PRO C C 58 177.500 177.932 -0.432 1
1 652 . 11 1 1 A 58 58 PRO CA C 58 62.600 62.922 -0.322 1
1 653 . 11 1 1 A 58 58 PRO CB C 58 32.200 31.664 0.536 1
1 656 . 11 1 1 A 59 59 ASN H H 59 8.890 8.706 0.184 1
1 657 . 11 1 1 A 59 59 ASN HA H 59 4.330 4.382 -0.052 1
1 662 . 11 1 1 A 59 59 ASN C C 59 177.600 177.647 -0.047 1
1 663 . 11 1 1 A 59 59 ASN CA C 59 56.300 56.447 -0.147 1
1 664 . 11 1 1 A 59 59 ASN CB C 59 38.400 38.331 0.069 1
1 665 . 11 1 1 A 59 59 ASN N N 59 122.200 121.862 0.338 1
1 667 . 11 1 1 A 60 60 SER H H 60 8.660 8.073 0.587 1
1 668 . 11 1 1 A 60 60 SER HA H 60 4.010 4.123 -0.113 1
1 671 . 11 1 1 A 60 60 SER C C 60 176.200 176.120 0.080 1
1 672 . 11 1 1 A 60 60 SER CA C 60 60.800 61.634 -0.834 1
1 673 . 11 1 1 A 60 60 SER CB C 60 61.500 62.902 -1.402 1
1 674 . 11 1 1 A 60 60 SER N N 60 113.200 116.572 -3.372 1
1 675 . 11 1 1 A 61 61 GLN H H 61 7.420 7.839 -0.419 1
1 676 . 11 1 1 A 61 61 GLN HA H 61 4.280 4.036 0.244 1
1 683 . 11 1 1 A 61 61 GLN C C 61 178.600 178.576 0.024 1
1 684 . 11 1 1 A 61 61 GLN CA C 61 57.900 58.856 -0.956 1
1 685 . 11 1 1 A 61 61 GLN CB C 61 28.600 28.235 0.365 1
1 687 . 11 1 1 A 61 61 GLN N N 61 122.200 121.060 1.140 1
1 689 . 11 1 1 A 62 62 LEU H H 62 7.430 7.893 -0.463 1
1 690 . 11 1 1 A 62 62 LEU HA H 62 3.850 4.056 -0.206 1
1 700 . 11 1 1 A 62 62 LEU C C 62 178.800 179.201 -0.401 1
1 701 . 11 1 1 A 62 62 LEU CA C 62 57.900 58.153 -0.253 1
1 702 . 11 1 1 A 62 62 LEU CB C 62 42.100 41.792 0.308 1
1 706 . 11 1 1 A 62 62 LEU N N 62 120.600 119.608 0.992 1
1 707 . 11 1 1 A 63 63 VAL H H 63 8.200 8.316 -0.116 1
1 708 . 11 1 1 A 63 63 VAL HA H 63 3.370 3.499 -0.129 1
1 716 . 11 1 1 A 63 63 VAL C C 63 178.000 177.897 0.103 1
1 717 . 11 1 1 A 63 63 VAL CA C 63 66.600 67.031 -0.431 1
1 718 . 11 1 1 A 63 63 VAL CB C 63 31.700 31.516 0.184 1
1 721 . 11 1 1 A 63 63 VAL N N 63 118.200 118.719 -0.519 1
1 722 . 11 1 1 A 64 64 ASP H H 64 7.960 8.358 -0.398 1
1 723 . 11 1 1 A 64 64 ASP HA H 64 4.460 4.369 0.091 1
1 726 . 11 1 1 A 64 64 ASP C C 64 178.100 178.470 -0.370 1
1 727 . 11 1 1 A 64 64 ASP CA C 64 57.700 57.296 0.404 1
1 728 . 11 1 1 A 64 64 ASP CB C 64 39.800 41.300 -1.500 1
1 729 . 11 1 1 A 64 64 ASP N N 64 120.200 120.299 -0.099 1
1 730 . 11 1 1 A 65 65 THR H H 65 8.380 8.588 -0.208 1
1 731 . 11 1 1 A 65 65 THR HA H 65 3.970 3.996 -0.026 1
1 736 . 11 1 1 A 65 65 THR C C 65 176.500 177.246 -0.746 1
1 737 . 11 1 1 A 65 65 THR CA C 65 66.500 66.618 -0.118 1
1 738 . 11 1 1 A 65 65 THR CB C 65 67.800 68.074 -0.274 1
1 740 . 11 1 1 A 65 65 THR N N 65 118.100 115.102 2.998 1
1 741 . 11 1 1 A 66 66 GLY H H 66 8.900 8.459 0.441 1
1 742 . 11 1 1 A 66 66 GLY HA2 H 66 3.630 3.732 -0.102 1
1 743 . 11 1 1 A 66 66 GLY HA3 H 66 3.630 3.754 -0.124 1
1 744 . 11 1 1 A 66 66 GLY C C 66 174.200 175.674 -1.474 1
1 745 . 11 1 1 A 66 66 GLY CA C 66 47.500 46.998 0.502 1
1 746 . 11 1 1 A 66 66 GLY N N 66 110.500 107.556 2.944 1
1 747 . 11 1 1 A 67 67 HIS H H 67 8.650 8.265 0.385 1
1 748 . 11 1 1 A 67 67 HIS HA H 67 4.220 4.138 0.082 1
1 752 . 11 1 1 A 67 67 HIS C C 67 176.900 177.457 -0.557 1
1 753 . 11 1 1 A 67 67 HIS CA C 67 59.000 59.376 -0.376 1
1 754 . 11 1 1 A 67 67 HIS CB C 67 27.800 29.502 -1.702 1
1 756 . 11 1 1 A 67 67 HIS N N 67 120.100 122.018 -1.918 1
1 757 . 11 1 1 A 68 68 GLN H H 68 7.860 8.578 -0.718 1
1 758 . 11 1 1 A 68 68 GLN HA H 68 3.990 4.004 -0.014 1
1 765 . 11 1 1 A 68 68 GLN C C 68 177.800 177.712 0.088 1
1 766 . 11 1 1 A 68 68 GLN CA C 68 58.800 58.440 0.360 1
1 767 . 11 1 1 A 68 68 GLN CB C 68 28.200 27.262 0.938 1
1 769 . 11 1 1 A 68 68 GLN N N 68 121.400 116.875 4.525 1
1 771 . 11 1 1 A 69 69 LEU H H 69 8.300 7.672 0.628 1
1 772 . 11 1 1 A 69 69 LEU HA H 69 4.330 4.068 0.262 1
1 782 . 11 1 1 A 69 69 LEU C C 69 179.300 180.063 -0.763 1
1 783 . 11 1 1 A 69 69 LEU CA C 69 58.200 58.038 0.162 1
1 784 . 11 1 1 A 69 69 LEU CB C 69 40.500 40.772 -0.272 1
1 788 . 11 1 1 A 69 69 LEU N N 69 120.300 121.769 -1.469 1
1 789 . 11 1 1 A 70 70 LEU H H 70 8.460 7.944 0.516 1
1 790 . 11 1 1 A 70 70 LEU HA H 70 3.880 4.014 -0.134 1
1 800 . 11 1 1 A 70 70 LEU C C 70 179.100 179.068 0.032 1
1 801 . 11 1 1 A 70 70 LEU CA C 70 58.300 58.194 0.106 1
1 802 . 11 1 1 A 70 70 LEU CB C 70 41.500 40.853 0.647 1
1 806 . 11 1 1 A 70 70 LEU N N 70 121.200 120.296 0.904 1
1 807 . 11 1 1 A 71 71 ASP H H 71 8.140 8.289 -0.149 1
1 808 . 11 1 1 A 71 71 ASP HA H 71 4.420 4.372 0.048 1
1 811 . 11 1 1 A 71 71 ASP C C 71 180.000 178.245 1.755 1
1 812 . 11 1 1 A 71 71 ASP CA C 71 57.300 57.330 -0.030 1
1 813 . 11 1 1 A 71 71 ASP CB C 71 39.300 41.164 -1.864 1
1 814 . 11 1 1 A 71 71 ASP N N 71 121.100 119.293 1.807 1
1 815 . 11 1 1 A 72 72 TYR H H 72 8.320 8.264 0.056 1
1 816 . 11 1 1 A 72 72 TYR HA H 72 4.550 4.421 0.129 1
1 823 . 11 1 1 A 72 72 TYR C C 72 179.100 178.843 0.257 1
1 824 . 11 1 1 A 72 72 TYR CA C 72 60.500 60.838 -0.338 1
1 825 . 11 1 1 A 72 72 TYR CB C 72 37.600 37.979 -0.379 1
1 828 . 11 1 1 A 72 72 TYR N N 72 120.300 118.281 2.019 1
1 829 . 11 1 1 A 73 73 CYS H H 73 8.850 8.755 0.095 1
1 830 . 11 1 1 A 73 73 CYS HA H 73 4.380 4.593 -0.213 1
1 834 . 11 1 1 A 73 73 CYS C C 73 177.300 177.194 0.106 1
1 835 . 11 1 1 A 73 73 CYS CA C 73 64.400 63.359 1.041 1
1 836 . 11 1 1 A 73 73 CYS CB C 73 27.600 26.319 1.281 1
1 837 . 11 1 1 A 73 73 CYS N N 73 116.800 118.622 -1.822 1
1 838 . 11 1 1 A 74 74 SER H H 74 8.410 8.502 -0.092 1
1 839 . 11 1 1 A 74 74 SER HA H 74 4.290 4.276 0.014 1
1 842 . 11 1 1 A 74 74 SER C C 74 176.300 176.875 -0.575 1
1 843 . 11 1 1 A 74 74 SER CA C 74 61.400 61.143 0.257 1
1 844 . 11 1 1 A 74 74 SER CB C 74 62.600 62.602 -0.002 1
1 845 . 11 1 1 A 74 74 SER N N 74 115.900 116.636 -0.736 1
1 846 . 11 1 1 A 75 75 GLY H H 75 7.790 8.123 -0.333 1
1 847 . 11 1 1 A 75 75 GLY HA2 H 75 4.320 3.743 0.577 1
1 848 . 11 1 1 A 75 75 GLY HA3 H 75 3.900 3.745 0.155 1
1 849 . 11 1 1 A 75 75 GLY C C 75 174.600 175.453 -0.853 1
1 850 . 11 1 1 A 75 75 GLY CA C 75 45.600 46.951 -1.351 1
1 851 . 11 1 1 A 75 75 GLY N N 75 107.500 109.187 -1.687 1
1 852 . 11 1 1 A 76 76 TYR H H 76 8.040 8.532 -0.492 1
1 853 . 11 1 1 A 76 76 TYR HA H 76 4.310 4.029 0.281 1
1 860 . 11 1 1 A 76 76 TYR C C 76 176.200 177.805 -1.605 1
1 861 . 11 1 1 A 76 76 TYR CA C 76 60.000 61.113 -1.113 1
1 862 . 11 1 1 A 76 76 TYR CB C 76 40.700 38.697 2.003 1
1 865 . 11 1 1 A 76 76 TYR N N 76 121.900 123.753 -1.853 1
1 866 . 11 1 1 A 77 77 VAL H H 77 7.540 8.356 -0.816 1
1 867 . 11 1 1 A 77 77 VAL HA H 77 3.450 3.554 -0.104 1
1 875 . 11 1 1 A 77 77 VAL C C 77 175.500 177.175 -1.675 1
1 876 . 11 1 1 A 77 77 VAL CA C 77 65.500 64.194 1.306 1
1 877 . 11 1 1 A 77 77 VAL CB C 77 31.600 31.343 0.257 1
1 880 . 11 1 1 A 77 77 VAL N N 77 116.600 119.508 -2.908 1
1 881 . 11 1 1 A 78 78 ASP H H 78 7.580 8.016 -0.436 1
1 882 . 11 1 1 A 78 78 ASP HA H 78 4.380 4.304 0.076 1
1 885 . 11 1 1 A 78 78 ASP C C 78 177.000 177.488 -0.488 1
1 886 . 11 1 1 A 78 78 ASP CA C 78 55.800 57.640 -1.840 1
1 887 . 11 1 1 A 78 78 ASP CB C 78 39.900 41.909 -2.009 1
1 888 . 11 1 1 A 78 78 ASP N N 78 116.400 121.054 -4.654 1
1 889 . 11 1 1 A 79 79 CYS H H 79 8.040 7.574 0.466 1
1 890 . 11 1 1 A 79 79 CYS HA H 79 4.110 4.487 -0.377 1
1 893 . 11 1 1 A 79 79 CYS C C 79 174.200 173.524 0.676 1
1 894 . 11 1 1 A 79 79 CYS CA C 79 58.600 58.043 0.557 1
1 895 . 11 1 1 A 79 79 CYS CB C 79 27.200 27.157 0.043 1
1 896 . 11 1 1 A 79 79 CYS N N 79 117.000 114.294 2.706 1
1 897 . 11 1 1 A 80 80 ILE H H 80 6.960 7.355 -0.395 1
1 898 . 11 1 1 A 80 80 ILE HA H 80 4.120 4.209 -0.089 1
1 908 . 11 1 1 A 80 80 ILE CA C 80 58.700 58.124 0.576 1
1 909 . 11 1 1 A 80 80 ILE CB C 80 38.500 37.303 1.197 1
1 913 . 11 1 1 A 80 80 ILE N N 80 123.200 122.649 0.551 1
1 914 . 11 1 1 A 81 81 PRO HA H 81 4.340 4.557 -0.217 1
1 921 . 11 1 1 A 81 81 PRO C C 81 178.000 176.345 1.655 1
1 922 . 11 1 1 A 81 81 PRO CA C 81 64.700 64.307 0.393 1
1 923 . 11 1 1 A 81 81 PRO CB C 81 32.600 31.881 0.719 1
1 926 . 11 1 1 A 82 82 GLN H H 82 7.560 8.170 -0.610 1
1 927 . 11 1 1 A 82 82 GLN HA H 82 4.600 4.501 0.099 1
1 934 . 11 1 1 A 82 82 GLN C C 82 177.400 175.649 1.751 1
1 935 . 11 1 1 A 82 82 GLN CA C 82 55.600 55.368 0.232 1
1 936 . 11 1 1 A 82 82 GLN CB C 82 28.800 28.798 0.002 1
1 938 . 11 1 1 A 82 82 GLN N N 82 115.900 118.535 -2.635 1
1 940 . 11 1 1 A 83 83 THR H H 83 8.880 8.330 0.550 1
1 941 . 11 1 1 A 83 83 THR HA H 83 3.750 3.906 -0.156 1
1 946 . 11 1 1 A 83 83 THR C C 83 176.300 176.192 0.108 1
1 947 . 11 1 1 A 83 83 THR CA C 83 66.500 66.740 -0.240 1
1 948 . 11 1 1 A 83 83 THR CB C 83 68.700 68.805 -0.105 1
1 950 . 11 1 1 A 83 83 THR N N 83 122.700 119.433 3.267 1
1 951 . 11 1 1 A 84 84 ARG H H 84 8.990 8.212 0.778 1
1 952 . 11 1 1 A 84 84 ARG HA H 84 4.250 4.036 0.214 1
1 960 . 11 1 1 A 84 84 ARG C C 84 178.900 179.132 -0.232 1
1 961 . 11 1 1 A 84 84 ARG CA C 84 59.100 59.616 -0.516 1
1 962 . 11 1 1 A 84 84 ARG CB C 84 29.300 30.255 -0.955 1
1 965 . 11 1 1 A 84 84 ARG N N 84 120.100 121.157 -1.057 1
1 967 . 11 1 1 A 85 85 ASN H H 85 7.270 8.294 -1.024 1
1 968 . 11 1 1 A 85 85 ASN HA H 85 4.810 4.644 0.166 1
1 973 . 11 1 1 A 85 85 ASN C C 85 176.800 177.687 -0.887 1
1 974 . 11 1 1 A 85 85 ASN CA C 85 54.800 56.332 -1.532 1
1 975 . 11 1 1 A 85 85 ASN CB C 85 37.600 38.121 -0.521 1
1 976 . 11 1 1 A 85 85 ASN N N 85 117.400 118.253 -0.853 1
1 978 . 11 1 1 A 86 86 LYS H H 86 8.340 8.324 0.016 1
1 979 . 11 1 1 A 86 86 LYS HA H 86 3.890 4.074 -0.184 1
1 988 . 11 1 1 A 86 86 LYS C C 86 178.600 178.713 -0.113 1
1 989 . 11 1 1 A 86 86 LYS CA C 86 60.800 59.222 1.578 1
1 990 . 11 1 1 A 86 86 LYS CB C 86 32.700 32.130 0.570 1
1 994 . 11 1 1 A 86 86 LYS N N 86 124.200 120.695 3.505 1
1 995 . 11 1 1 A 87 87 PHE H H 87 8.120 8.535 -0.415 1
1 996 . 11 1 1 A 87 87 PHE HA H 87 4.260 4.295 -0.035 1
1 1004 . 11 1 1 A 87 87 PHE C C 87 178.100 177.142 0.958 1
1 1005 . 11 1 1 A 87 87 PHE CA C 87 61.300 61.842 -0.542 1
1 1006 . 11 1 1 A 87 87 PHE CB C 87 38.200 39.261 -1.061 1
1 1010 . 11 1 1 A 87 87 PHE N N 87 118.300 120.967 -2.667 1
1 1011 . 11 1 1 A 88 88 ALA H H 88 7.860 8.099 -0.239 1
1 1012 . 11 1 1 A 88 88 ALA HA H 88 4.200 4.560 -0.360 1
1 1016 . 11 1 1 A 88 88 ALA C C 88 180.600 179.761 0.839 1
1 1017 . 11 1 1 A 88 88 ALA CA C 88 54.900 55.153 -0.253 1
1 1018 . 11 1 1 A 88 88 ALA CB C 88 18.100 18.147 -0.047 1
1 1019 . 11 1 1 A 88 88 ALA N N 88 121.700 120.824 0.876 1
1 1020 . 11 1 1 A 89 89 PHE H H 89 8.690 8.594 0.096 1
1 1021 . 11 1 1 A 89 89 PHE HA H 89 4.080 4.129 -0.049 1
1 1029 . 11 1 1 A 89 89 PHE C C 89 176.300 177.856 -1.556 1
1 1030 . 11 1 1 A 89 89 PHE CA C 89 62.000 61.294 0.706 1
1 1031 . 11 1 1 A 89 89 PHE CB C 89 39.800 39.257 0.543 1
1 1035 . 11 1 1 A 89 89 PHE N N 89 120.100 120.204 -0.104 1
1 1036 . 11 1 1 A 90 90 ARG H H 90 8.560 8.615 -0.055 1
1 1037 . 11 1 1 A 90 90 ARG HA H 90 3.790 3.879 -0.089 1
1 1045 . 11 1 1 A 90 90 ARG C C 90 179.600 178.843 0.757 1
1 1046 . 11 1 1 A 90 90 ARG CA C 90 60.000 59.512 0.488 1
1 1047 . 11 1 1 A 90 90 ARG CB C 90 30.000 29.957 0.043 1
1 1050 . 11 1 1 A 90 90 ARG N N 90 118.000 118.413 -0.413 1
1 1052 . 11 1 1 A 91 91 GLU H H 91 8.120 8.160 -0.040 1
1 1053 . 11 1 1 A 91 91 GLU HA H 91 3.980 3.967 0.013 1
1 1058 . 11 1 1 A 91 91 GLU C C 91 178.400 179.027 -0.627 1
1 1059 . 11 1 1 A 91 91 GLU CA C 91 58.900 59.380 -0.480 1
1 1060 . 11 1 1 A 91 91 GLU CB C 91 28.800 28.935 -0.135 1
1 1062 . 11 1 1 A 91 91 GLU N N 91 119.300 118.633 0.667 1
1 1063 . 11 1 1 A 92 92 ALA H H 92 7.820 8.118 -0.298 1
1 1064 . 11 1 1 A 92 92 ALA HA H 92 4.050 3.993 0.057 1
1 1068 . 11 1 1 A 92 92 ALA C C 92 179.800 179.649 0.151 1
1 1069 . 11 1 1 A 92 92 ALA CA C 92 55.000 55.071 -0.071 1
1 1070 . 11 1 1 A 92 92 ALA CB C 92 18.000 18.481 -0.481 1
1 1071 . 11 1 1 A 92 92 ALA N N 92 123.400 122.288 1.112 1
1 1072 . 11 1 1 A 93 93 VAL H H 93 8.430 7.965 0.465 1
1 1073 . 11 1 1 A 93 93 VAL HA H 93 3.250 3.338 -0.088 1
1 1081 . 11 1 1 A 93 93 VAL C C 93 177.900 177.614 0.286 1
1 1082 . 11 1 1 A 93 93 VAL CA C 93 66.800 66.444 0.356 1
1 1083 . 11 1 1 A 93 93 VAL CB C 93 31.300 31.302 -0.002 1
1 1086 . 11 1 1 A 93 93 VAL N N 93 119.900 118.325 1.575 1
1 1087 . 11 1 1 A 94 94 SER H H 94 7.990 7.798 0.192 1
1 1088 . 11 1 1 A 94 94 SER HA H 94 4.230 3.975 0.255 1
1 1091 . 11 1 1 A 94 94 SER C C 94 177.200 177.389 -0.189 1
1 1092 . 11 1 1 A 94 94 SER CA C 94 61.600 61.752 -0.152 1
1 1093 . 11 1 1 A 94 94 SER CB C 94 62.700 62.967 -0.267 1
1 1094 . 11 1 1 A 94 94 SER N N 94 116.000 115.910 0.090 1
1 1095 . 11 1 1 A 95 95 LYS H H 95 7.710 7.610 0.100 1
1 1096 . 11 1 1 A 95 95 LYS HA H 95 4.020 3.980 0.040 1
1 1105 . 11 1 1 A 95 95 LYS C C 95 179.400 179.151 0.249 1
1 1106 . 11 1 1 A 95 95 LYS CA C 95 59.600 59.207 0.393 1
1 1107 . 11 1 1 A 95 95 LYS CB C 95 32.300 32.114 0.186 1
1 1111 . 11 1 1 A 95 95 LYS N N 95 121.400 121.483 -0.083 1
1 1112 . 11 1 1 A 96 96 LEU H H 96 8.270 7.819 0.451 1
1 1113 . 11 1 1 A 96 96 LEU HA H 96 4.040 3.942 0.098 1
1 1123 . 11 1 1 A 96 96 LEU C C 96 177.700 178.279 -0.579 1
1 1124 . 11 1 1 A 96 96 LEU CA C 96 58.600 58.171 0.429 1
1 1125 . 11 1 1 A 96 96 LEU CB C 96 41.000 41.788 -0.788 1
1 1129 . 11 1 1 A 96 96 LEU N N 96 124.800 121.012 3.788 1
1 1130 . 11 1 1 A 97 97 GLU H H 97 8.500 8.313 0.187 1
1 1131 . 11 1 1 A 97 97 GLU HA H 97 3.760 4.070 -0.310 1
1 1136 . 11 1 1 A 97 97 GLU C C 97 179.100 179.271 -0.171 1
1 1137 . 11 1 1 A 97 97 GLU CA C 97 59.900 59.016 0.884 1
1 1138 . 11 1 1 A 97 97 GLU CB C 97 28.700 29.303 -0.603 1
1 1140 . 11 1 1 A 97 97 GLU N N 97 119.000 117.366 1.634 1
1 1141 . 11 1 1 A 98 98 LEU H H 98 7.740 8.342 -0.602 1
1 1142 . 11 1 1 A 98 98 LEU HA H 98 4.110 4.001 0.109 1
1 1152 . 11 1 1 A 98 98 LEU C C 98 179.700 179.179 0.521 1
1 1153 . 11 1 1 A 98 98 LEU CA C 98 57.900 57.803 0.097 1
1 1154 . 11 1 1 A 98 98 LEU CB C 98 41.800 41.409 0.391 1
1 1158 . 11 1 1 A 98 98 LEU N N 98 119.200 121.759 -2.559 1
1 1159 . 11 1 1 A 99 99 SER H H 99 8.290 8.145 0.145 1
1 1160 . 11 1 1 A 99 99 SER HA H 99 4.220 4.229 -0.009 1
1 1163 . 11 1 1 A 99 99 SER C C 99 176.600 177.215 -0.615 1
1 1164 . 11 1 1 A 99 99 SER CA C 99 62.400 61.099 1.301 1
1 1165 . 11 1 1 A 99 99 SER CB C 99 63.200 63.098 0.102 1
1 1166 . 11 1 1 A 99 99 SER N N 99 116.300 113.646 2.654 1
1 1167 . 11 1 1 A 100 100 LEU H H 100 8.490 8.279 0.211 1
1 1168 . 11 1 1 A 100 100 LEU HA H 100 3.960 3.983 -0.023 1
1 1178 . 11 1 1 A 100 100 LEU C C 100 179.300 179.225 0.075 1
1 1179 . 11 1 1 A 100 100 LEU CA C 100 57.700 57.982 -0.282 1
1 1180 . 11 1 1 A 100 100 LEU CB C 100 41.300 41.347 -0.047 1
1 1184 . 11 1 1 A 100 100 LEU N N 100 120.900 122.815 -1.915 1
1 1185 . 11 1 1 A 101 101 GLN H H 101 7.680 8.343 -0.663 1
1 1186 . 11 1 1 A 101 101 GLN HA H 101 4.100 3.974 0.126 1
1 1193 . 11 1 1 A 101 101 GLN C C 101 178.700 177.991 0.709 1
1 1194 . 11 1 1 A 101 101 GLN CA C 101 58.800 58.921 -0.121 1
1 1195 . 11 1 1 A 101 101 GLN CB C 101 27.900 27.821 0.079 1
1 1197 . 11 1 1 A 101 101 GLN N N 101 119.100 117.854 1.246 1
1 1199 . 11 1 1 A 102 102 GLU H H 102 7.850 8.141 -0.291 1
1 1200 . 11 1 1 A 102 102 GLU HA H 102 4.050 4.113 -0.063 1
1 1205 . 11 1 1 A 102 102 GLU C C 102 179.100 178.953 0.147 1
1 1206 . 11 1 1 A 102 102 GLU CA C 102 58.400 59.362 -0.962 1
1 1207 . 11 1 1 A 102 102 GLU CB C 102 28.600 29.105 -0.505 1
1 1209 . 11 1 1 A 102 102 GLU N N 102 118.400 118.902 -0.502 1
1 1210 . 11 1 1 A 103 103 LEU H H 103 8.080 8.018 0.062 1
1 1211 . 11 1 1 A 103 103 LEU HA H 103 4.020 3.989 0.031 1
1 1221 . 11 1 1 A 103 103 LEU C C 103 178.200 178.206 -0.006 1
1 1222 . 11 1 1 A 103 103 LEU CA C 103 57.000 58.247 -1.247 1
1 1223 . 11 1 1 A 103 103 LEU CB C 103 41.900 41.783 0.117 1
1 1227 . 11 1 1 A 103 103 LEU N N 103 120.600 123.242 -2.642 1
1 1228 . 11 1 1 A 104 104 GLN H H 104 7.900 8.212 -0.312 1
1 1229 . 11 1 1 A 104 104 GLN HA H 104 4.090 4.082 0.008 1
1 1236 . 11 1 1 A 104 104 GLN C C 104 177.300 177.266 0.034 1
1 1237 . 11 1 1 A 104 104 GLN CA C 104 58.100 58.133 -0.033 1
1 1238 . 11 1 1 A 104 104 GLN CB C 104 29.400 28.140 1.260 1
1 1240 . 11 1 1 A 104 104 GLN N N 104 117.700 116.739 0.961 1
1 1242 . 11 1 1 A 105 105 VAL H H 105 7.620 7.451 0.169 1
1 1243 . 11 1 1 A 105 105 VAL HA H 105 4.190 4.114 0.076 1
1 1251 . 11 1 1 A 105 105 VAL C C 105 176.800 176.575 0.225 1
1 1252 . 11 1 1 A 105 105 VAL CA C 105 62.600 63.787 -1.187 1
1 1253 . 11 1 1 A 105 105 VAL CB C 105 32.000 32.345 -0.345 1
1 1256 . 11 1 1 A 105 105 VAL N N 105 114.900 116.451 -1.551 1
1 1257 . 11 1 1 A 106 106 SER H H 106 7.900 7.970 -0.070 1
1 1258 . 11 1 1 A 106 106 SER HA H 106 4.460 4.565 -0.105 1
1 1261 . 11 1 1 A 106 106 SER C C 106 175.000 175.769 -0.769 1
1 1262 . 11 1 1 A 106 106 SER CA C 106 58.900 57.268 1.632 1
1 1263 . 11 1 1 A 106 106 SER CB C 106 63.900 63.193 0.707 1
1 1264 . 11 1 1 A 106 106 SER N N 106 116.900 117.359 -0.459 1
1 1265 . 11 1 1 A 107 107 SER H H 107 8.230 7.553 0.677 1
1 1266 . 11 1 1 A 107 107 SER HA H 107 4.390 4.116 0.274 1
1 1269 . 11 1 1 A 107 107 SER C C 107 174.600 174.839 -0.239 1
1 1270 . 11 1 1 A 107 107 SER CA C 107 58.400 60.985 -2.585 1
1 1271 . 11 1 1 A 107 107 SER CB C 107 63.600 63.533 0.067 1
1 1272 . 11 1 1 A 107 107 SER N N 107 117.500 115.707 1.793 1
1 1273 . 11 1 1 A 108 108 ALA H H 108 8.080 7.951 0.129 1
1 1274 . 11 1 1 A 108 108 ALA HA H 108 4.280 3.995 0.285 1
1 1278 . 11 1 1 A 108 108 ALA C C 108 177.500 175.915 1.585 1
1 1279 . 11 1 1 A 108 108 ALA CA C 108 52.700 53.590 -0.890 1
1 1280 . 11 1 1 A 108 108 ALA CB C 108 19.200 17.929 1.271 1
1 1281 . 11 1 1 A 108 108 ALA N N 108 124.900 120.863 4.037 1
1 1282 . 11 1 1 A 109 109 ALA H H 109 8.080 7.453 0.627 1
1 1283 . 11 1 1 A 109 109 ALA HA H 109 4.280 4.561 -0.281 1
1 1287 . 11 1 1 A 109 109 ALA C C 109 177.700 177.302 0.398 1
1 1288 . 11 1 1 A 109 109 ALA CA C 109 52.400 50.958 1.442 1
1 1289 . 11 1 1 A 109 109 ALA CB C 109 19.400 22.464 -3.064 1
1 1290 . 11 1 1 A 109 109 ALA N N 109 123.000 118.084 4.916 1
1 1291 . 11 1 1 A 110 110 ALA H H 110 8.300 8.557 -0.257 1
1 1292 . 11 1 1 A 110 110 ALA HA H 110 4.280 4.153 0.127 1
1 1296 . 11 1 1 A 110 110 ALA C C 110 178.200 177.943 0.257 1
1 1297 . 11 1 1 A 110 110 ALA CA C 110 52.700 53.136 -0.436 1
1 1298 . 11 1 1 A 110 110 ALA CB C 110 19.200 19.523 -0.323 1
1 1299 . 11 1 1 A 110 110 ALA N N 110 123.200 122.547 0.653 1
1 1300 . 11 1 1 A 111 111 GLY H H 111 8.300 7.316 0.984 1
1 1301 . 11 1 1 A 111 111 GLY HA2 H 111 3.930 4.062 -0.132 1
1 1302 . 11 1 1 A 111 111 GLY HA3 H 111 3.940 4.062 -0.122 1
1 1303 . 11 1 1 A 111 111 GLY C C 111 173.700 173.026 0.674 1
1 1304 . 11 1 1 A 111 111 GLY CA C 111 45.100 45.676 -0.576 1
1 1305 . 11 1 1 A 111 111 GLY N N 111 108.000 104.232 3.768 1
1 1306 . 11 1 1 A 112 112 VAL H H 112 7.930 8.735 -0.805 1
1 1307 . 11 1 1 A 112 112 VAL HA H 112 4.420 4.541 -0.121 1
1 1315 . 11 1 1 A 112 112 VAL CA C 112 60.000 58.978 1.022 1
1 1316 . 11 1 1 A 112 112 VAL CB C 112 32.200 33.884 -1.684 1
1 1319 . 11 1 1 A 112 112 VAL N N 112 120.400 124.148 -3.748 1
1 1320 . 11 1 1 A 113 113 PRO HA H 113 4.370 4.285 0.085 1
1 1327 . 11 1 1 A 113 113 PRO C C 113 177.300 178.070 -0.770 1
1 1328 . 11 1 1 A 113 113 PRO CA C 113 63.900 63.997 -0.097 1
1 1329 . 11 1 1 A 113 113 PRO CB C 113 31.800 31.300 0.500 1
1 1332 . 11 1 1 A 114 114 GLY H H 114 8.570 8.848 -0.278 1
1 1333 . 11 1 1 A 114 114 GLY HA2 H 114 3.880 3.976 -0.096 1
1 1334 . 11 1 1 A 114 114 GLY HA3 H 114 4.120 3.976 0.144 1
1 1335 . 11 1 1 A 114 114 GLY C C 114 174.900 175.201 -0.301 1
1 1336 . 11 1 1 A 114 114 GLY CA C 114 45.200 46.061 -0.861 1
1 1337 . 11 1 1 A 114 114 GLY N N 114 109.000 113.134 -4.134 1
1 1338 . 11 1 1 A 115 115 THR H H 115 7.900 7.486 0.414 1
1 1339 . 11 1 1 A 115 115 THR HA H 115 4.400 3.972 0.428 1
1 1344 . 11 1 1 A 115 115 THR C C 115 174.300 173.720 0.580 1
1 1345 . 11 1 1 A 115 115 THR CA C 115 61.700 64.838 -3.138 1
1 1346 . 11 1 1 A 115 115 THR CB C 115 69.700 69.783 -0.083 1
1 1348 . 11 1 1 A 115 115 THR N N 115 111.400 115.675 -4.275 1
1 1349 . 11 1 1 A 116 116 ASN H H 116 8.450 8.116 0.334 1
1 1350 . 11 1 1 A 116 116 ASN HA H 116 4.970 5.167 -0.197 1
1 1355 . 11 1 1 A 116 116 ASN CA C 116 51.500 49.316 2.184 1
1 1356 . 11 1 1 A 116 116 ASN CB C 116 38.900 40.011 -1.111 1
1 1357 . 11 1 1 A 116 116 ASN N N 116 123.100 116.627 6.473 1
1 1359 . 11 1 1 A 117 117 PRO HA H 117 4.370 4.340 0.030 1
1 1366 . 11 1 1 A 117 117 PRO C C 117 178.400 178.031 0.369 1
1 1367 . 11 1 1 A 117 117 PRO CA C 117 64.800 65.169 -0.369 1
1 1368 . 11 1 1 A 117 117 PRO CB C 117 32.100 31.792 0.308 1
1 1371 . 11 1 1 A 118 118 VAL H H 118 7.750 7.652 0.098 1
1 1372 . 11 1 1 A 118 118 VAL HA H 118 3.810 3.745 0.065 1
1 1380 . 11 1 1 A 118 118 VAL C C 118 178.300 178.245 0.055 1
1 1381 . 11 1 1 A 118 118 VAL CA C 118 65.200 65.403 -0.203 1
1 1382 . 11 1 1 A 118 118 VAL CB C 118 31.500 31.483 0.017 1
1 1385 . 11 1 1 A 118 118 VAL N N 118 118.300 116.141 2.159 1
1 1386 . 11 1 1 A 119 119 LEU H H 119 7.540 8.181 -0.641 1
1 1387 . 11 1 1 A 119 119 LEU HA H 119 4.030 3.903 0.127 1
1 1397 . 11 1 1 A 119 119 LEU C C 119 178.900 179.436 -0.536 1
1 1398 . 11 1 1 A 119 119 LEU CA C 119 57.800 58.010 -0.210 1
1 1399 . 11 1 1 A 119 119 LEU CB C 119 40.700 41.147 -0.447 1
1 1403 . 11 1 1 A 119 119 LEU N N 119 119.700 120.143 -0.443 1
1 1404 . 11 1 1 A 120 120 ASN H H 120 8.080 7.893 0.187 1
1 1405 . 11 1 1 A 120 120 ASN HA H 120 4.420 4.456 -0.036 1
1 1410 . 11 1 1 A 120 120 ASN C C 120 178.100 178.474 -0.374 1
1 1411 . 11 1 1 A 120 120 ASN CA C 120 56.100 56.177 -0.077 1
1 1412 . 11 1 1 A 120 120 ASN CB C 120 37.800 37.843 -0.043 1
1 1413 . 11 1 1 A 120 120 ASN N N 120 117.700 118.304 -0.604 1
1 1415 . 11 1 1 A 121 121 ASN H H 121 8.120 8.084 0.036 1
1 1416 . 11 1 1 A 121 121 ASN HA H 121 4.490 4.559 -0.069 1
1 1421 . 11 1 1 A 121 121 ASN C C 121 178.000 178.379 -0.379 1
1 1422 . 11 1 1 A 121 121 ASN CA C 121 56.100 56.571 -0.471 1
1 1423 . 11 1 1 A 121 121 ASN CB C 121 37.800 38.098 -0.298 1
1 1424 . 11 1 1 A 121 121 ASN N N 121 120.000 118.596 1.404 1
1 1426 . 11 1 1 A 122 122 LEU H H 122 8.180 8.289 -0.109 1
1 1427 . 11 1 1 A 122 122 LEU HA H 122 4.050 3.926 0.124 1
1 1437 . 11 1 1 A 122 122 LEU C C 122 173.800 178.927 -5.127 1
1 1438 . 11 1 1 A 122 122 LEU CA C 122 58.500 57.959 0.541 1
1 1439 . 11 1 1 A 122 122 LEU CB C 122 41.900 41.915 -0.015 1
1 1443 . 11 1 1 A 122 122 LEU N N 122 122.600 121.140 1.460 1
1 1444 . 11 1 1 A 123 123 LEU H H 123 8.260 7.919 0.341 1
1 1445 . 11 1 1 A 123 123 LEU HA H 123 3.850 3.976 -0.126 1
1 1455 . 11 1 1 A 123 123 LEU C C 123 178.900 178.687 0.213 1
1 1456 . 11 1 1 A 123 123 LEU CA C 123 58.500 58.091 0.409 1
1 1457 . 11 1 1 A 123 123 LEU CB C 123 41.200 41.314 -0.114 1
1 1461 . 11 1 1 A 123 123 LEU N N 123 119.700 120.406 -0.706 1
1 1462 . 11 1 1 A 124 124 SER H H 124 7.950 8.378 -0.428 1
1 1463 . 11 1 1 A 124 124 SER HA H 124 4.240 4.046 0.194 1
1 1466 . 11 1 1 A 124 124 SER C C 124 177.500 177.167 0.333 1
1 1467 . 11 1 1 A 124 124 SER CA C 124 61.600 61.767 -0.167 1
1 1468 . 11 1 1 A 124 124 SER CB C 124 62.600 62.867 -0.267 1
1 1469 . 11 1 1 A 124 124 SER N N 124 113.400 114.274 -0.874 1
1 1470 . 11 1 1 A 125 125 CYS H H 125 8.040 8.296 -0.256 1
1 1471 . 11 1 1 A 125 125 CYS HA H 125 4.350 4.117 0.233 1
1 1474 . 11 1 1 A 125 125 CYS C C 125 176.800 177.068 -0.268 1
1 1475 . 11 1 1 A 125 125 CYS CA C 125 62.600 63.617 -1.017 1
1 1476 . 11 1 1 A 125 125 CYS CB C 125 27.100 26.159 0.941 1
1 1477 . 11 1 1 A 125 125 CYS N N 125 119.800 119.348 0.452 1
1 1478 . 11 1 1 A 126 126 VAL H H 126 8.290 8.397 -0.107 1
1 1479 . 11 1 1 A 126 126 VAL HA H 126 3.430 3.450 -0.020 1
1 1487 . 11 1 1 A 126 126 VAL C C 126 177.800 177.950 -0.150 1
1 1488 . 11 1 1 A 126 126 VAL CA C 126 67.100 66.677 0.423 1
1 1489 . 11 1 1 A 126 126 VAL CB C 126 31.400 31.509 -0.109 1
1 1492 . 11 1 1 A 126 126 VAL N N 126 121.900 120.715 1.185 1
1 1493 . 11 1 1 A 127 127 GLN H H 127 8.200 8.222 -0.022 1
1 1494 . 11 1 1 A 127 127 GLN HA H 127 3.970 3.978 -0.008 1
1 1501 . 11 1 1 A 127 127 GLN C C 127 178.200 178.436 -0.236 1
1 1502 . 11 1 1 A 127 127 GLN CA C 127 58.700 58.827 -0.127 1
1 1503 . 11 1 1 A 127 127 GLN CB C 127 27.800 28.155 -0.355 1
1 1505 . 11 1 1 A 127 127 GLN N N 127 119.700 117.756 1.944 1
1 1507 . 11 1 1 A 128 128 GLU H H 128 7.880 8.118 -0.238 1
1 1508 . 11 1 1 A 128 128 GLU HA H 128 4.200 4.091 0.109 1
1 1513 . 11 1 1 A 128 128 GLU C C 128 178.400 178.900 -0.500 1
1 1514 . 11 1 1 A 128 128 GLU CA C 128 59.000 58.919 0.081 1
1 1515 . 11 1 1 A 128 128 GLU CB C 128 28.400 29.392 -0.992 1
1 1517 . 11 1 1 A 128 128 GLU N N 128 119.800 119.142 0.658 1
1 1518 . 11 1 1 A 129 129 ILE H H 129 8.000 8.455 -0.455 1
1 1519 . 11 1 1 A 129 129 ILE HA H 129 3.460 3.568 -0.108 1
1 1529 . 11 1 1 A 129 129 ILE C C 129 176.800 177.893 -1.093 1
1 1530 . 11 1 1 A 129 129 ILE CA C 129 66.100 65.470 0.630 1
1 1531 . 11 1 1 A 129 129 ILE CB C 129 38.200 37.429 0.771 1
1 1535 . 11 1 1 A 129 129 ILE N N 129 119.500 120.335 -0.835 1
1 1536 . 11 1 1 A 130 130 SER H H 130 8.040 8.255 -0.215 1
1 1537 . 11 1 1 A 130 130 SER HA H 130 3.780 4.153 -0.373 1
1 1540 . 11 1 1 A 130 130 SER C C 130 176.200 176.273 -0.073 1
1 1541 . 11 1 1 A 130 130 SER CA C 130 62.100 61.370 0.730 1
1 1542 . 11 1 1 A 130 130 SER CB C 130 62.600 62.437 0.163 1
1 1543 . 11 1 1 A 130 130 SER N N 130 112.800 114.790 -1.990 1
1 1544 . 11 1 1 A 131 131 ASP H H 131 8.270 7.899 0.371 1
1 1545 . 11 1 1 A 131 131 ASP HA H 131 4.310 4.355 -0.045 1
1 1548 . 11 1 1 A 131 131 ASP C C 131 179.200 178.575 0.625 1
1 1549 . 11 1 1 A 131 131 ASP CA C 131 56.800 57.743 -0.943 1
1 1550 . 11 1 1 A 131 131 ASP CB C 131 40.900 41.761 -0.861 1
1 1551 . 11 1 1 A 131 131 ASP N N 131 119.600 121.772 -2.172 1
1 1552 . 11 1 1 A 132 132 VAL H H 132 8.470 8.241 0.229 1
1 1553 . 11 1 1 A 132 132 VAL HA H 132 3.520 3.755 -0.235 1
1 1561 . 11 1 1 A 132 132 VAL C C 132 178.700 178.639 0.061 1
1 1562 . 11 1 1 A 132 132 VAL CA C 132 66.500 66.086 0.414 1
1 1563 . 11 1 1 A 132 132 VAL CB C 132 31.500 31.812 -0.312 1
1 1566 . 11 1 1 A 132 132 VAL N N 132 118.100 119.045 -0.945 1
1 1567 . 11 1 1 A 133 133 VAL H H 133 8.140 8.214 -0.074 1
1 1568 . 11 1 1 A 133 133 VAL HA H 133 3.770 3.695 0.075 1
1 1576 . 11 1 1 A 133 133 VAL C C 133 176.500 178.472 -1.972 1
1 1577 . 11 1 1 A 133 133 VAL CA C 133 65.100 66.686 -1.586 1
1 1578 . 11 1 1 A 133 133 VAL CB C 133 31.600 31.454 0.146 1
1 1581 . 11 1 1 A 133 133 VAL N N 133 117.000 121.062 -4.062 1
1 1582 . 11 1 1 A 134 134 GLN H H 134 7.490 8.015 -0.525 1
1 1583 . 11 1 1 A 134 134 GLN HA H 134 4.350 4.058 0.292 1
1 1590 . 11 1 1 A 134 134 GLN C C 134 175.400 178.820 -3.420 1
1 1591 . 11 1 1 A 134 134 GLN CA C 134 56.700 58.864 -2.164 1
1 1592 . 11 1 1 A 134 134 GLN CB C 134 30.500 28.203 2.297 1
1 1594 . 11 1 1 A 134 134 GLN N N 134 116.300 118.819 -2.519 1
1 1 . 12 1 1 A 2 2 GLY HA2 H 2 3.890 3.922 -0.032 1
1 2 . 12 1 1 A 2 2 GLY HA3 H 2 3.890 3.924 -0.034 1
1 3 . 12 1 1 A 2 2 GLY C C 2 174.200 174.221 -0.021 1
1 4 . 12 1 1 A 2 2 GLY CA C 2 44.700 47.357 -2.657 1
1 5 . 12 1 1 A 3 3 HIS H H 3 8.380 7.992 0.388 1
1 6 . 12 1 1 A 3 3 HIS HA H 3 4.610 4.942 -0.332 1
1 9 . 12 1 1 A 3 3 HIS C C 3 174.500 174.502 -0.002 1
1 10 . 12 1 1 A 3 3 HIS CA C 3 55.200 54.893 0.307 1
1 11 . 12 1 1 A 3 3 HIS CB C 3 28.800 30.470 -1.670 1
1 12 . 12 1 1 A 3 3 HIS N N 3 117.600 123.478 -5.878 1
1 13 . 12 1 1 A 4 4 HIS H H 4 8.520 8.834 -0.314 1
1 14 . 12 1 1 A 4 4 HIS HA H 4 4.640 4.519 0.121 1
1 17 . 12 1 1 A 4 4 HIS C C 4 174.200 174.846 -0.646 1
1 18 . 12 1 1 A 4 4 HIS CA C 4 55.100 55.444 -0.344 1
1 19 . 12 1 1 A 4 4 HIS CB C 4 28.900 29.781 -0.881 1
1 20 . 12 1 1 A 4 4 HIS N N 4 119.000 125.645 -6.645 1
1 21 . 12 1 1 A 5 5 HIS H H 5 8.530 8.218 0.312 1
1 22 . 12 1 1 A 5 5 HIS HA H 5 4.410 4.558 -0.148 1
1 25 . 12 1 1 A 5 5 HIS CA C 5 54.900 55.930 -1.030 1
1 26 . 12 1 1 A 5 5 HIS CB C 5 27.300 29.835 -2.535 1
1 27 . 12 1 1 A 5 5 HIS N N 5 121.600 121.913 -0.313 1
1 28 . 12 1 1 A 6 6 HIS HA H 6 4.640 4.953 -0.313 1
1 31 . 12 1 1 A 6 6 HIS C C 6 174.100 173.905 0.195 1
1 32 . 12 1 1 A 6 6 HIS CA C 6 55.100 54.283 0.817 1
1 33 . 12 1 1 A 6 6 HIS CB C 6 29.100 31.791 -2.691 1
1 34 . 12 1 1 A 7 7 HIS H H 7 8.690 8.970 -0.280 1
1 35 . 12 1 1 A 7 7 HIS HA H 7 4.650 4.512 0.138 1
1 38 . 12 1 1 A 7 7 HIS C C 7 174.200 173.473 0.727 1
1 39 . 12 1 1 A 7 7 HIS CA C 7 55.200 54.833 0.367 1
1 40 . 12 1 1 A 7 7 HIS CB C 7 29.300 29.430 -0.130 1
1 41 . 12 1 1 A 7 7 HIS N N 7 121.400 125.292 -3.892 1
1 42 . 12 1 1 A 8 8 HIS H H 8 8.660 8.186 0.474 1
1 43 . 12 1 1 A 8 8 HIS HA H 8 4.700 4.674 0.026 1
1 46 . 12 1 1 A 8 8 HIS C C 8 174.200 174.108 0.092 1
1 47 . 12 1 1 A 8 8 HIS CA C 8 55.000 55.301 -0.301 1
1 48 . 12 1 1 A 8 8 HIS CB C 8 29.300 29.029 0.271 1
1 49 . 12 1 1 A 8 8 HIS N N 8 120.400 126.424 -6.024 1
1 50 . 12 1 1 A 9 9 SER H H 9 8.490 8.833 -0.343 1
1 51 . 12 1 1 A 9 9 SER HA H 9 4.390 5.161 -0.771 1
1 54 . 12 1 1 A 9 9 SER C C 9 174.100 173.104 0.996 1
1 55 . 12 1 1 A 9 9 SER CA C 9 58.300 55.965 2.335 1
1 56 . 12 1 1 A 9 9 SER CB C 9 63.700 66.558 -2.858 1
1 57 . 12 1 1 A 9 9 SER N N 9 118.100 120.297 -2.197 1
1 58 . 12 1 1 A 10 10 HIS H H 10 8.710 8.999 -0.289 1
1 59 . 12 1 1 A 10 10 HIS HA H 10 4.690 5.077 -0.387 1
1 63 . 12 1 1 A 10 10 HIS C C 10 174.200 174.750 -0.550 1
1 64 . 12 1 1 A 10 10 HIS CA C 10 55.200 54.641 0.559 1
1 65 . 12 1 1 A 10 10 HIS CB C 10 28.800 32.214 -3.414 1
1 66 . 12 1 1 A 10 10 HIS N N 10 120.700 121.755 -1.055 1
1 67 . 12 1 1 A 11 11 MET H H 11 8.410 8.691 -0.281 1
1 68 . 12 1 1 A 11 11 MET HA H 11 4.420 4.528 -0.108 1
1 76 . 12 1 1 A 11 11 MET C C 11 175.800 175.924 -0.124 1
1 77 . 12 1 1 A 11 11 MET CA C 11 55.100 55.225 -0.125 1
1 78 . 12 1 1 A 11 11 MET CB C 11 32.800 32.189 0.611 1
1 81 . 12 1 1 A 11 11 MET N N 11 122.300 123.477 -1.177 1
1 82 . 12 1 1 A 12 12 ALA H H 12 8.440 8.768 -0.328 1
1 83 . 12 1 1 A 12 12 ALA HA H 12 4.280 5.160 -0.880 1
1 87 . 12 1 1 A 12 12 ALA C C 12 177.400 176.253 1.147 1
1 88 . 12 1 1 A 12 12 ALA CA C 12 52.400 49.924 2.476 1
1 89 . 12 1 1 A 12 12 ALA CB C 12 18.800 22.055 -3.255 1
1 90 . 12 1 1 A 12 12 ALA N N 12 125.900 125.245 0.655 1
1 91 . 12 1 1 A 13 13 ASN H H 13 8.440 8.781 -0.341 1
1 92 . 12 1 1 A 13 13 ASN HA H 13 4.660 4.869 -0.209 1
1 97 . 12 1 1 A 13 13 ASN C C 13 175.900 175.722 0.178 1
1 98 . 12 1 1 A 13 13 ASN CA C 13 53.200 52.883 0.317 1
1 99 . 12 1 1 A 13 13 ASN CB C 13 38.800 39.368 -0.568 1
1 100 . 12 1 1 A 13 13 ASN N N 13 118.300 118.954 -0.654 1
1 102 . 12 1 1 A 14 14 GLY H H 14 8.370 9.013 -0.643 1
1 103 . 12 1 1 A 14 14 GLY HA2 H 14 3.920 3.942 -0.022 1
1 104 . 12 1 1 A 14 14 GLY HA3 H 14 3.920 3.942 -0.022 1
1 105 . 12 1 1 A 14 14 GLY C C 14 174.000 175.261 -1.261 1
1 106 . 12 1 1 A 14 14 GLY CA C 14 45.200 46.852 -1.652 1
1 107 . 12 1 1 A 14 14 GLY N N 14 109.600 110.489 -0.889 1
1 108 . 12 1 1 A 15 15 ALA H H 15 8.140 7.935 0.205 1
1 109 . 12 1 1 A 15 15 ALA HA H 15 4.280 4.073 0.207 1
1 113 . 12 1 1 A 15 15 ALA C C 15 177.300 177.681 -0.381 1
1 114 . 12 1 1 A 15 15 ALA CA C 15 52.500 54.788 -2.288 1
1 115 . 12 1 1 A 15 15 ALA CB C 15 19.100 19.402 -0.302 1
1 116 . 12 1 1 A 15 15 ALA N N 15 123.800 121.750 2.050 1
1 117 . 12 1 1 A 16 16 ALA H H 16 8.030 7.794 0.236 1
1 118 . 12 1 1 A 16 16 ALA HA H 16 4.280 4.747 -0.467 1
1 122 . 12 1 1 A 16 16 ALA C C 16 178.400 177.652 0.748 1
1 123 . 12 1 1 A 16 16 ALA CA C 16 52.600 50.440 2.160 1
1 124 . 12 1 1 A 16 16 ALA CB C 16 19.100 21.848 -2.748 1
1 125 . 12 1 1 A 16 16 ALA N N 16 122.300 118.963 3.337 1
1 126 . 12 1 1 A 17 17 GLY H H 17 8.320 8.862 -0.542 1
1 127 . 12 1 1 A 17 17 GLY HA2 H 17 3.960 3.918 0.042 1
1 128 . 12 1 1 A 17 17 GLY HA3 H 17 3.960 3.918 0.042 1
1 129 . 12 1 1 A 17 17 GLY C C 17 174.500 175.502 -1.002 1
1 130 . 12 1 1 A 17 17 GLY CA C 17 45.200 46.274 -1.074 1
1 131 . 12 1 1 A 17 17 GLY N N 17 107.800 113.113 -5.313 1
1 132 . 12 1 1 A 18 18 THR H H 18 7.970 7.736 0.234 1
1 133 . 12 1 1 A 18 18 THR HA H 18 4.290 4.021 0.269 1
1 138 . 12 1 1 A 18 18 THR C C 18 174.600 176.166 -1.566 1
1 139 . 12 1 1 A 18 18 THR CA C 18 62.000 66.417 -4.417 1
1 140 . 12 1 1 A 18 18 THR CB C 18 69.700 68.341 1.359 1
1 142 . 12 1 1 A 18 18 THR N N 18 113.800 114.009 -0.209 1
1 143 . 12 1 1 A 19 19 LYS H H 19 8.350 8.481 -0.131 1
1 144 . 12 1 1 A 19 19 LYS HA H 19 4.270 4.148 0.122 1
1 153 . 12 1 1 A 19 19 LYS C C 19 176.600 176.499 0.101 1
1 154 . 12 1 1 A 19 19 LYS CA C 19 56.500 58.567 -2.067 1
1 155 . 12 1 1 A 19 19 LYS CB C 19 32.800 32.194 0.606 1
1 159 . 12 1 1 A 19 19 LYS N N 19 124.000 119.630 4.370 1
1 160 . 12 1 1 A 20 20 VAL H H 20 8.060 7.797 0.263 1
1 161 . 12 1 1 A 20 20 VAL HA H 20 3.990 4.240 -0.250 1
1 169 . 12 1 1 A 20 20 VAL C C 20 175.900 175.292 0.608 1
1 170 . 12 1 1 A 20 20 VAL CA C 20 62.400 62.062 0.338 1
1 171 . 12 1 1 A 20 20 VAL CB C 20 32.600 31.177 1.423 1
1 174 . 12 1 1 A 20 20 VAL N N 20 121.700 119.782 1.918 1
1 175 . 12 1 1 A 21 21 ALA H H 21 8.310 8.298 0.012 1
1 176 . 12 1 1 A 21 21 ALA HA H 21 4.290 4.533 -0.243 1
1 180 . 12 1 1 A 21 21 ALA C C 21 177.600 178.175 -0.575 1
1 181 . 12 1 1 A 21 21 ALA CA C 21 52.400 53.312 -0.912 1
1 182 . 12 1 1 A 21 21 ALA CB C 21 19.000 21.284 -2.284 1
1 183 . 12 1 1 A 21 21 ALA N N 21 127.700 128.306 -0.606 1
1 184 . 12 1 1 A 22 22 LEU H H 22 8.150 8.054 0.096 1
1 185 . 12 1 1 A 22 22 LEU HA H 22 4.280 4.126 0.154 1
1 195 . 12 1 1 A 22 22 LEU C C 22 177.400 177.822 -0.422 1
1 196 . 12 1 1 A 22 22 LEU CA C 22 55.200 57.439 -2.239 1
1 197 . 12 1 1 A 22 22 LEU CB C 22 42.200 42.306 -0.106 1
1 201 . 12 1 1 A 22 22 LEU N N 22 121.800 118.224 3.576 1
1 202 . 12 1 1 A 23 23 ARG H H 23 8.240 7.978 0.262 1
1 203 . 12 1 1 A 23 23 ARG HA H 23 4.290 4.611 -0.321 1
1 211 . 12 1 1 A 23 23 ARG C C 23 176.300 176.119 0.181 1
1 212 . 12 1 1 A 23 23 ARG CA C 23 56.000 55.130 0.870 1
1 213 . 12 1 1 A 23 23 ARG CB C 23 30.600 28.162 2.438 1
1 216 . 12 1 1 A 23 23 ARG N N 23 122.000 116.664 5.336 1
1 218 . 12 1 1 A 24 24 LYS H H 24 8.370 7.904 0.466 1
1 219 . 12 1 1 A 24 24 LYS HA H 24 4.330 4.345 -0.015 1
1 228 . 12 1 1 A 24 24 LYS C C 24 176.800 176.774 0.026 1
1 229 . 12 1 1 A 24 24 LYS CA C 24 56.400 57.629 -1.229 1
1 230 . 12 1 1 A 24 24 LYS CB C 24 32.700 33.427 -0.727 1
1 234 . 12 1 1 A 24 24 LYS N N 24 122.900 120.428 2.472 1
1 235 . 12 1 1 A 25 25 THR H H 25 8.100 7.562 0.538 1
1 236 . 12 1 1 A 25 25 THR HA H 25 4.290 4.324 -0.034 1
1 241 . 12 1 1 A 25 25 THR C C 25 174.600 174.447 0.153 1
1 242 . 12 1 1 A 25 25 THR CA C 25 61.500 62.757 -1.257 1
1 243 . 12 1 1 A 25 25 THR CB C 25 69.800 69.521 0.279 1
1 245 . 12 1 1 A 25 25 THR N N 25 115.500 115.009 0.491 1
1 246 . 12 1 1 A 26 26 LYS H H 26 8.370 8.765 -0.395 1
1 247 . 12 1 1 A 26 26 LYS HA H 26 4.270 4.472 -0.202 1
1 256 . 12 1 1 A 26 26 LYS C C 26 176.600 176.690 -0.090 1
1 257 . 12 1 1 A 26 26 LYS CA C 26 56.600 54.947 1.653 1
1 258 . 12 1 1 A 26 26 LYS CB C 26 32.700 33.669 -0.969 1
1 262 . 12 1 1 A 26 26 LYS N N 26 123.700 125.317 -1.617 1
1 263 . 12 1 1 A 27 27 GLN H H 27 8.390 8.700 -0.310 1
1 264 . 12 1 1 A 27 27 GLN HA H 27 4.240 4.613 -0.373 1
1 271 . 12 1 1 A 27 27 GLN C C 27 175.900 176.213 -0.313 1
1 272 . 12 1 1 A 27 27 GLN CA C 27 56.100 56.048 0.052 1
1 273 . 12 1 1 A 27 27 GLN CB C 27 29.300 30.635 -1.335 1
1 275 . 12 1 1 A 27 27 GLN N N 27 121.700 118.566 3.134 1
1 277 . 12 1 1 A 28 28 ALA H H 28 8.330 7.697 0.633 1
1 278 . 12 1 1 A 28 28 ALA HA H 28 4.240 4.583 -0.343 1
1 282 . 12 1 1 A 28 28 ALA C C 28 177.700 177.765 -0.065 1
1 283 . 12 1 1 A 28 28 ALA CA C 28 52.500 51.213 1.287 1
1 284 . 12 1 1 A 28 28 ALA CB C 28 19.100 21.791 -2.691 1
1 285 . 12 1 1 A 28 28 ALA N N 28 125.400 120.289 5.111 1
1 286 . 12 1 1 A 29 29 ALA H H 29 8.250 9.041 -0.791 1
1 287 . 12 1 1 A 29 29 ALA HA H 29 4.230 3.969 0.261 1
1 291 . 12 1 1 A 29 29 ALA C C 29 178.000 179.883 -1.883 1
1 292 . 12 1 1 A 29 29 ALA CA C 29 52.500 55.385 -2.885 1
1 293 . 12 1 1 A 29 29 ALA CB C 29 19.100 18.390 0.710 1
1 294 . 12 1 1 A 29 29 ALA N N 29 123.000 126.626 -3.626 1
1 295 . 12 1 1 A 30 30 GLU H H 30 8.260 8.688 -0.428 1
1 296 . 12 1 1 A 30 30 GLU HA H 30 4.220 4.103 0.117 1
1 301 . 12 1 1 A 30 30 GLU C C 30 176.500 178.169 -1.669 1
1 302 . 12 1 1 A 30 30 GLU CA C 30 56.400 58.564 -2.164 1
1 303 . 12 1 1 A 30 30 GLU CB C 30 29.500 28.204 1.296 1
1 305 . 12 1 1 A 30 30 GLU N N 30 119.700 115.799 3.901 1
1 306 . 12 1 1 A 31 31 LYS H H 31 8.230 7.946 0.284 1
1 307 . 12 1 1 A 31 31 LYS HA H 31 4.280 4.322 -0.042 1
1 316 . 12 1 1 A 31 31 LYS C C 31 176.500 177.170 -0.670 1
1 317 . 12 1 1 A 31 31 LYS CA C 31 56.400 58.114 -1.714 1
1 318 . 12 1 1 A 31 31 LYS CB C 31 32.800 33.317 -0.517 1
1 322 . 12 1 1 A 31 31 LYS N N 31 122.700 119.341 3.359 1
1 323 . 12 1 1 A 32 32 ILE H H 32 8.140 7.323 0.817 1
1 324 . 12 1 1 A 32 32 ILE HA H 32 4.110 4.058 0.052 1
1 334 . 12 1 1 A 32 32 ILE C C 32 176.400 176.260 0.140 1
1 335 . 12 1 1 A 32 32 ILE CA C 32 61.200 62.243 -1.043 1
1 336 . 12 1 1 A 32 32 ILE CB C 32 38.600 37.380 1.220 1
1 340 . 12 1 1 A 32 32 ILE N N 32 122.300 119.174 3.126 1
1 341 . 12 1 1 A 33 33 SER H H 33 8.230 8.971 -0.741 1
1 342 . 12 1 1 A 33 33 SER HA H 33 4.400 3.980 0.420 1
1 345 . 12 1 1 A 33 33 SER C C 33 174.800 176.695 -1.895 1
1 346 . 12 1 1 A 33 33 SER CA C 33 58.300 62.127 -3.827 1
1 347 . 12 1 1 A 33 33 SER CB C 33 63.700 62.792 0.908 1
1 348 . 12 1 1 A 33 33 SER N N 33 119.600 123.021 -3.421 1
1 349 . 12 1 1 A 34 34 ALA H H 34 8.430 8.312 0.118 1
1 350 . 12 1 1 A 34 34 ALA HA H 34 4.220 4.114 0.106 1
1 354 . 12 1 1 A 34 34 ALA C C 34 179.500 179.965 -0.465 1
1 355 . 12 1 1 A 34 34 ALA CA C 34 53.500 55.117 -1.617 1
1 356 . 12 1 1 A 34 34 ALA CB C 34 18.800 18.034 0.766 1
1 357 . 12 1 1 A 34 34 ALA N N 34 126.000 123.655 2.345 1
1 358 . 12 1 1 A 35 35 ASP H H 35 8.380 7.664 0.716 1
1 359 . 12 1 1 A 35 35 ASP HA H 35 4.520 4.430 0.090 1
1 362 . 12 1 1 A 35 35 ASP C C 35 176.500 178.391 -1.891 1
1 363 . 12 1 1 A 35 35 ASP CA C 35 54.800 56.413 -1.613 1
1 364 . 12 1 1 A 35 35 ASP CB C 35 40.200 40.753 -0.553 1
1 365 . 12 1 1 A 35 35 ASP N N 35 118.200 118.688 -0.488 1
1 366 . 12 1 1 A 36 36 LYS H H 36 8.000 7.825 0.175 1
1 367 . 12 1 1 A 36 36 LYS HA H 36 4.270 4.093 0.177 1
1 376 . 12 1 1 A 36 36 LYS C C 36 177.000 177.311 -0.311 1
1 377 . 12 1 1 A 36 36 LYS CA C 36 56.800 58.615 -1.815 1
1 378 . 12 1 1 A 36 36 LYS CB C 36 32.900 31.870 1.030 1
1 382 . 12 1 1 A 36 36 LYS N N 36 120.900 118.334 2.566 1
1 383 . 12 1 1 A 37 37 ILE H H 37 7.970 7.256 0.714 1
1 384 . 12 1 1 A 37 37 ILE HA H 37 4.020 4.169 -0.149 1
1 394 . 12 1 1 A 37 37 ILE C C 37 176.100 175.271 0.829 1
1 395 . 12 1 1 A 37 37 ILE CA C 37 61.300 61.882 -0.582 1
1 396 . 12 1 1 A 37 37 ILE CB C 37 38.100 37.613 0.487 1
1 400 . 12 1 1 A 37 37 ILE N N 37 121.800 120.969 0.831 1
1 401 . 12 1 1 A 38 38 SER H H 38 7.980 8.522 -0.542 1
1 402 . 12 1 1 A 38 38 SER HA H 38 4.540 4.635 -0.095 1
1 405 . 12 1 1 A 38 38 SER C C 38 174.700 175.562 -0.862 1
1 406 . 12 1 1 A 38 38 SER CA C 38 58.200 57.729 0.471 1
1 407 . 12 1 1 A 38 38 SER CB C 38 64.400 64.448 -0.048 1
1 408 . 12 1 1 A 38 38 SER N N 38 119.000 124.307 -5.307 1
1 409 . 12 1 1 A 39 39 LYS H H 39 8.690 9.042 -0.352 1
1 410 . 12 1 1 A 39 39 LYS HA H 39 3.400 3.679 -0.279 1
1 419 . 12 1 1 A 39 39 LYS C C 39 177.400 178.050 -0.650 1
1 420 . 12 1 1 A 39 39 LYS CA C 39 59.800 60.402 -0.602 1
1 421 . 12 1 1 A 39 39 LYS CB C 39 32.400 32.316 0.084 1
1 425 . 12 1 1 A 39 39 LYS N N 39 124.200 124.692 -0.492 1
1 426 . 12 1 1 A 40 40 GLU H H 40 8.280 8.350 -0.070 1
1 427 . 12 1 1 A 40 40 GLU HA H 40 3.840 4.032 -0.192 1
1 432 . 12 1 1 A 40 40 GLU C C 40 178.400 178.778 -0.378 1
1 433 . 12 1 1 A 40 40 GLU CA C 40 59.400 59.202 0.198 1
1 434 . 12 1 1 A 40 40 GLU CB C 40 28.300 29.440 -1.140 1
1 436 . 12 1 1 A 40 40 GLU N N 40 116.300 117.382 -1.082 1
1 437 . 12 1 1 A 41 41 ALA H H 41 7.890 7.875 0.015 1
1 438 . 12 1 1 A 41 41 ALA HA H 41 3.910 4.269 -0.359 1
1 442 . 12 1 1 A 41 41 ALA C C 41 179.900 179.345 0.555 1
1 443 . 12 1 1 A 41 41 ALA CA C 41 54.700 55.089 -0.389 1
1 444 . 12 1 1 A 41 41 ALA CB C 41 17.900 17.985 -0.085 1
1 445 . 12 1 1 A 41 41 ALA N N 41 122.300 122.213 0.087 1
1 446 . 12 1 1 A 42 42 LEU H H 42 7.490 7.621 -0.131 1
1 447 . 12 1 1 A 42 42 LEU HA H 42 3.480 3.759 -0.279 1
1 457 . 12 1 1 A 42 42 LEU C C 42 178.900 178.490 0.410 1
1 458 . 12 1 1 A 42 42 LEU CA C 42 59.800 57.451 2.349 1
1 459 . 12 1 1 A 42 42 LEU CB C 42 42.300 41.443 0.857 1
1 463 . 12 1 1 A 42 42 LEU N N 42 121.000 119.334 1.666 1
1 464 . 12 1 1 A 43 43 LEU H H 43 8.290 8.017 0.273 1
1 465 . 12 1 1 A 43 43 LEU HA H 43 3.780 3.834 -0.054 1
1 475 . 12 1 1 A 43 43 LEU C C 43 179.400 179.097 0.303 1
1 476 . 12 1 1 A 43 43 LEU CA C 43 57.600 58.023 -0.423 1
1 477 . 12 1 1 A 43 43 LEU CB C 43 40.900 41.415 -0.515 1
1 481 . 12 1 1 A 43 43 LEU N N 43 119.200 118.125 1.075 1
1 482 . 12 1 1 A 44 44 GLU H H 44 8.330 8.709 -0.379 1
1 483 . 12 1 1 A 44 44 GLU HA H 44 4.050 3.987 0.063 1
1 488 . 12 1 1 A 44 44 GLU C C 44 178.600 178.418 0.182 1
1 489 . 12 1 1 A 44 44 GLU CA C 44 58.900 59.270 -0.370 1
1 490 . 12 1 1 A 44 44 GLU CB C 44 28.300 28.941 -0.641 1
1 492 . 12 1 1 A 44 44 GLU N N 44 119.600 117.321 2.279 1
1 493 . 12 1 1 A 45 45 CYS H H 45 7.690 7.686 0.004 1
1 494 . 12 1 1 A 45 45 CYS HA H 45 4.120 4.032 0.088 1
1 497 . 12 1 1 A 45 45 CYS C C 45 176.100 176.663 -0.563 1
1 498 . 12 1 1 A 45 45 CYS CA C 45 62.500 63.333 -0.833 1
1 499 . 12 1 1 A 45 45 CYS CB C 45 26.200 27.109 -0.909 1
1 500 . 12 1 1 A 45 45 CYS N N 45 120.900 118.633 2.267 1
1 501 . 12 1 1 A 46 46 ALA H H 46 8.540 8.214 0.326 1
1 502 . 12 1 1 A 46 46 ALA HA H 46 3.900 3.933 -0.033 1
1 506 . 12 1 1 A 46 46 ALA C C 46 179.200 178.764 0.436 1
1 507 . 12 1 1 A 46 46 ALA CA C 46 55.500 55.498 0.002 1
1 508 . 12 1 1 A 46 46 ALA CB C 46 16.800 17.673 -0.873 1
1 509 . 12 1 1 A 46 46 ALA N N 46 121.500 122.101 -0.601 1
1 510 . 12 1 1 A 47 47 ASP H H 47 8.460 8.082 0.378 1
1 511 . 12 1 1 A 47 47 ASP HA H 47 4.340 4.413 -0.073 1
1 514 . 12 1 1 A 47 47 ASP C C 47 178.800 178.538 0.262 1
1 515 . 12 1 1 A 47 47 ASP CA C 47 56.600 56.916 -0.316 1
1 516 . 12 1 1 A 47 47 ASP CB C 47 39.800 42.224 -2.424 1
1 517 . 12 1 1 A 47 47 ASP N N 47 119.000 118.402 0.598 1
1 518 . 12 1 1 A 48 48 LEU H H 48 8.040 8.064 -0.024 1
1 519 . 12 1 1 A 48 48 LEU HA H 48 4.110 3.927 0.183 1
1 529 . 12 1 1 A 48 48 LEU C C 48 180.000 179.722 0.278 1
1 530 . 12 1 1 A 48 48 LEU CA C 48 58.000 58.245 -0.245 1
1 531 . 12 1 1 A 48 48 LEU CB C 48 41.700 41.460 0.240 1
1 535 . 12 1 1 A 48 48 LEU N N 48 123.000 119.429 3.571 1
1 536 . 12 1 1 A 49 49 LEU H H 49 8.300 7.880 0.420 1
1 537 . 12 1 1 A 49 49 LEU HA H 49 4.110 3.963 0.147 1
1 547 . 12 1 1 A 49 49 LEU C C 49 177.200 178.924 -1.724 1
1 548 . 12 1 1 A 49 49 LEU CA C 49 57.600 57.862 -0.262 1
1 549 . 12 1 1 A 49 49 LEU CB C 49 41.200 41.596 -0.396 1
1 553 . 12 1 1 A 49 49 LEU N N 49 120.900 120.205 0.695 1
1 554 . 12 1 1 A 50 50 SER H H 50 8.660 7.910 0.750 1
1 555 . 12 1 1 A 50 50 SER HA H 50 4.000 4.208 -0.208 1
1 558 . 12 1 1 A 50 50 SER C C 50 176.800 176.656 0.144 1
1 559 . 12 1 1 A 50 50 SER CA C 50 62.500 61.788 0.712 1
1 560 . 12 1 1 A 50 50 SER CB C 50 62.600 62.141 0.459 1
1 561 . 12 1 1 A 50 50 SER N N 50 113.300 113.267 0.033 1
1 562 . 12 1 1 A 51 51 SER H H 51 7.980 8.104 -0.124 1
1 563 . 12 1 1 A 51 51 SER HA H 51 4.220 4.101 0.119 1
1 566 . 12 1 1 A 51 51 SER C C 51 176.300 177.394 -1.094 1
1 567 . 12 1 1 A 51 51 SER CA C 51 61.200 61.573 -0.373 1
1 568 . 12 1 1 A 51 51 SER CB C 51 62.700 62.858 -0.158 1
1 569 . 12 1 1 A 51 51 SER N N 51 115.900 117.120 -1.220 1
1 570 . 12 1 1 A 52 52 ALA H H 52 8.030 8.195 -0.165 1
1 571 . 12 1 1 A 52 52 ALA HA H 52 4.130 4.217 -0.087 1
1 575 . 12 1 1 A 52 52 ALA C C 52 178.500 180.548 -2.048 1
1 576 . 12 1 1 A 52 52 ALA CA C 52 54.500 54.991 -0.491 1
1 577 . 12 1 1 A 52 52 ALA CB C 52 18.000 18.251 -0.251 1
1 578 . 12 1 1 A 52 52 ALA N N 52 125.400 123.298 2.102 1
1 579 . 12 1 1 A 53 53 LEU H H 53 7.710 8.348 -0.638 1
1 580 . 12 1 1 A 53 53 LEU HA H 53 4.180 4.075 0.105 1
1 590 . 12 1 1 A 53 53 LEU C C 53 177.700 178.219 -0.519 1
1 591 . 12 1 1 A 53 53 LEU CA C 53 56.500 57.428 -0.928 1
1 592 . 12 1 1 A 53 53 LEU CB C 53 42.400 41.764 0.636 1
1 596 . 12 1 1 A 53 53 LEU N N 53 113.800 118.839 -5.039 1
1 597 . 12 1 1 A 54 54 THR H H 54 7.550 7.347 0.203 1
1 598 . 12 1 1 A 54 54 THR HA H 54 4.420 4.357 0.063 1
1 603 . 12 1 1 A 54 54 THR C C 54 174.100 173.578 0.522 1
1 604 . 12 1 1 A 54 54 THR CA C 54 61.600 62.047 -0.447 1
1 605 . 12 1 1 A 54 54 THR CB C 54 69.300 69.581 -0.281 1
1 607 . 12 1 1 A 54 54 THR N N 54 107.700 105.480 2.220 1
1 608 . 12 1 1 A 55 55 GLU H H 55 7.750 7.408 0.342 1
1 609 . 12 1 1 A 55 55 GLU HA H 55 4.760 5.057 -0.297 1
1 614 . 12 1 1 A 55 55 GLU CA C 55 53.400 53.725 -0.325 1
1 615 . 12 1 1 A 55 55 GLU CB C 55 30.100 32.223 -2.123 1
1 617 . 12 1 1 A 55 55 GLU N N 55 122.800 118.913 3.887 1
1 618 . 12 1 1 A 56 56 PRO HA H 56 4.670 4.832 -0.162 1
1 625 . 12 1 1 A 56 56 PRO C C 56 176.200 176.399 -0.199 1
1 626 . 12 1 1 A 56 56 PRO CA C 56 62.900 62.554 0.346 1
1 627 . 12 1 1 A 56 56 PRO CB C 56 29.200 31.659 -2.459 1
1 630 . 12 1 1 A 57 57 VAL H H 57 8.010 8.372 -0.362 1
1 631 . 12 1 1 A 57 57 VAL HA H 57 4.590 4.932 -0.342 1
1 639 . 12 1 1 A 57 57 VAL CA C 57 58.600 58.291 0.309 1
1 640 . 12 1 1 A 57 57 VAL CB C 57 32.800 34.860 -2.060 1
1 643 . 12 1 1 A 57 57 VAL N N 57 121.400 117.679 3.721 1
1 644 . 12 1 1 A 58 58 PRO HA H 58 4.450 5.128 -0.678 1
1 651 . 12 1 1 A 58 58 PRO C C 58 177.500 177.886 -0.386 1
1 652 . 12 1 1 A 58 58 PRO CA C 58 62.600 62.845 -0.245 1
1 653 . 12 1 1 A 58 58 PRO CB C 58 32.200 32.159 0.041 1
1 656 . 12 1 1 A 59 59 ASN H H 59 8.890 8.835 0.055 1
1 657 . 12 1 1 A 59 59 ASN HA H 59 4.330 4.398 -0.068 1
1 662 . 12 1 1 A 59 59 ASN C C 59 177.600 177.639 -0.039 1
1 663 . 12 1 1 A 59 59 ASN CA C 59 56.300 56.582 -0.282 1
1 664 . 12 1 1 A 59 59 ASN CB C 59 38.400 38.399 0.001 1
1 665 . 12 1 1 A 59 59 ASN N N 59 122.200 121.976 0.224 1
1 667 . 12 1 1 A 60 60 SER H H 60 8.660 8.098 0.562 1
1 668 . 12 1 1 A 60 60 SER HA H 60 4.010 4.108 -0.098 1
1 671 . 12 1 1 A 60 60 SER C C 60 176.200 176.012 0.188 1
1 672 . 12 1 1 A 60 60 SER CA C 60 60.800 61.662 -0.862 1
1 673 . 12 1 1 A 60 60 SER CB C 60 61.500 62.927 -1.427 1
1 674 . 12 1 1 A 60 60 SER N N 60 113.200 116.078 -2.878 1
1 675 . 12 1 1 A 61 61 GLN H H 61 7.420 7.724 -0.304 1
1 676 . 12 1 1 A 61 61 GLN HA H 61 4.280 4.065 0.215 1
1 683 . 12 1 1 A 61 61 GLN C C 61 178.600 178.539 0.061 1
1 684 . 12 1 1 A 61 61 GLN CA C 61 57.900 58.891 -0.991 1
1 685 . 12 1 1 A 61 61 GLN CB C 61 28.600 28.220 0.380 1
1 687 . 12 1 1 A 61 61 GLN N N 61 122.200 120.885 1.315 1
1 689 . 12 1 1 A 62 62 LEU H H 62 7.430 7.926 -0.496 1
1 690 . 12 1 1 A 62 62 LEU HA H 62 3.850 4.086 -0.236 1
1 700 . 12 1 1 A 62 62 LEU C C 62 178.800 178.950 -0.150 1
1 701 . 12 1 1 A 62 62 LEU CA C 62 57.900 58.101 -0.201 1
1 702 . 12 1 1 A 62 62 LEU CB C 62 42.100 42.185 -0.085 1
1 706 . 12 1 1 A 62 62 LEU N N 62 120.600 119.983 0.617 1
1 707 . 12 1 1 A 63 63 VAL H H 63 8.200 8.147 0.053 1
1 708 . 12 1 1 A 63 63 VAL HA H 63 3.370 3.492 -0.122 1
1 716 . 12 1 1 A 63 63 VAL C C 63 178.000 178.031 -0.031 1
1 717 . 12 1 1 A 63 63 VAL CA C 63 66.600 66.963 -0.363 1
1 718 . 12 1 1 A 63 63 VAL CB C 63 31.700 31.078 0.622 1
1 721 . 12 1 1 A 63 63 VAL N N 63 118.200 117.621 0.579 1
1 722 . 12 1 1 A 64 64 ASP H H 64 7.960 8.064 -0.104 1
1 723 . 12 1 1 A 64 64 ASP HA H 64 4.460 4.375 0.085 1
1 726 . 12 1 1 A 64 64 ASP C C 64 178.100 178.571 -0.471 1
1 727 . 12 1 1 A 64 64 ASP CA C 64 57.700 57.492 0.208 1
1 728 . 12 1 1 A 64 64 ASP CB C 64 39.800 41.277 -1.477 1
1 729 . 12 1 1 A 64 64 ASP N N 64 120.200 120.189 0.011 1
1 730 . 12 1 1 A 65 65 THR H H 65 8.380 8.630 -0.250 1
1 731 . 12 1 1 A 65 65 THR HA H 65 3.970 4.060 -0.090 1
1 736 . 12 1 1 A 65 65 THR C C 65 176.500 177.219 -0.719 1
1 737 . 12 1 1 A 65 65 THR CA C 65 66.500 66.566 -0.066 1
1 738 . 12 1 1 A 65 65 THR CB C 65 67.800 67.992 -0.192 1
1 740 . 12 1 1 A 65 65 THR N N 65 118.100 115.884 2.216 1
1 741 . 12 1 1 A 66 66 GLY H H 66 8.900 8.612 0.288 1
1 742 . 12 1 1 A 66 66 GLY HA2 H 66 3.630 3.691 -0.061 1
1 743 . 12 1 1 A 66 66 GLY HA3 H 66 3.630 3.695 -0.065 1
1 744 . 12 1 1 A 66 66 GLY C C 66 174.200 175.647 -1.447 1
1 745 . 12 1 1 A 66 66 GLY CA C 66 47.500 47.295 0.205 1
1 746 . 12 1 1 A 66 66 GLY N N 66 110.500 107.495 3.005 1
1 747 . 12 1 1 A 67 67 HIS H H 67 8.650 8.263 0.387 1
1 748 . 12 1 1 A 67 67 HIS HA H 67 4.220 4.141 0.079 1
1 752 . 12 1 1 A 67 67 HIS C C 67 176.900 177.501 -0.601 1
1 753 . 12 1 1 A 67 67 HIS CA C 67 59.000 59.102 -0.102 1
1 754 . 12 1 1 A 67 67 HIS CB C 67 27.800 29.512 -1.712 1
1 756 . 12 1 1 A 67 67 HIS N N 67 120.100 122.039 -1.939 1
1 757 . 12 1 1 A 68 68 GLN H H 68 7.860 8.123 -0.263 1
1 758 . 12 1 1 A 68 68 GLN HA H 68 3.990 3.989 0.001 1
1 765 . 12 1 1 A 68 68 GLN C C 68 177.800 178.082 -0.282 1
1 766 . 12 1 1 A 68 68 GLN CA C 68 58.800 58.463 0.337 1
1 767 . 12 1 1 A 68 68 GLN CB C 68 28.200 28.362 -0.162 1
1 769 . 12 1 1 A 68 68 GLN N N 68 121.400 116.578 4.822 1
1 771 . 12 1 1 A 69 69 LEU H H 69 8.300 7.955 0.345 1
1 772 . 12 1 1 A 69 69 LEU HA H 69 4.330 4.284 0.046 1
1 782 . 12 1 1 A 69 69 LEU C C 69 179.300 179.976 -0.676 1
1 783 . 12 1 1 A 69 69 LEU CA C 69 58.200 58.217 -0.017 1
1 784 . 12 1 1 A 69 69 LEU CB C 69 40.500 40.821 -0.321 1
1 788 . 12 1 1 A 69 69 LEU N N 69 120.300 121.581 -1.281 1
1 789 . 12 1 1 A 70 70 LEU H H 70 8.460 7.912 0.548 1
1 790 . 12 1 1 A 70 70 LEU HA H 70 3.880 3.940 -0.060 1
1 800 . 12 1 1 A 70 70 LEU C C 70 179.100 179.295 -0.195 1
1 801 . 12 1 1 A 70 70 LEU CA C 70 58.300 58.053 0.247 1
1 802 . 12 1 1 A 70 70 LEU CB C 70 41.500 40.450 1.050 1
1 806 . 12 1 1 A 70 70 LEU N N 70 121.200 120.469 0.731 1
1 807 . 12 1 1 A 71 71 ASP H H 71 8.140 7.948 0.192 1
1 808 . 12 1 1 A 71 71 ASP HA H 71 4.420 4.247 0.173 1
1 811 . 12 1 1 A 71 71 ASP C C 71 180.000 178.162 1.838 1
1 812 . 12 1 1 A 71 71 ASP CA C 71 57.300 57.174 0.126 1
1 813 . 12 1 1 A 71 71 ASP CB C 71 39.300 40.890 -1.590 1
1 814 . 12 1 1 A 71 71 ASP N N 71 121.100 119.511 1.589 1
1 815 . 12 1 1 A 72 72 TYR H H 72 8.320 8.009 0.311 1
1 816 . 12 1 1 A 72 72 TYR HA H 72 4.550 4.486 0.064 1
1 823 . 12 1 1 A 72 72 TYR C C 72 179.100 178.649 0.451 1
1 824 . 12 1 1 A 72 72 TYR CA C 72 60.500 60.850 -0.350 1
1 825 . 12 1 1 A 72 72 TYR CB C 72 37.600 38.116 -0.516 1
1 828 . 12 1 1 A 72 72 TYR N N 72 120.300 118.251 2.049 1
1 829 . 12 1 1 A 73 73 CYS H H 73 8.850 8.596 0.254 1
1 830 . 12 1 1 A 73 73 CYS HA H 73 4.380 4.563 -0.183 1
1 834 . 12 1 1 A 73 73 CYS C C 73 177.300 177.266 0.034 1
1 835 . 12 1 1 A 73 73 CYS CA C 73 64.400 63.368 1.032 1
1 836 . 12 1 1 A 73 73 CYS CB C 73 27.600 26.343 1.257 1
1 837 . 12 1 1 A 73 73 CYS N N 73 116.800 118.638 -1.838 1
1 838 . 12 1 1 A 74 74 SER H H 74 8.410 8.510 -0.100 1
1 839 . 12 1 1 A 74 74 SER HA H 74 4.290 4.248 0.042 1
1 842 . 12 1 1 A 74 74 SER C C 74 176.300 176.849 -0.549 1
1 843 . 12 1 1 A 74 74 SER CA C 74 61.400 61.140 0.260 1
1 844 . 12 1 1 A 74 74 SER CB C 74 62.600 62.974 -0.374 1
1 845 . 12 1 1 A 74 74 SER N N 74 115.900 116.083 -0.183 1
1 846 . 12 1 1 A 75 75 GLY H H 75 7.790 8.087 -0.297 1
1 847 . 12 1 1 A 75 75 GLY HA2 H 75 4.320 3.718 0.602 1
1 848 . 12 1 1 A 75 75 GLY HA3 H 75 3.900 3.741 0.159 1
1 849 . 12 1 1 A 75 75 GLY C C 75 174.600 175.264 -0.664 1
1 850 . 12 1 1 A 75 75 GLY CA C 75 45.600 46.995 -1.395 1
1 851 . 12 1 1 A 75 75 GLY N N 75 107.500 107.368 0.132 1
1 852 . 12 1 1 A 76 76 TYR H H 76 8.040 8.495 -0.455 1
1 853 . 12 1 1 A 76 76 TYR HA H 76 4.310 3.987 0.323 1
1 860 . 12 1 1 A 76 76 TYR C C 76 176.200 177.518 -1.318 1
1 861 . 12 1 1 A 76 76 TYR CA C 76 60.000 61.039 -1.039 1
1 862 . 12 1 1 A 76 76 TYR CB C 76 40.700 38.460 2.240 1
1 865 . 12 1 1 A 76 76 TYR N N 76 121.900 123.386 -1.486 1
1 866 . 12 1 1 A 77 77 VAL H H 77 7.540 8.472 -0.932 1
1 867 . 12 1 1 A 77 77 VAL HA H 77 3.450 3.417 0.033 1
1 875 . 12 1 1 A 77 77 VAL C C 77 175.500 176.883 -1.383 1
1 876 . 12 1 1 A 77 77 VAL CA C 77 65.500 64.683 0.817 1
1 877 . 12 1 1 A 77 77 VAL CB C 77 31.600 31.138 0.462 1
1 880 . 12 1 1 A 77 77 VAL N N 77 116.600 119.419 -2.819 1
1 881 . 12 1 1 A 78 78 ASP H H 78 7.580 7.782 -0.202 1
1 882 . 12 1 1 A 78 78 ASP HA H 78 4.380 4.356 0.024 1
1 885 . 12 1 1 A 78 78 ASP C C 78 177.000 177.825 -0.825 1
1 886 . 12 1 1 A 78 78 ASP CA C 78 55.800 56.619 -0.819 1
1 887 . 12 1 1 A 78 78 ASP CB C 78 39.900 40.502 -0.602 1
1 888 . 12 1 1 A 78 78 ASP N N 78 116.400 120.454 -4.054 1
1 889 . 12 1 1 A 79 79 CYS H H 79 8.040 7.310 0.730 1
1 890 . 12 1 1 A 79 79 CYS HA H 79 4.110 4.279 -0.169 1
1 893 . 12 1 1 A 79 79 CYS C C 79 174.200 174.614 -0.414 1
1 894 . 12 1 1 A 79 79 CYS CA C 79 58.600 60.539 -1.939 1
1 895 . 12 1 1 A 79 79 CYS CB C 79 27.200 27.987 -0.787 1
1 896 . 12 1 1 A 79 79 CYS N N 79 117.000 116.772 0.228 1
1 897 . 12 1 1 A 80 80 ILE H H 80 6.960 6.886 0.074 1
1 898 . 12 1 1 A 80 80 ILE HA H 80 4.120 4.046 0.074 1
1 908 . 12 1 1 A 80 80 ILE CA C 80 58.700 60.006 -1.306 1
1 909 . 12 1 1 A 80 80 ILE CB C 80 38.500 38.132 0.368 1
1 913 . 12 1 1 A 80 80 ILE N N 80 123.200 122.152 1.048 1
1 914 . 12 1 1 A 81 81 PRO HA H 81 4.340 4.537 -0.197 1
1 921 . 12 1 1 A 81 81 PRO C C 81 178.000 176.317 1.683 1
1 922 . 12 1 1 A 81 81 PRO CA C 81 64.700 64.284 0.416 1
1 923 . 12 1 1 A 81 81 PRO CB C 81 32.600 31.775 0.825 1
1 926 . 12 1 1 A 82 82 GLN H H 82 7.560 8.107 -0.547 1
1 927 . 12 1 1 A 82 82 GLN HA H 82 4.600 4.531 0.069 1
1 934 . 12 1 1 A 82 82 GLN C C 82 177.400 176.067 1.333 1
1 935 . 12 1 1 A 82 82 GLN CA C 82 55.600 55.108 0.492 1
1 936 . 12 1 1 A 82 82 GLN CB C 82 28.800 29.137 -0.337 1
1 938 . 12 1 1 A 82 82 GLN N N 82 115.900 119.404 -3.504 1
1 940 . 12 1 1 A 83 83 THR H H 83 8.880 8.585 0.295 1
1 941 . 12 1 1 A 83 83 THR HA H 83 3.750 3.906 -0.156 1
1 946 . 12 1 1 A 83 83 THR C C 83 176.300 176.464 -0.164 1
1 947 . 12 1 1 A 83 83 THR CA C 83 66.500 66.294 0.206 1
1 948 . 12 1 1 A 83 83 THR CB C 83 68.700 68.827 -0.127 1
1 950 . 12 1 1 A 83 83 THR N N 83 122.700 119.676 3.024 1
1 951 . 12 1 1 A 84 84 ARG H H 84 8.990 8.233 0.757 1
1 952 . 12 1 1 A 84 84 ARG HA H 84 4.250 4.054 0.196 1
1 960 . 12 1 1 A 84 84 ARG C C 84 178.900 178.958 -0.058 1
1 961 . 12 1 1 A 84 84 ARG CA C 84 59.100 59.701 -0.601 1
1 962 . 12 1 1 A 84 84 ARG CB C 84 29.300 30.263 -0.963 1
1 965 . 12 1 1 A 84 84 ARG N N 84 120.100 121.655 -1.555 1
1 967 . 12 1 1 A 85 85 ASN H H 85 7.270 8.368 -1.098 1
1 968 . 12 1 1 A 85 85 ASN HA H 85 4.810 4.645 0.165 1
1 973 . 12 1 1 A 85 85 ASN C C 85 176.800 177.831 -1.031 1
1 974 . 12 1 1 A 85 85 ASN CA C 85 54.800 56.261 -1.461 1
1 975 . 12 1 1 A 85 85 ASN CB C 85 37.600 38.143 -0.543 1
1 976 . 12 1 1 A 85 85 ASN N N 85 117.400 118.236 -0.836 1
1 978 . 12 1 1 A 86 86 LYS H H 86 8.340 8.162 0.178 1
1 979 . 12 1 1 A 86 86 LYS HA H 86 3.890 4.130 -0.240 1
1 988 . 12 1 1 A 86 86 LYS C C 86 178.600 179.155 -0.555 1
1 989 . 12 1 1 A 86 86 LYS CA C 86 60.800 58.856 1.944 1
1 990 . 12 1 1 A 86 86 LYS CB C 86 32.700 32.212 0.488 1
1 994 . 12 1 1 A 86 86 LYS N N 86 124.200 120.924 3.276 1
1 995 . 12 1 1 A 87 87 PHE H H 87 8.120 8.897 -0.777 1
1 996 . 12 1 1 A 87 87 PHE HA H 87 4.260 4.128 0.132 1
1 1004 . 12 1 1 A 87 87 PHE C C 87 178.100 177.905 0.195 1
1 1005 . 12 1 1 A 87 87 PHE CA C 87 61.300 62.065 -0.765 1
1 1006 . 12 1 1 A 87 87 PHE CB C 87 38.200 39.092 -0.892 1
1 1010 . 12 1 1 A 87 87 PHE N N 87 118.300 121.382 -3.082 1
1 1011 . 12 1 1 A 88 88 ALA H H 88 7.860 8.199 -0.339 1
1 1012 . 12 1 1 A 88 88 ALA HA H 88 4.200 4.134 0.066 1
1 1016 . 12 1 1 A 88 88 ALA C C 88 180.600 179.890 0.710 1
1 1017 . 12 1 1 A 88 88 ALA CA C 88 54.900 55.153 -0.253 1
1 1018 . 12 1 1 A 88 88 ALA CB C 88 18.100 17.954 0.146 1
1 1019 . 12 1 1 A 88 88 ALA N N 88 121.700 121.504 0.196 1
1 1020 . 12 1 1 A 89 89 PHE H H 89 8.690 8.371 0.319 1
1 1021 . 12 1 1 A 89 89 PHE HA H 89 4.080 4.099 -0.019 1
1 1029 . 12 1 1 A 89 89 PHE C C 89 176.300 177.559 -1.259 1
1 1030 . 12 1 1 A 89 89 PHE CA C 89 62.000 61.703 0.297 1
1 1031 . 12 1 1 A 89 89 PHE CB C 89 39.800 39.324 0.476 1
1 1035 . 12 1 1 A 89 89 PHE N N 89 120.100 119.912 0.188 1
1 1036 . 12 1 1 A 90 90 ARG H H 90 8.560 8.400 0.160 1
1 1037 . 12 1 1 A 90 90 ARG HA H 90 3.790 3.913 -0.123 1
1 1045 . 12 1 1 A 90 90 ARG C C 90 179.600 178.272 1.328 1
1 1046 . 12 1 1 A 90 90 ARG CA C 90 60.000 59.459 0.541 1
1 1047 . 12 1 1 A 90 90 ARG CB C 90 30.000 29.932 0.068 1
1 1050 . 12 1 1 A 90 90 ARG N N 90 118.000 117.995 0.005 1
1 1052 . 12 1 1 A 91 91 GLU H H 91 8.120 8.266 -0.146 1
1 1053 . 12 1 1 A 91 91 GLU HA H 91 3.980 3.917 0.063 1
1 1058 . 12 1 1 A 91 91 GLU C C 91 178.400 179.031 -0.631 1
1 1059 . 12 1 1 A 91 91 GLU CA C 91 58.900 59.183 -0.283 1
1 1060 . 12 1 1 A 91 91 GLU CB C 91 28.800 29.108 -0.308 1
1 1062 . 12 1 1 A 91 91 GLU N N 91 119.300 117.841 1.459 1
1 1063 . 12 1 1 A 92 92 ALA H H 92 7.820 7.760 0.060 1
1 1064 . 12 1 1 A 92 92 ALA HA H 92 4.050 3.948 0.102 1
1 1068 . 12 1 1 A 92 92 ALA C C 92 179.800 179.786 0.014 1
1 1069 . 12 1 1 A 92 92 ALA CA C 92 55.000 55.122 -0.122 1
1 1070 . 12 1 1 A 92 92 ALA CB C 92 18.000 18.080 -0.080 1
1 1071 . 12 1 1 A 92 92 ALA N N 92 123.400 122.263 1.137 1
1 1072 . 12 1 1 A 93 93 VAL H H 93 8.430 7.940 0.490 1
1 1073 . 12 1 1 A 93 93 VAL HA H 93 3.250 3.237 0.013 1
1 1081 . 12 1 1 A 93 93 VAL C C 93 177.900 178.079 -0.179 1
1 1082 . 12 1 1 A 93 93 VAL CA C 93 66.800 66.778 0.022 1
1 1083 . 12 1 1 A 93 93 VAL CB C 93 31.300 31.333 -0.033 1
1 1086 . 12 1 1 A 93 93 VAL N N 93 119.900 118.526 1.374 1
1 1087 . 12 1 1 A 94 94 SER H H 94 7.990 8.326 -0.336 1
1 1088 . 12 1 1 A 94 94 SER HA H 94 4.230 4.259 -0.029 1
1 1091 . 12 1 1 A 94 94 SER C C 94 177.200 176.542 0.658 1
1 1092 . 12 1 1 A 94 94 SER CA C 94 61.600 62.099 -0.499 1
1 1093 . 12 1 1 A 94 94 SER CB C 94 62.700 62.729 -0.029 1
1 1094 . 12 1 1 A 94 94 SER N N 94 116.000 116.273 -0.273 1
1 1095 . 12 1 1 A 95 95 LYS H H 95 7.710 7.752 -0.042 1
1 1096 . 12 1 1 A 95 95 LYS HA H 95 4.020 4.100 -0.080 1
1 1105 . 12 1 1 A 95 95 LYS C C 95 179.400 178.948 0.452 1
1 1106 . 12 1 1 A 95 95 LYS CA C 95 59.600 59.300 0.300 1
1 1107 . 12 1 1 A 95 95 LYS CB C 95 32.300 32.265 0.035 1
1 1111 . 12 1 1 A 95 95 LYS N N 95 121.400 122.090 -0.690 1
1 1112 . 12 1 1 A 96 96 LEU H H 96 8.270 8.072 0.198 1
1 1113 . 12 1 1 A 96 96 LEU HA H 96 4.040 4.028 0.012 1
1 1123 . 12 1 1 A 96 96 LEU C C 96 177.700 178.225 -0.525 1
1 1124 . 12 1 1 A 96 96 LEU CA C 96 58.600 58.206 0.394 1
1 1125 . 12 1 1 A 96 96 LEU CB C 96 41.000 41.590 -0.590 1
1 1129 . 12 1 1 A 96 96 LEU N N 96 124.800 121.182 3.618 1
1 1130 . 12 1 1 A 97 97 GLU H H 97 8.500 8.330 0.170 1
1 1131 . 12 1 1 A 97 97 GLU HA H 97 3.760 4.081 -0.321 1
1 1136 . 12 1 1 A 97 97 GLU C C 97 179.100 179.412 -0.312 1
1 1137 . 12 1 1 A 97 97 GLU CA C 97 59.900 59.052 0.848 1
1 1138 . 12 1 1 A 97 97 GLU CB C 97 28.700 29.304 -0.604 1
1 1140 . 12 1 1 A 97 97 GLU N N 97 119.000 117.303 1.697 1
1 1141 . 12 1 1 A 98 98 LEU H H 98 7.740 7.899 -0.159 1
1 1142 . 12 1 1 A 98 98 LEU HA H 98 4.110 3.995 0.115 1
1 1152 . 12 1 1 A 98 98 LEU C C 98 179.700 178.803 0.897 1
1 1153 . 12 1 1 A 98 98 LEU CA C 98 57.900 57.707 0.193 1
1 1154 . 12 1 1 A 98 98 LEU CB C 98 41.800 41.480 0.320 1
1 1158 . 12 1 1 A 98 98 LEU N N 98 119.200 121.424 -2.224 1
1 1159 . 12 1 1 A 99 99 SER H H 99 8.290 8.405 -0.115 1
1 1160 . 12 1 1 A 99 99 SER HA H 99 4.220 4.193 0.027 1
1 1163 . 12 1 1 A 99 99 SER C C 99 176.600 177.598 -0.998 1
1 1164 . 12 1 1 A 99 99 SER CA C 99 62.400 61.646 0.754 1
1 1165 . 12 1 1 A 99 99 SER CB C 99 63.200 62.833 0.367 1
1 1166 . 12 1 1 A 99 99 SER N N 99 116.300 112.766 3.534 1
1 1167 . 12 1 1 A 100 100 LEU H H 100 8.490 8.209 0.281 1
1 1168 . 12 1 1 A 100 100 LEU HA H 100 3.960 4.014 -0.054 1
1 1178 . 12 1 1 A 100 100 LEU C C 100 179.300 179.737 -0.437 1
1 1179 . 12 1 1 A 100 100 LEU CA C 100 57.700 57.935 -0.235 1
1 1180 . 12 1 1 A 100 100 LEU CB C 100 41.300 41.291 0.009 1
1 1184 . 12 1 1 A 100 100 LEU N N 100 120.900 123.113 -2.213 1
1 1185 . 12 1 1 A 101 101 GLN H H 101 7.680 8.425 -0.745 1
1 1186 . 12 1 1 A 101 101 GLN HA H 101 4.100 4.035 0.065 1
1 1193 . 12 1 1 A 101 101 GLN C C 101 178.700 177.879 0.821 1
1 1194 . 12 1 1 A 101 101 GLN CA C 101 58.800 58.708 0.092 1
1 1195 . 12 1 1 A 101 101 GLN CB C 101 27.900 27.786 0.114 1
1 1197 . 12 1 1 A 101 101 GLN N N 101 119.100 118.032 1.068 1
1 1199 . 12 1 1 A 102 102 GLU H H 102 7.850 8.339 -0.489 1
1 1200 . 12 1 1 A 102 102 GLU HA H 102 4.050 4.130 -0.080 1
1 1205 . 12 1 1 A 102 102 GLU C C 102 179.100 178.876 0.224 1
1 1206 . 12 1 1 A 102 102 GLU CA C 102 58.400 59.311 -0.911 1
1 1207 . 12 1 1 A 102 102 GLU CB C 102 28.600 28.935 -0.335 1
1 1209 . 12 1 1 A 102 102 GLU N N 102 118.400 119.264 -0.864 1
1 1210 . 12 1 1 A 103 103 LEU H H 103 8.080 7.667 0.413 1
1 1211 . 12 1 1 A 103 103 LEU HA H 103 4.020 4.012 0.008 1
1 1221 . 12 1 1 A 103 103 LEU C C 103 178.200 178.256 -0.056 1
1 1222 . 12 1 1 A 103 103 LEU CA C 103 57.000 58.087 -1.087 1
1 1223 . 12 1 1 A 103 103 LEU CB C 103 41.900 41.915 -0.015 1
1 1227 . 12 1 1 A 103 103 LEU N N 103 120.600 123.450 -2.850 1
1 1228 . 12 1 1 A 104 104 GLN H H 104 7.900 8.156 -0.256 1
1 1229 . 12 1 1 A 104 104 GLN HA H 104 4.090 4.107 -0.017 1
1 1236 . 12 1 1 A 104 104 GLN C C 104 177.300 177.637 -0.337 1
1 1237 . 12 1 1 A 104 104 GLN CA C 104 58.100 58.175 -0.075 1
1 1238 . 12 1 1 A 104 104 GLN CB C 104 29.400 28.630 0.770 1
1 1240 . 12 1 1 A 104 104 GLN N N 104 117.700 116.911 0.789 1
1 1242 . 12 1 1 A 105 105 VAL H H 105 7.620 7.591 0.029 1
1 1243 . 12 1 1 A 105 105 VAL HA H 105 4.190 4.044 0.146 1
1 1251 . 12 1 1 A 105 105 VAL C C 105 176.800 176.478 0.322 1
1 1252 . 12 1 1 A 105 105 VAL CA C 105 62.600 64.380 -1.780 1
1 1253 . 12 1 1 A 105 105 VAL CB C 105 32.000 31.465 0.535 1
1 1256 . 12 1 1 A 105 105 VAL N N 105 114.900 117.067 -2.167 1
1 1257 . 12 1 1 A 106 106 SER H H 106 7.900 7.555 0.345 1
1 1258 . 12 1 1 A 106 106 SER HA H 106 4.460 4.771 -0.311 1
1 1261 . 12 1 1 A 106 106 SER C C 106 175.000 175.053 -0.053 1
1 1262 . 12 1 1 A 106 106 SER CA C 106 58.900 57.980 0.920 1
1 1263 . 12 1 1 A 106 106 SER CB C 106 63.900 64.065 -0.165 1
1 1264 . 12 1 1 A 106 106 SER N N 106 116.900 117.318 -0.418 1
1 1265 . 12 1 1 A 107 107 SER H H 107 8.230 7.424 0.806 1
1 1266 . 12 1 1 A 107 107 SER HA H 107 4.390 4.167 0.223 1
1 1269 . 12 1 1 A 107 107 SER C C 107 174.600 175.200 -0.600 1
1 1270 . 12 1 1 A 107 107 SER CA C 107 58.400 61.135 -2.735 1
1 1271 . 12 1 1 A 107 107 SER CB C 107 63.600 63.021 0.579 1
1 1272 . 12 1 1 A 107 107 SER N N 107 117.500 116.873 0.627 1
1 1273 . 12 1 1 A 108 108 ALA H H 108 8.080 7.825 0.255 1
1 1274 . 12 1 1 A 108 108 ALA HA H 108 4.280 3.916 0.364 1
1 1278 . 12 1 1 A 108 108 ALA C C 108 177.500 176.560 0.940 1
1 1279 . 12 1 1 A 108 108 ALA CA C 108 52.700 55.004 -2.304 1
1 1280 . 12 1 1 A 108 108 ALA CB C 108 19.200 17.010 2.190 1
1 1281 . 12 1 1 A 108 108 ALA N N 108 124.900 120.643 4.257 1
1 1282 . 12 1 1 A 109 109 ALA H H 109 8.080 8.169 -0.089 1
1 1283 . 12 1 1 A 109 109 ALA HA H 109 4.280 4.334 -0.054 1
1 1287 . 12 1 1 A 109 109 ALA C C 109 177.700 176.955 0.745 1
1 1288 . 12 1 1 A 109 109 ALA CA C 109 52.400 51.854 0.546 1
1 1289 . 12 1 1 A 109 109 ALA CB C 109 19.400 20.596 -1.196 1
1 1290 . 12 1 1 A 109 109 ALA N N 109 123.000 121.313 1.687 1
1 1291 . 12 1 1 A 110 110 ALA H H 110 8.300 8.680 -0.380 1
1 1292 . 12 1 1 A 110 110 ALA HA H 110 4.280 4.320 -0.040 1
1 1296 . 12 1 1 A 110 110 ALA C C 110 178.200 178.691 -0.491 1
1 1297 . 12 1 1 A 110 110 ALA CA C 110 52.700 54.246 -1.546 1
1 1298 . 12 1 1 A 110 110 ALA CB C 110 19.200 19.458 -0.258 1
1 1299 . 12 1 1 A 110 110 ALA N N 110 123.200 121.016 2.184 1
1 1300 . 12 1 1 A 111 111 GLY H H 111 8.300 7.576 0.724 1
1 1301 . 12 1 1 A 111 111 GLY HA2 H 111 3.930 4.093 -0.163 1
1 1302 . 12 1 1 A 111 111 GLY HA3 H 111 3.940 4.093 -0.153 1
1 1303 . 12 1 1 A 111 111 GLY C C 111 173.700 173.662 0.038 1
1 1304 . 12 1 1 A 111 111 GLY CA C 111 45.100 45.773 -0.673 1
1 1305 . 12 1 1 A 111 111 GLY N N 111 108.000 102.387 5.613 1
1 1306 . 12 1 1 A 112 112 VAL H H 112 7.930 7.540 0.390 1
1 1307 . 12 1 1 A 112 112 VAL HA H 112 4.420 4.245 0.175 1
1 1315 . 12 1 1 A 112 112 VAL CA C 112 60.000 59.663 0.337 1
1 1316 . 12 1 1 A 112 112 VAL CB C 112 32.200 32.144 0.056 1
1 1319 . 12 1 1 A 112 112 VAL N N 112 120.400 120.995 -0.595 1
1 1320 . 12 1 1 A 113 113 PRO HA H 113 4.370 4.282 0.088 1
1 1327 . 12 1 1 A 113 113 PRO C C 113 177.300 178.022 -0.722 1
1 1328 . 12 1 1 A 113 113 PRO CA C 113 63.900 63.988 -0.088 1
1 1329 . 12 1 1 A 113 113 PRO CB C 113 31.800 31.307 0.493 1
1 1332 . 12 1 1 A 114 114 GLY H H 114 8.570 8.865 -0.295 1
1 1333 . 12 1 1 A 114 114 GLY HA2 H 114 3.880 3.967 -0.087 1
1 1334 . 12 1 1 A 114 114 GLY HA3 H 114 4.120 3.968 0.152 1
1 1335 . 12 1 1 A 114 114 GLY C C 114 174.900 175.204 -0.304 1
1 1336 . 12 1 1 A 114 114 GLY CA C 114 45.200 46.094 -0.894 1
1 1337 . 12 1 1 A 114 114 GLY N N 114 109.000 113.176 -4.176 1
1 1338 . 12 1 1 A 115 115 THR H H 115 7.900 7.516 0.384 1
1 1339 . 12 1 1 A 115 115 THR HA H 115 4.400 4.038 0.362 1
1 1344 . 12 1 1 A 115 115 THR C C 115 174.300 173.677 0.623 1
1 1345 . 12 1 1 A 115 115 THR CA C 115 61.700 64.508 -2.808 1
1 1346 . 12 1 1 A 115 115 THR CB C 115 69.700 69.707 -0.007 1
1 1348 . 12 1 1 A 115 115 THR N N 115 111.400 115.666 -4.266 1
1 1349 . 12 1 1 A 116 116 ASN H H 116 8.450 7.982 0.468 1
1 1350 . 12 1 1 A 116 116 ASN HA H 116 4.970 5.158 -0.188 1
1 1355 . 12 1 1 A 116 116 ASN CA C 116 51.500 49.285 2.215 1
1 1356 . 12 1 1 A 116 116 ASN CB C 116 38.900 40.367 -1.467 1
1 1357 . 12 1 1 A 116 116 ASN N N 116 123.100 116.766 6.334 1
1 1359 . 12 1 1 A 117 117 PRO HA H 117 4.370 4.329 0.041 1
1 1366 . 12 1 1 A 117 117 PRO C C 117 178.400 177.912 0.488 1
1 1367 . 12 1 1 A 117 117 PRO CA C 117 64.800 64.886 -0.086 1
1 1368 . 12 1 1 A 117 117 PRO CB C 117 32.100 31.870 0.230 1
1 1371 . 12 1 1 A 118 118 VAL H H 118 7.750 7.583 0.167 1
1 1372 . 12 1 1 A 118 118 VAL HA H 118 3.810 3.782 0.028 1
1 1380 . 12 1 1 A 118 118 VAL C C 118 178.300 178.280 0.020 1
1 1381 . 12 1 1 A 118 118 VAL CA C 118 65.200 65.345 -0.145 1
1 1382 . 12 1 1 A 118 118 VAL CB C 118 31.500 31.590 -0.090 1
1 1385 . 12 1 1 A 118 118 VAL N N 118 118.300 116.359 1.941 1
1 1386 . 12 1 1 A 119 119 LEU H H 119 7.540 8.197 -0.657 1
1 1387 . 12 1 1 A 119 119 LEU HA H 119 4.030 3.960 0.070 1
1 1397 . 12 1 1 A 119 119 LEU C C 119 178.900 179.183 -0.283 1
1 1398 . 12 1 1 A 119 119 LEU CA C 119 57.800 58.128 -0.328 1
1 1399 . 12 1 1 A 119 119 LEU CB C 119 40.700 40.621 0.079 1
1 1403 . 12 1 1 A 119 119 LEU N N 119 119.700 120.220 -0.520 1
1 1404 . 12 1 1 A 120 120 ASN H H 120 8.080 8.250 -0.170 1
1 1405 . 12 1 1 A 120 120 ASN HA H 120 4.420 4.420 0.000 1
1 1410 . 12 1 1 A 120 120 ASN C C 120 178.100 177.597 0.503 1
1 1411 . 12 1 1 A 120 120 ASN CA C 120 56.100 56.536 -0.436 1
1 1412 . 12 1 1 A 120 120 ASN CB C 120 37.800 38.740 -0.940 1
1 1413 . 12 1 1 A 120 120 ASN N N 120 117.700 118.226 -0.526 1
1 1415 . 12 1 1 A 121 121 ASN H H 121 8.120 7.881 0.239 1
1 1416 . 12 1 1 A 121 121 ASN HA H 121 4.490 4.491 -0.001 1
1 1421 . 12 1 1 A 121 121 ASN C C 121 178.000 178.151 -0.151 1
1 1422 . 12 1 1 A 121 121 ASN CA C 121 56.100 56.442 -0.342 1
1 1423 . 12 1 1 A 121 121 ASN CB C 121 37.800 38.547 -0.747 1
1 1424 . 12 1 1 A 121 121 ASN N N 121 120.000 116.976 3.024 1
1 1426 . 12 1 1 A 122 122 LEU H H 122 8.180 8.252 -0.072 1
1 1427 . 12 1 1 A 122 122 LEU HA H 122 4.050 3.933 0.117 1
1 1437 . 12 1 1 A 122 122 LEU C C 122 173.800 178.932 -5.132 1
1 1438 . 12 1 1 A 122 122 LEU CA C 122 58.500 57.896 0.604 1
1 1439 . 12 1 1 A 122 122 LEU CB C 122 41.900 41.967 -0.067 1
1 1443 . 12 1 1 A 122 122 LEU N N 122 122.600 120.823 1.777 1
1 1444 . 12 1 1 A 123 123 LEU H H 123 8.260 8.081 0.179 1
1 1445 . 12 1 1 A 123 123 LEU HA H 123 3.850 3.964 -0.114 1
1 1455 . 12 1 1 A 123 123 LEU C C 123 178.900 178.440 0.460 1
1 1456 . 12 1 1 A 123 123 LEU CA C 123 58.500 58.161 0.339 1
1 1457 . 12 1 1 A 123 123 LEU CB C 123 41.200 41.316 -0.116 1
1 1461 . 12 1 1 A 123 123 LEU N N 123 119.700 120.423 -0.723 1
1 1462 . 12 1 1 A 124 124 SER H H 124 7.950 8.435 -0.485 1
1 1463 . 12 1 1 A 124 124 SER HA H 124 4.240 4.130 0.110 1
1 1466 . 12 1 1 A 124 124 SER C C 124 177.500 177.180 0.320 1
1 1467 . 12 1 1 A 124 124 SER CA C 124 61.600 62.102 -0.502 1
1 1468 . 12 1 1 A 124 124 SER CB C 124 62.600 62.832 -0.232 1
1 1469 . 12 1 1 A 124 124 SER N N 124 113.400 113.776 -0.376 1
1 1470 . 12 1 1 A 125 125 CYS H H 125 8.040 8.301 -0.261 1
1 1471 . 12 1 1 A 125 125 CYS HA H 125 4.350 4.105 0.245 1
1 1474 . 12 1 1 A 125 125 CYS C C 125 176.800 176.945 -0.145 1
1 1475 . 12 1 1 A 125 125 CYS CA C 125 62.600 63.967 -1.367 1
1 1476 . 12 1 1 A 125 125 CYS CB C 125 27.100 26.819 0.281 1
1 1477 . 12 1 1 A 125 125 CYS N N 125 119.800 119.818 -0.018 1
1 1478 . 12 1 1 A 126 126 VAL H H 126 8.290 8.471 -0.181 1
1 1479 . 12 1 1 A 126 126 VAL HA H 126 3.430 3.381 0.049 1
1 1487 . 12 1 1 A 126 126 VAL C C 126 177.800 177.816 -0.016 1
1 1488 . 12 1 1 A 126 126 VAL CA C 126 67.100 66.879 0.221 1
1 1489 . 12 1 1 A 126 126 VAL CB C 126 31.400 31.564 -0.164 1
1 1492 . 12 1 1 A 126 126 VAL N N 126 121.900 120.516 1.384 1
1 1493 . 12 1 1 A 127 127 GLN H H 127 8.200 8.470 -0.270 1
1 1494 . 12 1 1 A 127 127 GLN HA H 127 3.970 3.950 0.020 1
1 1501 . 12 1 1 A 127 127 GLN C C 127 178.200 178.534 -0.334 1
1 1502 . 12 1 1 A 127 127 GLN CA C 127 58.700 58.815 -0.115 1
1 1503 . 12 1 1 A 127 127 GLN CB C 127 27.800 28.330 -0.530 1
1 1505 . 12 1 1 A 127 127 GLN N N 127 119.700 118.261 1.439 1
1 1507 . 12 1 1 A 128 128 GLU H H 128 7.880 7.888 -0.008 1
1 1508 . 12 1 1 A 128 128 GLU HA H 128 4.200 4.096 0.104 1
1 1513 . 12 1 1 A 128 128 GLU C C 128 178.400 178.622 -0.222 1
1 1514 . 12 1 1 A 128 128 GLU CA C 128 59.000 58.965 0.035 1
1 1515 . 12 1 1 A 128 128 GLU CB C 128 28.400 29.548 -1.148 1
1 1517 . 12 1 1 A 128 128 GLU N N 128 119.800 119.075 0.725 1
1 1518 . 12 1 1 A 129 129 ILE H H 129 8.000 8.368 -0.368 1
1 1519 . 12 1 1 A 129 129 ILE HA H 129 3.460 3.534 -0.074 1
1 1529 . 12 1 1 A 129 129 ILE C C 129 176.800 178.121 -1.321 1
1 1530 . 12 1 1 A 129 129 ILE CA C 129 66.100 65.370 0.730 1
1 1531 . 12 1 1 A 129 129 ILE CB C 129 38.200 37.587 0.613 1
1 1535 . 12 1 1 A 129 129 ILE N N 129 119.500 120.154 -0.654 1
1 1536 . 12 1 1 A 130 130 SER H H 130 8.040 8.349 -0.309 1
1 1537 . 12 1 1 A 130 130 SER HA H 130 3.780 4.171 -0.391 1
1 1540 . 12 1 1 A 130 130 SER C C 130 176.200 176.466 -0.266 1
1 1541 . 12 1 1 A 130 130 SER CA C 130 62.100 61.536 0.564 1
1 1542 . 12 1 1 A 130 130 SER CB C 130 62.600 62.242 0.358 1
1 1543 . 12 1 1 A 130 130 SER N N 130 112.800 114.721 -1.921 1
1 1544 . 12 1 1 A 131 131 ASP H H 131 8.270 7.863 0.407 1
1 1545 . 12 1 1 A 131 131 ASP HA H 131 4.310 4.414 -0.104 1
1 1548 . 12 1 1 A 131 131 ASP C C 131 179.200 178.802 0.398 1
1 1549 . 12 1 1 A 131 131 ASP CA C 131 56.800 56.944 -0.144 1
1 1550 . 12 1 1 A 131 131 ASP CB C 131 40.900 40.823 0.077 1
1 1551 . 12 1 1 A 131 131 ASP N N 131 119.600 121.997 -2.397 1
1 1552 . 12 1 1 A 132 132 VAL H H 132 8.470 8.366 0.104 1
1 1553 . 12 1 1 A 132 132 VAL HA H 132 3.520 3.747 -0.227 1
1 1561 . 12 1 1 A 132 132 VAL C C 132 178.700 178.389 0.311 1
1 1562 . 12 1 1 A 132 132 VAL CA C 132 66.500 65.943 0.557 1
1 1563 . 12 1 1 A 132 132 VAL CB C 132 31.500 31.778 -0.278 1
1 1566 . 12 1 1 A 132 132 VAL N N 132 118.100 119.913 -1.813 1
1 1567 . 12 1 1 A 133 133 VAL H H 133 8.140 7.820 0.320 1
1 1568 . 12 1 1 A 133 133 VAL HA H 133 3.770 3.932 -0.162 1
1 1576 . 12 1 1 A 133 133 VAL C C 133 176.500 176.145 0.355 1
1 1577 . 12 1 1 A 133 133 VAL CA C 133 65.100 66.173 -1.073 1
1 1578 . 12 1 1 A 133 133 VAL CB C 133 31.600 31.492 0.108 1
1 1581 . 12 1 1 A 133 133 VAL N N 133 117.000 120.039 -3.039 1
1 1582 . 12 1 1 A 134 134 GLN H H 134 7.490 7.786 -0.296 1
1 1583 . 12 1 1 A 134 134 GLN HA H 134 4.350 4.489 -0.139 1
1 1590 . 12 1 1 A 134 134 GLN C C 134 175.400 176.195 -0.795 1
1 1591 . 12 1 1 A 134 134 GLN CA C 134 56.700 55.403 1.297 1
1 1592 . 12 1 1 A 134 134 GLN CB C 134 30.500 29.534 0.966 1
1 1594 . 12 1 1 A 134 134 GLN N N 134 116.300 117.625 -1.325 1
1 1 . 13 1 1 A 2 2 GLY HA2 H 2 3.890 3.755 0.135 1
1 2 . 13 1 1 A 2 2 GLY HA3 H 2 3.890 3.771 0.119 1
1 3 . 13 1 1 A 2 2 GLY C C 2 174.200 174.305 -0.105 1
1 4 . 13 1 1 A 2 2 GLY CA C 2 44.700 47.129 -2.429 1
1 5 . 13 1 1 A 3 3 HIS H H 3 8.380 8.559 -0.179 1
1 6 . 13 1 1 A 3 3 HIS HA H 3 4.610 4.835 -0.225 1
1 9 . 13 1 1 A 3 3 HIS C C 3 174.500 174.062 0.438 1
1 10 . 13 1 1 A 3 3 HIS CA C 3 55.200 56.315 -1.115 1
1 11 . 13 1 1 A 3 3 HIS CB C 3 28.800 31.554 -2.754 1
1 12 . 13 1 1 A 3 3 HIS N N 3 117.600 120.093 -2.493 1
1 13 . 13 1 1 A 4 4 HIS H H 4 8.520 7.338 1.182 1
1 14 . 13 1 1 A 4 4 HIS HA H 4 4.640 4.703 -0.063 1
1 17 . 13 1 1 A 4 4 HIS C C 4 174.200 172.510 1.690 1
1 18 . 13 1 1 A 4 4 HIS CA C 4 55.100 54.929 0.171 1
1 19 . 13 1 1 A 4 4 HIS CB C 4 28.900 31.369 -2.469 1
1 20 . 13 1 1 A 4 4 HIS N N 4 119.000 115.721 3.279 1
1 21 . 13 1 1 A 5 5 HIS H H 5 8.530 8.603 -0.073 1
1 22 . 13 1 1 A 5 5 HIS HA H 5 4.410 5.701 -1.291 1
1 25 . 13 1 1 A 5 5 HIS CA C 5 54.900 53.436 1.464 1
1 26 . 13 1 1 A 5 5 HIS CB C 5 27.300 33.063 -5.763 1
1 27 . 13 1 1 A 5 5 HIS N N 5 121.600 116.953 4.647 1
1 28 . 13 1 1 A 6 6 HIS HA H 6 4.640 4.712 -0.072 1
1 31 . 13 1 1 A 6 6 HIS C C 6 174.100 174.761 -0.661 1
1 32 . 13 1 1 A 6 6 HIS CA C 6 55.100 55.819 -0.719 1
1 33 . 13 1 1 A 6 6 HIS CB C 6 29.100 30.187 -1.087 1
1 34 . 13 1 1 A 7 7 HIS H H 7 8.690 8.706 -0.016 1
1 35 . 13 1 1 A 7 7 HIS HA H 7 4.650 4.633 0.017 1
1 38 . 13 1 1 A 7 7 HIS C C 7 174.200 173.682 0.518 1
1 39 . 13 1 1 A 7 7 HIS CA C 7 55.200 57.324 -2.124 1
1 40 . 13 1 1 A 7 7 HIS CB C 7 29.300 30.353 -1.053 1
1 41 . 13 1 1 A 7 7 HIS N N 7 121.400 127.434 -6.034 1
1 42 . 13 1 1 A 8 8 HIS H H 8 8.660 8.685 -0.025 1
1 43 . 13 1 1 A 8 8 HIS HA H 8 4.700 4.987 -0.287 1
1 46 . 13 1 1 A 8 8 HIS C C 8 174.200 173.887 0.313 1
1 47 . 13 1 1 A 8 8 HIS CA C 8 55.000 53.636 1.364 1
1 48 . 13 1 1 A 8 8 HIS CB C 8 29.300 32.330 -3.030 1
1 49 . 13 1 1 A 8 8 HIS N N 8 120.400 128.409 -8.009 1
1 50 . 13 1 1 A 9 9 SER H H 9 8.490 8.225 0.265 1
1 51 . 13 1 1 A 9 9 SER HA H 9 4.390 4.530 -0.140 1
1 54 . 13 1 1 A 9 9 SER C C 9 174.100 174.182 -0.082 1
1 55 . 13 1 1 A 9 9 SER CA C 9 58.300 58.582 -0.282 1
1 56 . 13 1 1 A 9 9 SER CB C 9 63.700 63.816 -0.116 1
1 57 . 13 1 1 A 9 9 SER N N 9 118.100 123.614 -5.514 1
1 58 . 13 1 1 A 10 10 HIS H H 10 8.710 8.564 0.146 1
1 59 . 13 1 1 A 10 10 HIS HA H 10 4.690 5.599 -0.909 1
1 63 . 13 1 1 A 10 10 HIS C C 10 174.200 173.891 0.309 1
1 64 . 13 1 1 A 10 10 HIS CA C 10 55.200 53.310 1.890 1
1 65 . 13 1 1 A 10 10 HIS CB C 10 28.800 32.840 -4.040 1
1 66 . 13 1 1 A 10 10 HIS N N 10 120.700 118.263 2.437 1
1 67 . 13 1 1 A 11 11 MET H H 11 8.410 9.003 -0.593 1
1 68 . 13 1 1 A 11 11 MET HA H 11 4.420 4.428 -0.008 1
1 76 . 13 1 1 A 11 11 MET C C 11 175.800 176.576 -0.776 1
1 77 . 13 1 1 A 11 11 MET CA C 11 55.100 55.044 0.056 1
1 78 . 13 1 1 A 11 11 MET CB C 11 32.800 34.321 -1.521 1
1 81 . 13 1 1 A 11 11 MET N N 11 122.300 118.880 3.420 1
1 82 . 13 1 1 A 12 12 ALA H H 12 8.440 8.506 -0.066 1
1 83 . 13 1 1 A 12 12 ALA HA H 12 4.280 4.752 -0.472 1
1 87 . 13 1 1 A 12 12 ALA C C 12 177.400 176.226 1.174 1
1 88 . 13 1 1 A 12 12 ALA CA C 12 52.400 51.166 1.234 1
1 89 . 13 1 1 A 12 12 ALA CB C 12 18.800 21.009 -2.209 1
1 90 . 13 1 1 A 12 12 ALA N N 12 125.900 123.391 2.509 1
1 91 . 13 1 1 A 13 13 ASN H H 13 8.440 8.736 -0.296 1
1 92 . 13 1 1 A 13 13 ASN HA H 13 4.660 5.249 -0.589 1
1 97 . 13 1 1 A 13 13 ASN C C 13 175.900 173.818 2.082 1
1 98 . 13 1 1 A 13 13 ASN CA C 13 53.200 51.778 1.422 1
1 99 . 13 1 1 A 13 13 ASN CB C 13 38.800 41.559 -2.759 1
1 100 . 13 1 1 A 13 13 ASN N N 13 118.300 113.416 4.884 1
1 102 . 13 1 1 A 14 14 GLY H H 14 8.370 8.270 0.100 1
1 103 . 13 1 1 A 14 14 GLY HA2 H 14 3.920 4.204 -0.284 1
1 104 . 13 1 1 A 14 14 GLY HA3 H 14 3.920 4.205 -0.285 1
1 105 . 13 1 1 A 14 14 GLY C C 14 174.000 171.350 2.650 1
1 106 . 13 1 1 A 14 14 GLY CA C 14 45.200 45.609 -0.409 1
1 107 . 13 1 1 A 14 14 GLY N N 14 109.600 105.499 4.101 1
1 108 . 13 1 1 A 15 15 ALA H H 15 8.140 8.269 -0.129 1
1 109 . 13 1 1 A 15 15 ALA HA H 15 4.280 4.834 -0.554 1
1 113 . 13 1 1 A 15 15 ALA C C 15 177.300 177.447 -0.147 1
1 114 . 13 1 1 A 15 15 ALA CA C 15 52.500 51.275 1.225 1
1 115 . 13 1 1 A 15 15 ALA CB C 15 19.100 22.614 -3.514 1
1 116 . 13 1 1 A 15 15 ALA N N 15 123.800 122.005 1.795 1
1 117 . 13 1 1 A 16 16 ALA H H 16 8.030 8.887 -0.857 1
1 118 . 13 1 1 A 16 16 ALA HA H 16 4.280 4.124 0.156 1
1 122 . 13 1 1 A 16 16 ALA C C 16 178.400 178.193 0.207 1
1 123 . 13 1 1 A 16 16 ALA CA C 16 52.600 53.825 -1.225 1
1 124 . 13 1 1 A 16 16 ALA CB C 16 19.100 18.398 0.702 1
1 125 . 13 1 1 A 16 16 ALA N N 16 122.300 122.351 -0.051 1
1 126 . 13 1 1 A 17 17 GLY H H 17 8.320 8.280 0.040 1
1 127 . 13 1 1 A 17 17 GLY HA2 H 17 3.960 3.919 0.041 1
1 128 . 13 1 1 A 17 17 GLY HA3 H 17 3.960 3.920 0.040 1
1 129 . 13 1 1 A 17 17 GLY C C 17 174.500 175.328 -0.828 1
1 130 . 13 1 1 A 17 17 GLY CA C 17 45.200 45.940 -0.740 1
1 131 . 13 1 1 A 17 17 GLY N N 17 107.800 107.852 -0.052 1
1 132 . 13 1 1 A 18 18 THR H H 18 7.970 7.631 0.339 1
1 133 . 13 1 1 A 18 18 THR HA H 18 4.290 4.144 0.146 1
1 138 . 13 1 1 A 18 18 THR C C 18 174.600 176.089 -1.489 1
1 139 . 13 1 1 A 18 18 THR CA C 18 62.000 66.047 -4.047 1
1 140 . 13 1 1 A 18 18 THR CB C 18 69.700 68.188 1.512 1
1 142 . 13 1 1 A 18 18 THR N N 18 113.800 116.493 -2.693 1
1 143 . 13 1 1 A 19 19 LYS H H 19 8.350 8.835 -0.485 1
1 144 . 13 1 1 A 19 19 LYS HA H 19 4.270 4.113 0.157 1
1 153 . 13 1 1 A 19 19 LYS C C 19 176.600 177.194 -0.594 1
1 154 . 13 1 1 A 19 19 LYS CA C 19 56.500 58.651 -2.151 1
1 155 . 13 1 1 A 19 19 LYS CB C 19 32.800 31.833 0.967 1
1 159 . 13 1 1 A 19 19 LYS N N 19 124.000 120.372 3.628 1
1 160 . 13 1 1 A 20 20 VAL H H 20 8.060 7.199 0.861 1
1 161 . 13 1 1 A 20 20 VAL HA H 20 3.990 4.455 -0.465 1
1 169 . 13 1 1 A 20 20 VAL C C 20 175.900 176.242 -0.342 1
1 170 . 13 1 1 A 20 20 VAL CA C 20 62.400 61.965 0.435 1
1 171 . 13 1 1 A 20 20 VAL CB C 20 32.600 32.346 0.254 1
1 174 . 13 1 1 A 20 20 VAL N N 20 121.700 118.763 2.937 1
1 175 . 13 1 1 A 21 21 ALA H H 21 8.310 8.124 0.186 1
1 176 . 13 1 1 A 21 21 ALA HA H 21 4.290 3.978 0.312 1
1 180 . 13 1 1 A 21 21 ALA C C 21 177.600 179.058 -1.458 1
1 181 . 13 1 1 A 21 21 ALA CA C 21 52.400 55.536 -3.136 1
1 182 . 13 1 1 A 21 21 ALA CB C 21 19.000 18.980 0.020 1
1 183 . 13 1 1 A 21 21 ALA N N 21 127.700 126.192 1.508 1
1 184 . 13 1 1 A 22 22 LEU H H 22 8.150 7.731 0.419 1
1 185 . 13 1 1 A 22 22 LEU HA H 22 4.280 4.355 -0.075 1
1 195 . 13 1 1 A 22 22 LEU C C 22 177.400 175.961 1.439 1
1 196 . 13 1 1 A 22 22 LEU CA C 22 55.200 54.275 0.925 1
1 197 . 13 1 1 A 22 22 LEU CB C 22 42.200 42.385 -0.185 1
1 201 . 13 1 1 A 22 22 LEU N N 22 121.800 115.026 6.774 1
1 202 . 13 1 1 A 23 23 ARG H H 23 8.240 7.760 0.480 1
1 203 . 13 1 1 A 23 23 ARG HA H 23 4.290 4.148 0.142 1
1 211 . 13 1 1 A 23 23 ARG C C 23 176.300 175.996 0.304 1
1 212 . 13 1 1 A 23 23 ARG CA C 23 56.000 56.484 -0.484 1
1 213 . 13 1 1 A 23 23 ARG CB C 23 30.600 28.981 1.619 1
1 216 . 13 1 1 A 23 23 ARG N N 23 122.000 116.004 5.996 1
1 218 . 13 1 1 A 24 24 LYS H H 24 8.370 8.215 0.155 1
1 219 . 13 1 1 A 24 24 LYS HA H 24 4.330 4.474 -0.144 1
1 228 . 13 1 1 A 24 24 LYS C C 24 176.800 176.122 0.678 1
1 229 . 13 1 1 A 24 24 LYS CA C 24 56.400 57.473 -1.073 1
1 230 . 13 1 1 A 24 24 LYS CB C 24 32.700 34.675 -1.975 1
1 234 . 13 1 1 A 24 24 LYS N N 24 122.900 122.884 0.016 1
1 235 . 13 1 1 A 25 25 THR H H 25 8.100 7.721 0.379 1
1 236 . 13 1 1 A 25 25 THR HA H 25 4.290 4.511 -0.221 1
1 241 . 13 1 1 A 25 25 THR C C 25 174.600 174.623 -0.023 1
1 242 . 13 1 1 A 25 25 THR CA C 25 61.500 60.641 0.859 1
1 243 . 13 1 1 A 25 25 THR CB C 25 69.800 70.769 -0.969 1
1 245 . 13 1 1 A 25 25 THR N N 25 115.500 110.617 4.883 1
1 246 . 13 1 1 A 26 26 LYS H H 26 8.370 8.684 -0.314 1
1 247 . 13 1 1 A 26 26 LYS HA H 26 4.270 4.275 -0.005 1
1 256 . 13 1 1 A 26 26 LYS C C 26 176.600 177.259 -0.659 1
1 257 . 13 1 1 A 26 26 LYS CA C 26 56.600 56.644 -0.044 1
1 258 . 13 1 1 A 26 26 LYS CB C 26 32.700 32.743 -0.043 1
1 262 . 13 1 1 A 26 26 LYS N N 26 123.700 122.852 0.848 1
1 263 . 13 1 1 A 27 27 GLN H H 27 8.390 8.970 -0.580 1
1 264 . 13 1 1 A 27 27 GLN HA H 27 4.240 4.494 -0.254 1
1 271 . 13 1 1 A 27 27 GLN C C 27 175.900 176.219 -0.319 1
1 272 . 13 1 1 A 27 27 GLN CA C 27 56.100 56.742 -0.642 1
1 273 . 13 1 1 A 27 27 GLN CB C 27 29.300 29.350 -0.050 1
1 275 . 13 1 1 A 27 27 GLN N N 27 121.700 120.493 1.207 1
1 277 . 13 1 1 A 28 28 ALA H H 28 8.330 7.722 0.608 1
1 278 . 13 1 1 A 28 28 ALA HA H 28 4.240 4.484 -0.244 1
1 282 . 13 1 1 A 28 28 ALA C C 28 177.700 177.660 0.040 1
1 283 . 13 1 1 A 28 28 ALA CA C 28 52.500 51.811 0.689 1
1 284 . 13 1 1 A 28 28 ALA CB C 28 19.100 22.309 -3.209 1
1 285 . 13 1 1 A 28 28 ALA N N 28 125.400 119.822 5.578 1
1 286 . 13 1 1 A 29 29 ALA H H 29 8.250 9.039 -0.789 1
1 287 . 13 1 1 A 29 29 ALA HA H 29 4.230 3.935 0.295 1
1 291 . 13 1 1 A 29 29 ALA C C 29 178.000 179.609 -1.609 1
1 292 . 13 1 1 A 29 29 ALA CA C 29 52.500 55.327 -2.827 1
1 293 . 13 1 1 A 29 29 ALA CB C 29 19.100 18.404 0.696 1
1 294 . 13 1 1 A 29 29 ALA N N 29 123.000 126.435 -3.435 1
1 295 . 13 1 1 A 30 30 GLU H H 30 8.260 8.397 -0.137 1
1 296 . 13 1 1 A 30 30 GLU HA H 30 4.220 4.090 0.130 1
1 301 . 13 1 1 A 30 30 GLU C C 30 176.500 178.195 -1.695 1
1 302 . 13 1 1 A 30 30 GLU CA C 30 56.400 59.246 -2.846 1
1 303 . 13 1 1 A 30 30 GLU CB C 30 29.500 29.332 0.168 1
1 305 . 13 1 1 A 30 30 GLU N N 30 119.700 118.377 1.323 1
1 306 . 13 1 1 A 31 31 LYS H H 31 8.230 8.003 0.227 1
1 307 . 13 1 1 A 31 31 LYS HA H 31 4.280 4.244 0.036 1
1 316 . 13 1 1 A 31 31 LYS C C 31 176.500 177.006 -0.506 1
1 317 . 13 1 1 A 31 31 LYS CA C 31 56.400 57.923 -1.523 1
1 318 . 13 1 1 A 31 31 LYS CB C 31 32.800 32.852 -0.052 1
1 322 . 13 1 1 A 31 31 LYS N N 31 122.700 118.435 4.265 1
1 323 . 13 1 1 A 32 32 ILE H H 32 8.140 7.380 0.760 1
1 324 . 13 1 1 A 32 32 ILE HA H 32 4.110 4.124 -0.014 1
1 334 . 13 1 1 A 32 32 ILE C C 32 176.400 175.807 0.593 1
1 335 . 13 1 1 A 32 32 ILE CA C 32 61.200 62.263 -1.063 1
1 336 . 13 1 1 A 32 32 ILE CB C 32 38.600 37.973 0.627 1
1 340 . 13 1 1 A 32 32 ILE N N 32 122.300 120.861 1.439 1
1 341 . 13 1 1 A 33 33 SER H H 33 8.230 8.699 -0.469 1
1 342 . 13 1 1 A 33 33 SER HA H 33 4.400 4.471 -0.071 1
1 345 . 13 1 1 A 33 33 SER C C 33 174.800 176.201 -1.401 1
1 346 . 13 1 1 A 33 33 SER CA C 33 58.300 60.536 -2.236 1
1 347 . 13 1 1 A 33 33 SER CB C 33 63.700 63.540 0.160 1
1 348 . 13 1 1 A 33 33 SER N N 33 119.600 122.054 -2.454 1
1 349 . 13 1 1 A 34 34 ALA H H 34 8.430 8.325 0.105 1
1 350 . 13 1 1 A 34 34 ALA HA H 34 4.220 4.045 0.175 1
1 354 . 13 1 1 A 34 34 ALA C C 34 179.500 180.037 -0.537 1
1 355 . 13 1 1 A 34 34 ALA CA C 34 53.500 55.333 -1.833 1
1 356 . 13 1 1 A 34 34 ALA CB C 34 18.800 18.480 0.320 1
1 357 . 13 1 1 A 34 34 ALA N N 34 126.000 123.899 2.101 1
1 358 . 13 1 1 A 35 35 ASP H H 35 8.380 8.310 0.070 1
1 359 . 13 1 1 A 35 35 ASP HA H 35 4.520 4.320 0.200 1
1 362 . 13 1 1 A 35 35 ASP C C 35 176.500 178.067 -1.567 1
1 363 . 13 1 1 A 35 35 ASP CA C 35 54.800 56.629 -1.829 1
1 364 . 13 1 1 A 35 35 ASP CB C 35 40.200 40.667 -0.467 1
1 365 . 13 1 1 A 35 35 ASP N N 35 118.200 117.029 1.171 1
1 366 . 13 1 1 A 36 36 LYS H H 36 8.000 7.835 0.165 1
1 367 . 13 1 1 A 36 36 LYS HA H 36 4.270 4.114 0.156 1
1 376 . 13 1 1 A 36 36 LYS C C 36 177.000 176.907 0.093 1
1 377 . 13 1 1 A 36 36 LYS CA C 36 56.800 58.516 -1.716 1
1 378 . 13 1 1 A 36 36 LYS CB C 36 32.900 32.304 0.596 1
1 382 . 13 1 1 A 36 36 LYS N N 36 120.900 119.009 1.891 1
1 383 . 13 1 1 A 37 37 ILE H H 37 7.970 7.365 0.605 1
1 384 . 13 1 1 A 37 37 ILE HA H 37 4.020 4.104 -0.084 1
1 394 . 13 1 1 A 37 37 ILE C C 37 176.100 175.016 1.084 1
1 395 . 13 1 1 A 37 37 ILE CA C 37 61.300 61.570 -0.270 1
1 396 . 13 1 1 A 37 37 ILE CB C 37 38.100 37.595 0.505 1
1 400 . 13 1 1 A 37 37 ILE N N 37 121.800 122.115 -0.315 1
1 401 . 13 1 1 A 38 38 SER H H 38 7.980 8.979 -0.999 1
1 402 . 13 1 1 A 38 38 SER HA H 38 4.540 4.625 -0.085 1
1 405 . 13 1 1 A 38 38 SER C C 38 174.700 175.455 -0.755 1
1 406 . 13 1 1 A 38 38 SER CA C 38 58.200 58.006 0.194 1
1 407 . 13 1 1 A 38 38 SER CB C 38 64.400 64.165 0.235 1
1 408 . 13 1 1 A 38 38 SER N N 38 119.000 124.365 -5.365 1
1 409 . 13 1 1 A 39 39 LYS H H 39 8.690 9.025 -0.335 1
1 410 . 13 1 1 A 39 39 LYS HA H 39 3.400 3.539 -0.139 1
1 419 . 13 1 1 A 39 39 LYS C C 39 177.400 178.104 -0.704 1
1 420 . 13 1 1 A 39 39 LYS CA C 39 59.800 60.396 -0.596 1
1 421 . 13 1 1 A 39 39 LYS CB C 39 32.400 32.148 0.252 1
1 425 . 13 1 1 A 39 39 LYS N N 39 124.200 125.175 -0.975 1
1 426 . 13 1 1 A 40 40 GLU H H 40 8.280 8.329 -0.049 1
1 427 . 13 1 1 A 40 40 GLU HA H 40 3.840 4.074 -0.234 1
1 432 . 13 1 1 A 40 40 GLU C C 40 178.400 178.758 -0.358 1
1 433 . 13 1 1 A 40 40 GLU CA C 40 59.400 59.178 0.222 1
1 434 . 13 1 1 A 40 40 GLU CB C 40 28.300 29.386 -1.086 1
1 436 . 13 1 1 A 40 40 GLU N N 40 116.300 117.276 -0.976 1
1 437 . 13 1 1 A 41 41 ALA H H 41 7.890 7.882 0.008 1
1 438 . 13 1 1 A 41 41 ALA HA H 41 3.910 4.074 -0.164 1
1 442 . 13 1 1 A 41 41 ALA C C 41 179.900 179.685 0.215 1
1 443 . 13 1 1 A 41 41 ALA CA C 41 54.700 55.088 -0.388 1
1 444 . 13 1 1 A 41 41 ALA CB C 41 17.900 18.438 -0.538 1
1 445 . 13 1 1 A 41 41 ALA N N 41 122.300 122.452 -0.152 1
1 446 . 13 1 1 A 42 42 LEU H H 42 7.490 7.665 -0.175 1
1 447 . 13 1 1 A 42 42 LEU HA H 42 3.480 3.802 -0.322 1
1 457 . 13 1 1 A 42 42 LEU C C 42 178.900 178.562 0.338 1
1 458 . 13 1 1 A 42 42 LEU CA C 42 59.800 57.561 2.239 1
1 459 . 13 1 1 A 42 42 LEU CB C 42 42.300 41.406 0.894 1
1 463 . 13 1 1 A 42 42 LEU N N 42 121.000 119.562 1.438 1
1 464 . 13 1 1 A 43 43 LEU H H 43 8.290 8.043 0.247 1
1 465 . 13 1 1 A 43 43 LEU HA H 43 3.780 3.845 -0.065 1
1 475 . 13 1 1 A 43 43 LEU C C 43 179.400 179.046 0.354 1
1 476 . 13 1 1 A 43 43 LEU CA C 43 57.600 57.956 -0.356 1
1 477 . 13 1 1 A 43 43 LEU CB C 43 40.900 41.140 -0.240 1
1 481 . 13 1 1 A 43 43 LEU N N 43 119.200 117.984 1.216 1
1 482 . 13 1 1 A 44 44 GLU H H 44 8.330 8.323 0.007 1
1 483 . 13 1 1 A 44 44 GLU HA H 44 4.050 3.871 0.179 1
1 488 . 13 1 1 A 44 44 GLU C C 44 178.600 179.225 -0.625 1
1 489 . 13 1 1 A 44 44 GLU CA C 44 58.900 59.315 -0.415 1
1 490 . 13 1 1 A 44 44 GLU CB C 44 28.300 29.417 -1.117 1
1 492 . 13 1 1 A 44 44 GLU N N 44 119.600 118.038 1.562 1
1 493 . 13 1 1 A 45 45 CYS H H 45 7.690 7.882 -0.192 1
1 494 . 13 1 1 A 45 45 CYS HA H 45 4.120 4.036 0.084 1
1 497 . 13 1 1 A 45 45 CYS C C 45 176.100 176.787 -0.687 1
1 498 . 13 1 1 A 45 45 CYS CA C 45 62.500 62.456 0.044 1
1 499 . 13 1 1 A 45 45 CYS CB C 45 26.200 26.108 0.092 1
1 500 . 13 1 1 A 45 45 CYS N N 45 120.900 118.775 2.125 1
1 501 . 13 1 1 A 46 46 ALA H H 46 8.540 8.032 0.508 1
1 502 . 13 1 1 A 46 46 ALA HA H 46 3.900 3.882 0.018 1
1 506 . 13 1 1 A 46 46 ALA C C 46 179.200 178.873 0.327 1
1 507 . 13 1 1 A 46 46 ALA CA C 46 55.500 55.506 -0.006 1
1 508 . 13 1 1 A 46 46 ALA CB C 46 16.800 18.066 -1.266 1
1 509 . 13 1 1 A 46 46 ALA N N 46 121.500 122.294 -0.794 1
1 510 . 13 1 1 A 47 47 ASP H H 47 8.460 8.074 0.386 1
1 511 . 13 1 1 A 47 47 ASP HA H 47 4.340 4.311 0.029 1
1 514 . 13 1 1 A 47 47 ASP C C 47 178.800 178.736 0.064 1
1 515 . 13 1 1 A 47 47 ASP CA C 47 56.600 57.495 -0.895 1
1 516 . 13 1 1 A 47 47 ASP CB C 47 39.800 42.326 -2.526 1
1 517 . 13 1 1 A 47 47 ASP N N 47 119.000 118.480 0.520 1
1 518 . 13 1 1 A 48 48 LEU H H 48 8.040 7.646 0.394 1
1 519 . 13 1 1 A 48 48 LEU HA H 48 4.110 3.951 0.159 1
1 529 . 13 1 1 A 48 48 LEU C C 48 180.000 179.398 0.602 1
1 530 . 13 1 1 A 48 48 LEU CA C 48 58.000 58.314 -0.314 1
1 531 . 13 1 1 A 48 48 LEU CB C 48 41.700 41.551 0.149 1
1 535 . 13 1 1 A 48 48 LEU N N 48 123.000 120.225 2.775 1
1 536 . 13 1 1 A 49 49 LEU H H 49 8.300 7.865 0.435 1
1 537 . 13 1 1 A 49 49 LEU HA H 49 4.110 3.822 0.288 1
1 547 . 13 1 1 A 49 49 LEU C C 49 177.200 178.842 -1.642 1
1 548 . 13 1 1 A 49 49 LEU CA C 49 57.600 58.089 -0.489 1
1 549 . 13 1 1 A 49 49 LEU CB C 49 41.200 41.826 -0.626 1
1 553 . 13 1 1 A 49 49 LEU N N 49 120.900 119.126 1.774 1
1 554 . 13 1 1 A 50 50 SER H H 50 8.660 8.087 0.573 1
1 555 . 13 1 1 A 50 50 SER HA H 50 4.000 4.202 -0.202 1
1 558 . 13 1 1 A 50 50 SER C C 50 176.800 176.607 0.193 1
1 559 . 13 1 1 A 50 50 SER CA C 50 62.500 61.633 0.867 1
1 560 . 13 1 1 A 50 50 SER CB C 50 62.600 62.292 0.308 1
1 561 . 13 1 1 A 50 50 SER N N 50 113.300 112.804 0.496 1
1 562 . 13 1 1 A 51 51 SER H H 51 7.980 8.006 -0.026 1
1 563 . 13 1 1 A 51 51 SER HA H 51 4.220 4.076 0.144 1
1 566 . 13 1 1 A 51 51 SER C C 51 176.300 177.039 -0.739 1
1 567 . 13 1 1 A 51 51 SER CA C 51 61.200 61.411 -0.211 1
1 568 . 13 1 1 A 51 51 SER CB C 51 62.700 63.040 -0.340 1
1 569 . 13 1 1 A 51 51 SER N N 51 115.900 116.611 -0.711 1
1 570 . 13 1 1 A 52 52 ALA H H 52 8.030 8.139 -0.109 1
1 571 . 13 1 1 A 52 52 ALA HA H 52 4.130 4.114 0.016 1
1 575 . 13 1 1 A 52 52 ALA C C 52 178.500 180.180 -1.680 1
1 576 . 13 1 1 A 52 52 ALA CA C 52 54.500 54.935 -0.435 1
1 577 . 13 1 1 A 52 52 ALA CB C 52 18.000 18.402 -0.402 1
1 578 . 13 1 1 A 52 52 ALA N N 52 125.400 123.508 1.892 1
1 579 . 13 1 1 A 53 53 LEU H H 53 7.710 7.882 -0.172 1
1 580 . 13 1 1 A 53 53 LEU HA H 53 4.180 4.135 0.045 1
1 590 . 13 1 1 A 53 53 LEU C C 53 177.700 178.141 -0.441 1
1 591 . 13 1 1 A 53 53 LEU CA C 53 56.500 57.122 -0.622 1
1 592 . 13 1 1 A 53 53 LEU CB C 53 42.400 41.581 0.819 1
1 596 . 13 1 1 A 53 53 LEU N N 53 113.800 118.338 -4.538 1
1 597 . 13 1 1 A 54 54 THR H H 54 7.550 7.628 -0.078 1
1 598 . 13 1 1 A 54 54 THR HA H 54 4.420 4.344 0.076 1
1 603 . 13 1 1 A 54 54 THR C C 54 174.100 173.202 0.898 1
1 604 . 13 1 1 A 54 54 THR CA C 54 61.600 62.251 -0.651 1
1 605 . 13 1 1 A 54 54 THR CB C 54 69.300 69.431 -0.131 1
1 607 . 13 1 1 A 54 54 THR N N 54 107.700 107.544 0.156 1
1 608 . 13 1 1 A 55 55 GLU H H 55 7.750 7.713 0.037 1
1 609 . 13 1 1 A 55 55 GLU HA H 55 4.760 4.973 -0.213 1
1 614 . 13 1 1 A 55 55 GLU CA C 55 53.400 53.556 -0.156 1
1 615 . 13 1 1 A 55 55 GLU CB C 55 30.100 32.377 -2.277 1
1 617 . 13 1 1 A 55 55 GLU N N 55 122.800 118.296 4.504 1
1 618 . 13 1 1 A 56 56 PRO HA H 56 4.670 4.644 0.026 1
1 625 . 13 1 1 A 56 56 PRO C C 56 176.200 176.384 -0.184 1
1 626 . 13 1 1 A 56 56 PRO CA C 56 62.900 63.223 -0.323 1
1 627 . 13 1 1 A 56 56 PRO CB C 56 29.200 31.810 -2.610 1
1 630 . 13 1 1 A 57 57 VAL H H 57 8.010 8.362 -0.352 1
1 631 . 13 1 1 A 57 57 VAL HA H 57 4.590 4.934 -0.344 1
1 639 . 13 1 1 A 57 57 VAL CA C 57 58.600 58.302 0.298 1
1 640 . 13 1 1 A 57 57 VAL CB C 57 32.800 34.589 -1.789 1
1 643 . 13 1 1 A 57 57 VAL N N 57 121.400 117.193 4.207 1
1 644 . 13 1 1 A 58 58 PRO HA H 58 4.450 5.106 -0.656 1
1 651 . 13 1 1 A 58 58 PRO C C 58 177.500 177.909 -0.409 1
1 652 . 13 1 1 A 58 58 PRO CA C 58 62.600 62.811 -0.211 1
1 653 . 13 1 1 A 58 58 PRO CB C 58 32.200 32.382 -0.182 1
1 656 . 13 1 1 A 59 59 ASN H H 59 8.890 9.341 -0.451 1
1 657 . 13 1 1 A 59 59 ASN HA H 59 4.330 4.442 -0.112 1
1 662 . 13 1 1 A 59 59 ASN C C 59 177.600 177.178 0.422 1
1 663 . 13 1 1 A 59 59 ASN CA C 59 56.300 56.276 0.024 1
1 664 . 13 1 1 A 59 59 ASN CB C 59 38.400 38.957 -0.557 1
1 665 . 13 1 1 A 59 59 ASN N N 59 122.200 123.625 -1.425 1
1 667 . 13 1 1 A 60 60 SER H H 60 8.660 8.212 0.448 1
1 668 . 13 1 1 A 60 60 SER HA H 60 4.010 4.082 -0.072 1
1 671 . 13 1 1 A 60 60 SER C C 60 176.200 177.345 -1.145 1
1 672 . 13 1 1 A 60 60 SER CA C 60 60.800 61.437 -0.637 1
1 673 . 13 1 1 A 60 60 SER CB C 60 61.500 63.091 -1.591 1
1 674 . 13 1 1 A 60 60 SER N N 60 113.200 113.084 0.116 1
1 675 . 13 1 1 A 61 61 GLN H H 61 7.420 7.752 -0.332 1
1 676 . 13 1 1 A 61 61 GLN HA H 61 4.280 4.022 0.258 1
1 683 . 13 1 1 A 61 61 GLN C C 61 178.600 178.520 0.080 1
1 684 . 13 1 1 A 61 61 GLN CA C 61 57.900 58.820 -0.920 1
1 685 . 13 1 1 A 61 61 GLN CB C 61 28.600 28.210 0.390 1
1 687 . 13 1 1 A 61 61 GLN N N 61 122.200 120.321 1.879 1
1 689 . 13 1 1 A 62 62 LEU H H 62 7.430 7.841 -0.411 1
1 690 . 13 1 1 A 62 62 LEU HA H 62 3.850 4.046 -0.196 1
1 700 . 13 1 1 A 62 62 LEU C C 62 178.800 179.039 -0.239 1
1 701 . 13 1 1 A 62 62 LEU CA C 62 57.900 58.095 -0.195 1
1 702 . 13 1 1 A 62 62 LEU CB C 62 42.100 42.241 -0.141 1
1 706 . 13 1 1 A 62 62 LEU N N 62 120.600 119.960 0.640 1
1 707 . 13 1 1 A 63 63 VAL H H 63 8.200 8.165 0.035 1
1 708 . 13 1 1 A 63 63 VAL HA H 63 3.370 3.502 -0.132 1
1 716 . 13 1 1 A 63 63 VAL C C 63 178.000 178.010 -0.010 1
1 717 . 13 1 1 A 63 63 VAL CA C 63 66.600 67.043 -0.443 1
1 718 . 13 1 1 A 63 63 VAL CB C 63 31.700 31.284 0.416 1
1 721 . 13 1 1 A 63 63 VAL N N 63 118.200 117.695 0.505 1
1 722 . 13 1 1 A 64 64 ASP H H 64 7.960 8.469 -0.509 1
1 723 . 13 1 1 A 64 64 ASP HA H 64 4.460 4.357 0.103 1
1 726 . 13 1 1 A 64 64 ASP C C 64 178.100 178.551 -0.451 1
1 727 . 13 1 1 A 64 64 ASP CA C 64 57.700 57.381 0.319 1
1 728 . 13 1 1 A 64 64 ASP CB C 64 39.800 41.300 -1.500 1
1 729 . 13 1 1 A 64 64 ASP N N 64 120.200 120.335 -0.135 1
1 730 . 13 1 1 A 65 65 THR H H 65 8.380 8.454 -0.074 1
1 731 . 13 1 1 A 65 65 THR HA H 65 3.970 3.997 -0.027 1
1 736 . 13 1 1 A 65 65 THR C C 65 176.500 177.331 -0.831 1
1 737 . 13 1 1 A 65 65 THR CA C 65 66.500 66.775 -0.275 1
1 738 . 13 1 1 A 65 65 THR CB C 65 67.800 67.962 -0.162 1
1 740 . 13 1 1 A 65 65 THR N N 65 118.100 115.130 2.970 1
1 741 . 13 1 1 A 66 66 GLY H H 66 8.900 8.644 0.256 1
1 742 . 13 1 1 A 66 66 GLY HA2 H 66 3.630 3.759 -0.129 1
1 743 . 13 1 1 A 66 66 GLY HA3 H 66 3.630 3.773 -0.143 1
1 744 . 13 1 1 A 66 66 GLY C C 66 174.200 175.617 -1.417 1
1 745 . 13 1 1 A 66 66 GLY CA C 66 47.500 46.995 0.505 1
1 746 . 13 1 1 A 66 66 GLY N N 66 110.500 107.871 2.629 1
1 747 . 13 1 1 A 67 67 HIS H H 67 8.650 8.265 0.385 1
1 748 . 13 1 1 A 67 67 HIS HA H 67 4.220 4.173 0.047 1
1 752 . 13 1 1 A 67 67 HIS C C 67 176.900 177.603 -0.703 1
1 753 . 13 1 1 A 67 67 HIS CA C 67 59.000 59.209 -0.209 1
1 754 . 13 1 1 A 67 67 HIS CB C 67 27.800 29.690 -1.890 1
1 756 . 13 1 1 A 67 67 HIS N N 67 120.100 122.115 -2.015 1
1 757 . 13 1 1 A 68 68 GLN H H 68 7.860 8.443 -0.583 1
1 758 . 13 1 1 A 68 68 GLN HA H 68 3.990 3.993 -0.003 1
1 765 . 13 1 1 A 68 68 GLN C C 68 177.800 178.025 -0.225 1
1 766 . 13 1 1 A 68 68 GLN CA C 68 58.800 58.594 0.206 1
1 767 . 13 1 1 A 68 68 GLN CB C 68 28.200 27.458 0.742 1
1 769 . 13 1 1 A 68 68 GLN N N 68 121.400 116.854 4.546 1
1 771 . 13 1 1 A 69 69 LEU H H 69 8.300 7.794 0.506 1
1 772 . 13 1 1 A 69 69 LEU HA H 69 4.330 4.069 0.261 1
1 782 . 13 1 1 A 69 69 LEU C C 69 179.300 179.939 -0.639 1
1 783 . 13 1 1 A 69 69 LEU CA C 69 58.200 58.148 0.052 1
1 784 . 13 1 1 A 69 69 LEU CB C 69 40.500 41.045 -0.545 1
1 788 . 13 1 1 A 69 69 LEU N N 69 120.300 121.825 -1.525 1
1 789 . 13 1 1 A 70 70 LEU H H 70 8.460 7.775 0.685 1
1 790 . 13 1 1 A 70 70 LEU HA H 70 3.880 3.968 -0.088 1
1 800 . 13 1 1 A 70 70 LEU C C 70 179.100 179.030 0.070 1
1 801 . 13 1 1 A 70 70 LEU CA C 70 58.300 58.105 0.195 1
1 802 . 13 1 1 A 70 70 LEU CB C 70 41.500 40.547 0.953 1
1 806 . 13 1 1 A 70 70 LEU N N 70 121.200 120.191 1.009 1
1 807 . 13 1 1 A 71 71 ASP H H 71 8.140 8.035 0.105 1
1 808 . 13 1 1 A 71 71 ASP HA H 71 4.420 4.272 0.148 1
1 811 . 13 1 1 A 71 71 ASP C C 71 180.000 178.224 1.776 1
1 812 . 13 1 1 A 71 71 ASP CA C 71 57.300 57.324 -0.024 1
1 813 . 13 1 1 A 71 71 ASP CB C 71 39.300 41.396 -2.096 1
1 814 . 13 1 1 A 71 71 ASP N N 71 121.100 119.360 1.740 1
1 815 . 13 1 1 A 72 72 TYR H H 72 8.320 8.357 -0.037 1
1 816 . 13 1 1 A 72 72 TYR HA H 72 4.550 4.455 0.095 1
1 823 . 13 1 1 A 72 72 TYR C C 72 179.100 178.636 0.464 1
1 824 . 13 1 1 A 72 72 TYR CA C 72 60.500 60.856 -0.356 1
1 825 . 13 1 1 A 72 72 TYR CB C 72 37.600 38.061 -0.461 1
1 828 . 13 1 1 A 72 72 TYR N N 72 120.300 117.638 2.662 1
1 829 . 13 1 1 A 73 73 CYS H H 73 8.850 8.559 0.291 1
1 830 . 13 1 1 A 73 73 CYS HA H 73 4.380 4.593 -0.213 1
1 834 . 13 1 1 A 73 73 CYS C C 73 177.300 177.261 0.039 1
1 835 . 13 1 1 A 73 73 CYS CA C 73 64.400 63.299 1.101 1
1 836 . 13 1 1 A 73 73 CYS CB C 73 27.600 26.278 1.322 1
1 837 . 13 1 1 A 73 73 CYS N N 73 116.800 118.634 -1.834 1
1 838 . 13 1 1 A 74 74 SER H H 74 8.410 8.430 -0.020 1
1 839 . 13 1 1 A 74 74 SER HA H 74 4.290 4.275 0.015 1
1 842 . 13 1 1 A 74 74 SER C C 74 176.300 177.070 -0.770 1
1 843 . 13 1 1 A 74 74 SER CA C 74 61.400 61.288 0.112 1
1 844 . 13 1 1 A 74 74 SER CB C 74 62.600 63.004 -0.404 1
1 845 . 13 1 1 A 74 74 SER N N 74 115.900 116.055 -0.155 1
1 846 . 13 1 1 A 75 75 GLY H H 75 7.790 8.077 -0.287 1
1 847 . 13 1 1 A 75 75 GLY HA2 H 75 4.320 3.801 0.519 1
1 848 . 13 1 1 A 75 75 GLY HA3 H 75 3.900 3.807 0.093 1
1 849 . 13 1 1 A 75 75 GLY C C 75 174.600 175.462 -0.862 1
1 850 . 13 1 1 A 75 75 GLY CA C 75 45.600 46.950 -1.350 1
1 851 . 13 1 1 A 75 75 GLY N N 75 107.500 107.457 0.043 1
1 852 . 13 1 1 A 76 76 TYR H H 76 8.040 8.524 -0.484 1
1 853 . 13 1 1 A 76 76 TYR HA H 76 4.310 4.040 0.270 1
1 860 . 13 1 1 A 76 76 TYR C C 76 176.200 177.789 -1.589 1
1 861 . 13 1 1 A 76 76 TYR CA C 76 60.000 61.124 -1.124 1
1 862 . 13 1 1 A 76 76 TYR CB C 76 40.700 38.682 2.018 1
1 865 . 13 1 1 A 76 76 TYR N N 76 121.900 123.753 -1.853 1
1 866 . 13 1 1 A 77 77 VAL H H 77 7.540 8.364 -0.824 1
1 867 . 13 1 1 A 77 77 VAL HA H 77 3.450 3.477 -0.027 1
1 875 . 13 1 1 A 77 77 VAL C C 77 175.500 177.223 -1.723 1
1 876 . 13 1 1 A 77 77 VAL CA C 77 65.500 64.177 1.323 1
1 877 . 13 1 1 A 77 77 VAL CB C 77 31.600 31.352 0.248 1
1 880 . 13 1 1 A 77 77 VAL N N 77 116.600 119.466 -2.866 1
1 881 . 13 1 1 A 78 78 ASP H H 78 7.580 7.975 -0.395 1
1 882 . 13 1 1 A 78 78 ASP HA H 78 4.380 4.319 0.061 1
1 885 . 13 1 1 A 78 78 ASP C C 78 177.000 177.702 -0.702 1
1 886 . 13 1 1 A 78 78 ASP CA C 78 55.800 57.761 -1.961 1
1 887 . 13 1 1 A 78 78 ASP CB C 78 39.900 41.958 -2.058 1
1 888 . 13 1 1 A 78 78 ASP N N 78 116.400 121.095 -4.695 1
1 889 . 13 1 1 A 79 79 CYS H H 79 8.040 7.622 0.418 1
1 890 . 13 1 1 A 79 79 CYS HA H 79 4.110 4.368 -0.258 1
1 893 . 13 1 1 A 79 79 CYS C C 79 174.200 174.937 -0.737 1
1 894 . 13 1 1 A 79 79 CYS CA C 79 58.600 60.503 -1.903 1
1 895 . 13 1 1 A 79 79 CYS CB C 79 27.200 28.034 -0.834 1
1 896 . 13 1 1 A 79 79 CYS N N 79 117.000 114.785 2.215 1
1 897 . 13 1 1 A 80 80 ILE H H 80 6.960 6.889 0.071 1
1 898 . 13 1 1 A 80 80 ILE HA H 80 4.120 4.060 0.060 1
1 908 . 13 1 1 A 80 80 ILE CA C 80 58.700 59.688 -0.988 1
1 909 . 13 1 1 A 80 80 ILE CB C 80 38.500 37.958 0.542 1
1 913 . 13 1 1 A 80 80 ILE N N 80 123.200 122.302 0.898 1
1 914 . 13 1 1 A 81 81 PRO HA H 81 4.340 4.483 -0.143 1
1 921 . 13 1 1 A 81 81 PRO C C 81 178.000 176.215 1.785 1
1 922 . 13 1 1 A 81 81 PRO CA C 81 64.700 64.574 0.126 1
1 923 . 13 1 1 A 81 81 PRO CB C 81 32.600 32.116 0.484 1
1 926 . 13 1 1 A 82 82 GLN H H 82 7.560 8.101 -0.541 1
1 927 . 13 1 1 A 82 82 GLN HA H 82 4.600 4.409 0.191 1
1 934 . 13 1 1 A 82 82 GLN C C 82 177.400 175.794 1.606 1
1 935 . 13 1 1 A 82 82 GLN CA C 82 55.600 55.690 -0.090 1
1 936 . 13 1 1 A 82 82 GLN CB C 82 28.800 29.221 -0.421 1
1 938 . 13 1 1 A 82 82 GLN N N 82 115.900 117.605 -1.705 1
1 940 . 13 1 1 A 83 83 THR H H 83 8.880 8.450 0.430 1
1 941 . 13 1 1 A 83 83 THR HA H 83 3.750 3.960 -0.210 1
1 946 . 13 1 1 A 83 83 THR C C 83 176.300 176.510 -0.210 1
1 947 . 13 1 1 A 83 83 THR CA C 83 66.500 66.522 -0.022 1
1 948 . 13 1 1 A 83 83 THR CB C 83 68.700 68.769 -0.069 1
1 950 . 13 1 1 A 83 83 THR N N 83 122.700 119.474 3.226 1
1 951 . 13 1 1 A 84 84 ARG H H 84 8.990 8.169 0.821 1
1 952 . 13 1 1 A 84 84 ARG HA H 84 4.250 4.050 0.200 1
1 960 . 13 1 1 A 84 84 ARG C C 84 178.900 178.737 0.163 1
1 961 . 13 1 1 A 84 84 ARG CA C 84 59.100 59.615 -0.515 1
1 962 . 13 1 1 A 84 84 ARG CB C 84 29.300 30.164 -0.864 1
1 965 . 13 1 1 A 84 84 ARG N N 84 120.100 122.147 -2.047 1
1 967 . 13 1 1 A 85 85 ASN H H 85 7.270 8.297 -1.027 1
1 968 . 13 1 1 A 85 85 ASN HA H 85 4.810 4.619 0.191 1
1 973 . 13 1 1 A 85 85 ASN C C 85 176.800 177.741 -0.941 1
1 974 . 13 1 1 A 85 85 ASN CA C 85 54.800 56.446 -1.646 1
1 975 . 13 1 1 A 85 85 ASN CB C 85 37.600 38.271 -0.671 1
1 976 . 13 1 1 A 85 85 ASN N N 85 117.400 118.414 -1.014 1
1 978 . 13 1 1 A 86 86 LYS H H 86 8.340 8.276 0.064 1
1 979 . 13 1 1 A 86 86 LYS HA H 86 3.890 4.058 -0.168 1
1 988 . 13 1 1 A 86 86 LYS C C 86 178.600 178.866 -0.266 1
1 989 . 13 1 1 A 86 86 LYS CA C 86 60.800 59.041 1.759 1
1 990 . 13 1 1 A 86 86 LYS CB C 86 32.700 32.125 0.575 1
1 994 . 13 1 1 A 86 86 LYS N N 86 124.200 120.699 3.501 1
1 995 . 13 1 1 A 87 87 PHE H H 87 8.120 8.697 -0.577 1
1 996 . 13 1 1 A 87 87 PHE HA H 87 4.260 4.294 -0.034 1
1 1004 . 13 1 1 A 87 87 PHE C C 87 178.100 177.558 0.542 1
1 1005 . 13 1 1 A 87 87 PHE CA C 87 61.300 61.720 -0.420 1
1 1006 . 13 1 1 A 87 87 PHE CB C 87 38.200 39.170 -0.970 1
1 1010 . 13 1 1 A 87 87 PHE N N 87 118.300 121.068 -2.768 1
1 1011 . 13 1 1 A 88 88 ALA H H 88 7.860 7.961 -0.101 1
1 1012 . 13 1 1 A 88 88 ALA HA H 88 4.200 4.161 0.039 1
1 1016 . 13 1 1 A 88 88 ALA C C 88 180.600 179.899 0.701 1
1 1017 . 13 1 1 A 88 88 ALA CA C 88 54.900 55.021 -0.121 1
1 1018 . 13 1 1 A 88 88 ALA CB C 88 18.100 18.042 0.058 1
1 1019 . 13 1 1 A 88 88 ALA N N 88 121.700 120.823 0.877 1
1 1020 . 13 1 1 A 89 89 PHE H H 89 8.690 8.547 0.143 1
1 1021 . 13 1 1 A 89 89 PHE HA H 89 4.080 4.173 -0.093 1
1 1029 . 13 1 1 A 89 89 PHE C C 89 176.300 177.691 -1.391 1
1 1030 . 13 1 1 A 89 89 PHE CA C 89 62.000 61.167 0.833 1
1 1031 . 13 1 1 A 89 89 PHE CB C 89 39.800 39.258 0.542 1
1 1035 . 13 1 1 A 89 89 PHE N N 89 120.100 120.495 -0.395 1
1 1036 . 13 1 1 A 90 90 ARG H H 90 8.560 8.577 -0.017 1
1 1037 . 13 1 1 A 90 90 ARG HA H 90 3.790 3.844 -0.054 1
1 1045 . 13 1 1 A 90 90 ARG C C 90 179.600 178.692 0.908 1
1 1046 . 13 1 1 A 90 90 ARG CA C 90 60.000 59.695 0.305 1
1 1047 . 13 1 1 A 90 90 ARG CB C 90 30.000 30.048 -0.048 1
1 1050 . 13 1 1 A 90 90 ARG N N 90 118.000 118.358 -0.358 1
1 1052 . 13 1 1 A 91 91 GLU H H 91 8.120 8.101 0.019 1
1 1053 . 13 1 1 A 91 91 GLU HA H 91 3.980 3.933 0.047 1
1 1058 . 13 1 1 A 91 91 GLU C C 91 178.400 178.924 -0.524 1
1 1059 . 13 1 1 A 91 91 GLU CA C 91 58.900 59.207 -0.307 1
1 1060 . 13 1 1 A 91 91 GLU CB C 91 28.800 29.091 -0.291 1
1 1062 . 13 1 1 A 91 91 GLU N N 91 119.300 118.335 0.965 1
1 1063 . 13 1 1 A 92 92 ALA H H 92 7.820 7.664 0.156 1
1 1064 . 13 1 1 A 92 92 ALA HA H 92 4.050 3.987 0.063 1
1 1068 . 13 1 1 A 92 92 ALA C C 92 179.800 179.737 0.063 1
1 1069 . 13 1 1 A 92 92 ALA CA C 92 55.000 55.140 -0.140 1
1 1070 . 13 1 1 A 92 92 ALA CB C 92 18.000 18.358 -0.358 1
1 1071 . 13 1 1 A 92 92 ALA N N 92 123.400 122.289 1.111 1
1 1072 . 13 1 1 A 93 93 VAL H H 93 8.430 7.958 0.472 1
1 1073 . 13 1 1 A 93 93 VAL HA H 93 3.250 3.321 -0.071 1
1 1081 . 13 1 1 A 93 93 VAL C C 93 177.900 177.975 -0.075 1
1 1082 . 13 1 1 A 93 93 VAL CA C 93 66.800 66.685 0.115 1
1 1083 . 13 1 1 A 93 93 VAL CB C 93 31.300 31.215 0.085 1
1 1086 . 13 1 1 A 93 93 VAL N N 93 119.900 118.681 1.219 1
1 1087 . 13 1 1 A 94 94 SER H H 94 7.990 7.919 0.071 1
1 1088 . 13 1 1 A 94 94 SER HA H 94 4.230 3.964 0.266 1
1 1091 . 13 1 1 A 94 94 SER C C 94 177.200 177.419 -0.219 1
1 1092 . 13 1 1 A 94 94 SER CA C 94 61.600 61.538 0.062 1
1 1093 . 13 1 1 A 94 94 SER CB C 94 62.700 62.776 -0.076 1
1 1094 . 13 1 1 A 94 94 SER N N 94 116.000 115.898 0.102 1
1 1095 . 13 1 1 A 95 95 LYS H H 95 7.710 7.526 0.184 1
1 1096 . 13 1 1 A 95 95 LYS HA H 95 4.020 4.027 -0.007 1
1 1105 . 13 1 1 A 95 95 LYS C C 95 179.400 179.188 0.212 1
1 1106 . 13 1 1 A 95 95 LYS CA C 95 59.600 59.334 0.266 1
1 1107 . 13 1 1 A 95 95 LYS CB C 95 32.300 32.367 -0.067 1
1 1111 . 13 1 1 A 95 95 LYS N N 95 121.400 121.936 -0.536 1
1 1112 . 13 1 1 A 96 96 LEU H H 96 8.270 7.987 0.283 1
1 1113 . 13 1 1 A 96 96 LEU HA H 96 4.040 3.948 0.092 1
1 1123 . 13 1 1 A 96 96 LEU C C 96 177.700 178.329 -0.629 1
1 1124 . 13 1 1 A 96 96 LEU CA C 96 58.600 58.094 0.506 1
1 1125 . 13 1 1 A 96 96 LEU CB C 96 41.000 41.830 -0.830 1
1 1129 . 13 1 1 A 96 96 LEU N N 96 124.800 120.897 3.903 1
1 1130 . 13 1 1 A 97 97 GLU H H 97 8.500 8.349 0.151 1
1 1131 . 13 1 1 A 97 97 GLU HA H 97 3.760 4.075 -0.315 1
1 1136 . 13 1 1 A 97 97 GLU C C 97 179.100 179.447 -0.347 1
1 1137 . 13 1 1 A 97 97 GLU CA C 97 59.900 59.028 0.872 1
1 1138 . 13 1 1 A 97 97 GLU CB C 97 28.700 29.310 -0.610 1
1 1140 . 13 1 1 A 97 97 GLU N N 97 119.000 117.327 1.673 1
1 1141 . 13 1 1 A 98 98 LEU H H 98 7.740 8.349 -0.609 1
1 1142 . 13 1 1 A 98 98 LEU HA H 98 4.110 3.986 0.124 1
1 1152 . 13 1 1 A 98 98 LEU C C 98 179.700 179.203 0.497 1
1 1153 . 13 1 1 A 98 98 LEU CA C 98 57.900 57.807 0.093 1
1 1154 . 13 1 1 A 98 98 LEU CB C 98 41.800 41.540 0.260 1
1 1158 . 13 1 1 A 98 98 LEU N N 98 119.200 121.202 -2.002 1
1 1159 . 13 1 1 A 99 99 SER H H 99 8.290 8.084 0.206 1
1 1160 . 13 1 1 A 99 99 SER HA H 99 4.220 4.259 -0.039 1
1 1163 . 13 1 1 A 99 99 SER C C 99 176.600 177.345 -0.745 1
1 1164 . 13 1 1 A 99 99 SER CA C 99 62.400 61.137 1.263 1
1 1165 . 13 1 1 A 99 99 SER CB C 99 63.200 63.019 0.181 1
1 1166 . 13 1 1 A 99 99 SER N N 99 116.300 113.817 2.483 1
1 1167 . 13 1 1 A 100 100 LEU H H 100 8.490 8.127 0.363 1
1 1168 . 13 1 1 A 100 100 LEU HA H 100 3.960 3.936 0.024 1
1 1178 . 13 1 1 A 100 100 LEU C C 100 179.300 179.335 -0.035 1
1 1179 . 13 1 1 A 100 100 LEU CA C 100 57.700 58.081 -0.381 1
1 1180 . 13 1 1 A 100 100 LEU CB C 100 41.300 41.232 0.068 1
1 1184 . 13 1 1 A 100 100 LEU N N 100 120.900 122.879 -1.979 1
1 1185 . 13 1 1 A 101 101 GLN H H 101 7.680 8.243 -0.563 1
1 1186 . 13 1 1 A 101 101 GLN HA H 101 4.100 3.978 0.122 1
1 1193 . 13 1 1 A 101 101 GLN C C 101 178.700 177.983 0.717 1
1 1194 . 13 1 1 A 101 101 GLN CA C 101 58.800 58.927 -0.127 1
1 1195 . 13 1 1 A 101 101 GLN CB C 101 27.900 27.743 0.157 1
1 1197 . 13 1 1 A 101 101 GLN N N 101 119.100 117.530 1.570 1
1 1199 . 13 1 1 A 102 102 GLU H H 102 7.850 8.136 -0.286 1
1 1200 . 13 1 1 A 102 102 GLU HA H 102 4.050 4.109 -0.059 1
1 1205 . 13 1 1 A 102 102 GLU C C 102 179.100 178.883 0.217 1
1 1206 . 13 1 1 A 102 102 GLU CA C 102 58.400 59.357 -0.957 1
1 1207 . 13 1 1 A 102 102 GLU CB C 102 28.600 29.140 -0.540 1
1 1209 . 13 1 1 A 102 102 GLU N N 102 118.400 119.226 -0.826 1
1 1210 . 13 1 1 A 103 103 LEU H H 103 8.080 8.151 -0.071 1
1 1211 . 13 1 1 A 103 103 LEU HA H 103 4.020 4.051 -0.031 1
1 1221 . 13 1 1 A 103 103 LEU C C 103 178.200 178.309 -0.109 1
1 1222 . 13 1 1 A 103 103 LEU CA C 103 57.000 57.912 -0.912 1
1 1223 . 13 1 1 A 103 103 LEU CB C 103 41.900 41.760 0.140 1
1 1227 . 13 1 1 A 103 103 LEU N N 103 120.600 123.262 -2.662 1
1 1228 . 13 1 1 A 104 104 GLN H H 104 7.900 8.157 -0.257 1
1 1229 . 13 1 1 A 104 104 GLN HA H 104 4.090 4.385 -0.295 1
1 1236 . 13 1 1 A 104 104 GLN C C 104 177.300 177.802 -0.502 1
1 1237 . 13 1 1 A 104 104 GLN CA C 104 58.100 58.467 -0.367 1
1 1238 . 13 1 1 A 104 104 GLN CB C 104 29.400 28.325 1.075 1
1 1240 . 13 1 1 A 104 104 GLN N N 104 117.700 116.887 0.813 1
1 1242 . 13 1 1 A 105 105 VAL H H 105 7.620 7.459 0.161 1
1 1243 . 13 1 1 A 105 105 VAL HA H 105 4.190 3.893 0.297 1
1 1251 . 13 1 1 A 105 105 VAL C C 105 176.800 176.769 0.031 1
1 1252 . 13 1 1 A 105 105 VAL CA C 105 62.600 64.601 -2.001 1
1 1253 . 13 1 1 A 105 105 VAL CB C 105 32.000 31.547 0.453 1
1 1256 . 13 1 1 A 105 105 VAL N N 105 114.900 116.030 -1.130 1
1 1257 . 13 1 1 A 106 106 SER H H 106 7.900 7.929 -0.029 1
1 1258 . 13 1 1 A 106 106 SER HA H 106 4.460 4.895 -0.435 1
1 1261 . 13 1 1 A 106 106 SER C C 106 175.000 175.150 -0.150 1
1 1262 . 13 1 1 A 106 106 SER CA C 106 58.900 57.902 0.998 1
1 1263 . 13 1 1 A 106 106 SER CB C 106 63.900 63.675 0.225 1
1 1264 . 13 1 1 A 106 106 SER N N 106 116.900 117.753 -0.853 1
1 1265 . 13 1 1 A 107 107 SER H H 107 8.230 7.687 0.543 1
1 1266 . 13 1 1 A 107 107 SER HA H 107 4.390 4.171 0.219 1
1 1269 . 13 1 1 A 107 107 SER C C 107 174.600 175.382 -0.782 1
1 1270 . 13 1 1 A 107 107 SER CA C 107 58.400 60.993 -2.593 1
1 1271 . 13 1 1 A 107 107 SER CB C 107 63.600 63.147 0.453 1
1 1272 . 13 1 1 A 107 107 SER N N 107 117.500 116.999 0.501 1
1 1273 . 13 1 1 A 108 108 ALA H H 108 8.080 7.748 0.332 1
1 1274 . 13 1 1 A 108 108 ALA HA H 108 4.280 3.906 0.374 1
1 1278 . 13 1 1 A 108 108 ALA C C 108 177.500 176.696 0.804 1
1 1279 . 13 1 1 A 108 108 ALA CA C 108 52.700 55.227 -2.527 1
1 1280 . 13 1 1 A 108 108 ALA CB C 108 19.200 17.644 1.556 1
1 1281 . 13 1 1 A 108 108 ALA N N 108 124.900 120.642 4.258 1
1 1282 . 13 1 1 A 109 109 ALA H H 109 8.080 8.262 -0.182 1
1 1283 . 13 1 1 A 109 109 ALA HA H 109 4.280 4.332 -0.052 1
1 1287 . 13 1 1 A 109 109 ALA C C 109 177.700 177.455 0.245 1
1 1288 . 13 1 1 A 109 109 ALA CA C 109 52.400 52.115 0.285 1
1 1289 . 13 1 1 A 109 109 ALA CB C 109 19.400 19.825 -0.425 1
1 1290 . 13 1 1 A 109 109 ALA N N 109 123.000 121.035 1.965 1
1 1291 . 13 1 1 A 110 110 ALA H H 110 8.300 8.605 -0.305 1
1 1292 . 13 1 1 A 110 110 ALA HA H 110 4.280 4.260 0.020 1
1 1296 . 13 1 1 A 110 110 ALA C C 110 178.200 178.090 0.110 1
1 1297 . 13 1 1 A 110 110 ALA CA C 110 52.700 54.852 -2.152 1
1 1298 . 13 1 1 A 110 110 ALA CB C 110 19.200 19.122 0.078 1
1 1299 . 13 1 1 A 110 110 ALA N N 110 123.200 122.331 0.869 1
1 1300 . 13 1 1 A 111 111 GLY H H 111 8.300 7.491 0.809 1
1 1301 . 13 1 1 A 111 111 GLY HA2 H 111 3.930 4.179 -0.249 1
1 1302 . 13 1 1 A 111 111 GLY HA3 H 111 3.940 4.179 -0.239 1
1 1303 . 13 1 1 A 111 111 GLY C C 111 173.700 172.448 1.252 1
1 1304 . 13 1 1 A 111 111 GLY CA C 111 45.100 45.622 -0.522 1
1 1305 . 13 1 1 A 111 111 GLY N N 111 108.000 102.384 5.616 1
1 1306 . 13 1 1 A 112 112 VAL H H 112 7.930 8.831 -0.901 1
1 1307 . 13 1 1 A 112 112 VAL HA H 112 4.420 4.558 -0.138 1
1 1315 . 13 1 1 A 112 112 VAL CA C 112 60.000 58.727 1.273 1
1 1316 . 13 1 1 A 112 112 VAL CB C 112 32.200 34.509 -2.309 1
1 1319 . 13 1 1 A 112 112 VAL N N 112 120.400 125.948 -5.548 1
1 1320 . 13 1 1 A 113 113 PRO HA H 113 4.370 4.288 0.082 1
1 1327 . 13 1 1 A 113 113 PRO C C 113 177.300 178.035 -0.735 1
1 1328 . 13 1 1 A 113 113 PRO CA C 113 63.900 63.934 -0.034 1
1 1329 . 13 1 1 A 113 113 PRO CB C 113 31.800 31.250 0.550 1
1 1332 . 13 1 1 A 114 114 GLY H H 114 8.570 8.888 -0.318 1
1 1333 . 13 1 1 A 114 114 GLY HA2 H 114 3.880 3.949 -0.069 1
1 1334 . 13 1 1 A 114 114 GLY HA3 H 114 4.120 3.950 0.170 1
1 1335 . 13 1 1 A 114 114 GLY C C 114 174.900 175.141 -0.241 1
1 1336 . 13 1 1 A 114 114 GLY CA C 114 45.200 46.077 -0.877 1
1 1337 . 13 1 1 A 114 114 GLY N N 114 109.000 113.131 -4.131 1
1 1338 . 13 1 1 A 115 115 THR H H 115 7.900 7.397 0.503 1
1 1339 . 13 1 1 A 115 115 THR HA H 115 4.400 4.003 0.397 1
1 1344 . 13 1 1 A 115 115 THR C C 115 174.300 174.021 0.279 1
1 1345 . 13 1 1 A 115 115 THR CA C 115 61.700 64.612 -2.912 1
1 1346 . 13 1 1 A 115 115 THR CB C 115 69.700 70.120 -0.420 1
1 1348 . 13 1 1 A 115 115 THR N N 115 111.400 115.668 -4.268 1
1 1349 . 13 1 1 A 116 116 ASN H H 116 8.450 8.063 0.387 1
1 1350 . 13 1 1 A 116 116 ASN HA H 116 4.970 5.073 -0.103 1
1 1355 . 13 1 1 A 116 116 ASN CA C 116 51.500 49.252 2.248 1
1 1356 . 13 1 1 A 116 116 ASN CB C 116 38.900 40.175 -1.275 1
1 1357 . 13 1 1 A 116 116 ASN N N 116 123.100 116.631 6.469 1
1 1359 . 13 1 1 A 117 117 PRO HA H 117 4.370 4.715 -0.345 1
1 1366 . 13 1 1 A 117 117 PRO C C 117 178.400 178.074 0.326 1
1 1367 . 13 1 1 A 117 117 PRO CA C 117 64.800 64.493 0.307 1
1 1368 . 13 1 1 A 117 117 PRO CB C 117 32.100 31.845 0.255 1
1 1371 . 13 1 1 A 118 118 VAL H H 118 7.750 7.509 0.241 1
1 1372 . 13 1 1 A 118 118 VAL HA H 118 3.810 3.773 0.037 1
1 1380 . 13 1 1 A 118 118 VAL C C 118 178.300 178.152 0.148 1
1 1381 . 13 1 1 A 118 118 VAL CA C 118 65.200 65.395 -0.195 1
1 1382 . 13 1 1 A 118 118 VAL CB C 118 31.500 31.570 -0.070 1
1 1385 . 13 1 1 A 118 118 VAL N N 118 118.300 116.380 1.920 1
1 1386 . 13 1 1 A 119 119 LEU H H 119 7.540 8.338 -0.798 1
1 1387 . 13 1 1 A 119 119 LEU HA H 119 4.030 3.871 0.159 1
1 1397 . 13 1 1 A 119 119 LEU C C 119 178.900 179.913 -1.013 1
1 1398 . 13 1 1 A 119 119 LEU CA C 119 57.800 57.763 0.037 1
1 1399 . 13 1 1 A 119 119 LEU CB C 119 40.700 40.955 -0.255 1
1 1403 . 13 1 1 A 119 119 LEU N N 119 119.700 120.346 -0.646 1
1 1404 . 13 1 1 A 120 120 ASN H H 120 8.080 8.347 -0.267 1
1 1405 . 13 1 1 A 120 120 ASN HA H 120 4.420 4.528 -0.108 1
1 1410 . 13 1 1 A 120 120 ASN C C 120 178.100 178.598 -0.498 1
1 1411 . 13 1 1 A 120 120 ASN CA C 120 56.100 56.495 -0.395 1
1 1412 . 13 1 1 A 120 120 ASN CB C 120 37.800 37.691 0.109 1
1 1413 . 13 1 1 A 120 120 ASN N N 120 117.700 118.267 -0.567 1
1 1415 . 13 1 1 A 121 121 ASN H H 121 8.120 7.988 0.132 1
1 1416 . 13 1 1 A 121 121 ASN HA H 121 4.490 4.507 -0.017 1
1 1421 . 13 1 1 A 121 121 ASN C C 121 178.000 178.174 -0.174 1
1 1422 . 13 1 1 A 121 121 ASN CA C 121 56.100 56.392 -0.292 1
1 1423 . 13 1 1 A 121 121 ASN CB C 121 37.800 38.520 -0.720 1
1 1424 . 13 1 1 A 121 121 ASN N N 121 120.000 118.571 1.429 1
1 1426 . 13 1 1 A 122 122 LEU H H 122 8.180 8.235 -0.055 1
1 1427 . 13 1 1 A 122 122 LEU HA H 122 4.050 3.894 0.156 1
1 1437 . 13 1 1 A 122 122 LEU C C 122 173.800 178.907 -5.107 1
1 1438 . 13 1 1 A 122 122 LEU CA C 122 58.500 58.071 0.429 1
1 1439 . 13 1 1 A 122 122 LEU CB C 122 41.900 41.461 0.439 1
1 1443 . 13 1 1 A 122 122 LEU N N 122 122.600 120.482 2.118 1
1 1444 . 13 1 1 A 123 123 LEU H H 123 8.260 8.112 0.148 1
1 1445 . 13 1 1 A 123 123 LEU HA H 123 3.850 3.967 -0.117 1
1 1455 . 13 1 1 A 123 123 LEU C C 123 178.900 178.519 0.381 1
1 1456 . 13 1 1 A 123 123 LEU CA C 123 58.500 58.047 0.453 1
1 1457 . 13 1 1 A 123 123 LEU CB C 123 41.200 41.309 -0.109 1
1 1461 . 13 1 1 A 123 123 LEU N N 123 119.700 120.865 -1.165 1
1 1462 . 13 1 1 A 124 124 SER H H 124 7.950 8.003 -0.053 1
1 1463 . 13 1 1 A 124 124 SER HA H 124 4.240 4.065 0.175 1
1 1466 . 13 1 1 A 124 124 SER C C 124 177.500 177.214 0.286 1
1 1467 . 13 1 1 A 124 124 SER CA C 124 61.600 61.778 -0.178 1
1 1468 . 13 1 1 A 124 124 SER CB C 124 62.600 62.872 -0.272 1
1 1469 . 13 1 1 A 124 124 SER N N 124 113.400 114.128 -0.728 1
1 1470 . 13 1 1 A 125 125 CYS H H 125 8.040 8.451 -0.411 1
1 1471 . 13 1 1 A 125 125 CYS HA H 125 4.350 4.115 0.235 1
1 1474 . 13 1 1 A 125 125 CYS C C 125 176.800 177.114 -0.314 1
1 1475 . 13 1 1 A 125 125 CYS CA C 125 62.600 63.772 -1.172 1
1 1476 . 13 1 1 A 125 125 CYS CB C 125 27.100 26.783 0.317 1
1 1477 . 13 1 1 A 125 125 CYS N N 125 119.800 119.337 0.463 1
1 1478 . 13 1 1 A 126 126 VAL H H 126 8.290 8.568 -0.278 1
1 1479 . 13 1 1 A 126 126 VAL HA H 126 3.430 3.470 -0.040 1
1 1487 . 13 1 1 A 126 126 VAL C C 126 177.800 178.041 -0.241 1
1 1488 . 13 1 1 A 126 126 VAL CA C 126 67.100 66.695 0.405 1
1 1489 . 13 1 1 A 126 126 VAL CB C 126 31.400 31.623 -0.223 1
1 1492 . 13 1 1 A 126 126 VAL N N 126 121.900 120.620 1.280 1
1 1493 . 13 1 1 A 127 127 GLN H H 127 8.200 8.160 0.040 1
1 1494 . 13 1 1 A 127 127 GLN HA H 127 3.970 4.013 -0.043 1
1 1501 . 13 1 1 A 127 127 GLN C C 127 178.200 178.517 -0.317 1
1 1502 . 13 1 1 A 127 127 GLN CA C 127 58.700 58.840 -0.140 1
1 1503 . 13 1 1 A 127 127 GLN CB C 127 27.800 28.056 -0.256 1
1 1505 . 13 1 1 A 127 127 GLN N N 127 119.700 117.658 2.042 1
1 1507 . 13 1 1 A 128 128 GLU H H 128 7.880 7.995 -0.115 1
1 1508 . 13 1 1 A 128 128 GLU HA H 128 4.200 4.115 0.085 1
1 1513 . 13 1 1 A 128 128 GLU C C 128 178.400 178.799 -0.399 1
1 1514 . 13 1 1 A 128 128 GLU CA C 128 59.000 58.855 0.145 1
1 1515 . 13 1 1 A 128 128 GLU CB C 128 28.400 29.385 -0.985 1
1 1517 . 13 1 1 A 128 128 GLU N N 128 119.800 119.112 0.688 1
1 1518 . 13 1 1 A 129 129 ILE H H 129 8.000 8.377 -0.377 1
1 1519 . 13 1 1 A 129 129 ILE HA H 129 3.460 3.659 -0.199 1
1 1529 . 13 1 1 A 129 129 ILE C C 129 176.800 178.096 -1.296 1
1 1530 . 13 1 1 A 129 129 ILE CA C 129 66.100 65.582 0.518 1
1 1531 . 13 1 1 A 129 129 ILE CB C 129 38.200 37.397 0.803 1
1 1535 . 13 1 1 A 129 129 ILE N N 129 119.500 120.182 -0.682 1
1 1536 . 13 1 1 A 130 130 SER H H 130 8.040 8.257 -0.217 1
1 1537 . 13 1 1 A 130 130 SER HA H 130 3.780 4.067 -0.287 1
1 1540 . 13 1 1 A 130 130 SER C C 130 176.200 176.945 -0.745 1
1 1541 . 13 1 1 A 130 130 SER CA C 130 62.100 61.676 0.424 1
1 1542 . 13 1 1 A 130 130 SER CB C 130 62.600 62.968 -0.368 1
1 1543 . 13 1 1 A 130 130 SER N N 130 112.800 115.811 -3.011 1
1 1544 . 13 1 1 A 131 131 ASP H H 131 8.270 8.078 0.192 1
1 1545 . 13 1 1 A 131 131 ASP HA H 131 4.310 4.295 0.015 1
1 1548 . 13 1 1 A 131 131 ASP C C 131 179.200 178.660 0.540 1
1 1549 . 13 1 1 A 131 131 ASP CA C 131 56.800 57.787 -0.987 1
1 1550 . 13 1 1 A 131 131 ASP CB C 131 40.900 41.796 -0.896 1
1 1551 . 13 1 1 A 131 131 ASP N N 131 119.600 121.028 -1.428 1
1 1552 . 13 1 1 A 132 132 VAL H H 132 8.470 8.230 0.240 1
1 1553 . 13 1 1 A 132 132 VAL HA H 132 3.520 3.739 -0.219 1
1 1561 . 13 1 1 A 132 132 VAL C C 132 178.700 178.678 0.022 1
1 1562 . 13 1 1 A 132 132 VAL CA C 132 66.500 66.463 0.037 1
1 1563 . 13 1 1 A 132 132 VAL CB C 132 31.500 31.687 -0.187 1
1 1566 . 13 1 1 A 132 132 VAL N N 132 118.100 118.899 -0.799 1
1 1567 . 13 1 1 A 133 133 VAL H H 133 8.140 8.199 -0.059 1
1 1568 . 13 1 1 A 133 133 VAL HA H 133 3.770 3.723 0.047 1
1 1576 . 13 1 1 A 133 133 VAL C C 133 176.500 176.741 -0.241 1
1 1577 . 13 1 1 A 133 133 VAL CA C 133 65.100 66.984 -1.884 1
1 1578 . 13 1 1 A 133 133 VAL CB C 133 31.600 31.551 0.049 1
1 1581 . 13 1 1 A 133 133 VAL N N 133 117.000 120.635 -3.635 1
1 1582 . 13 1 1 A 134 134 GLN H H 134 7.490 7.674 -0.184 1
1 1583 . 13 1 1 A 134 134 GLN HA H 134 4.350 4.373 -0.023 1
1 1590 . 13 1 1 A 134 134 GLN C C 134 175.400 176.215 -0.815 1
1 1591 . 13 1 1 A 134 134 GLN CA C 134 56.700 56.193 0.507 1
1 1592 . 13 1 1 A 134 134 GLN CB C 134 30.500 28.990 1.510 1
1 1594 . 13 1 1 A 134 134 GLN N N 134 116.300 117.976 -1.676 1
1 1 . 14 1 1 A 2 2 GLY HA2 H 2 3.890 3.752 0.138 1
1 2 . 14 1 1 A 2 2 GLY HA3 H 2 3.890 3.760 0.130 1
1 3 . 14 1 1 A 2 2 GLY C C 2 174.200 174.109 0.091 1
1 4 . 14 1 1 A 2 2 GLY CA C 2 44.700 46.426 -1.726 1
1 5 . 14 1 1 A 3 3 HIS H H 3 8.380 8.487 -0.107 1
1 6 . 14 1 1 A 3 3 HIS HA H 3 4.610 4.788 -0.178 1
1 9 . 14 1 1 A 3 3 HIS C C 3 174.500 175.343 -0.843 1
1 10 . 14 1 1 A 3 3 HIS CA C 3 55.200 55.682 -0.482 1
1 11 . 14 1 1 A 3 3 HIS CB C 3 28.800 31.147 -2.347 1
1 12 . 14 1 1 A 3 3 HIS N N 3 117.600 123.268 -5.668 1
1 13 . 14 1 1 A 4 4 HIS H H 4 8.520 8.266 0.254 1
1 14 . 14 1 1 A 4 4 HIS HA H 4 4.640 4.004 0.636 1
1 17 . 14 1 1 A 4 4 HIS C C 4 174.200 173.716 0.484 1
1 18 . 14 1 1 A 4 4 HIS CA C 4 55.100 59.106 -4.006 1
1 19 . 14 1 1 A 4 4 HIS CB C 4 28.900 27.924 0.976 1
1 20 . 14 1 1 A 4 4 HIS N N 4 119.000 114.623 4.377 1
1 21 . 14 1 1 A 5 5 HIS H H 5 8.530 7.446 1.084 1
1 22 . 14 1 1 A 5 5 HIS HA H 5 4.410 4.626 -0.216 1
1 25 . 14 1 1 A 5 5 HIS CA C 5 54.900 54.936 -0.036 1
1 26 . 14 1 1 A 5 5 HIS CB C 5 27.300 30.888 -3.588 1
1 27 . 14 1 1 A 5 5 HIS N N 5 121.600 111.216 10.384 1
1 28 . 14 1 1 A 6 6 HIS HA H 6 4.640 5.070 -0.430 1
1 31 . 14 1 1 A 6 6 HIS C C 6 174.100 174.520 -0.420 1
1 32 . 14 1 1 A 6 6 HIS CA C 6 55.100 55.012 0.088 1
1 33 . 14 1 1 A 6 6 HIS CB C 6 29.100 32.059 -2.959 1
1 34 . 14 1 1 A 7 7 HIS H H 7 8.690 9.158 -0.468 1
1 35 . 14 1 1 A 7 7 HIS HA H 7 4.650 5.088 -0.438 1
1 38 . 14 1 1 A 7 7 HIS C C 7 174.200 173.840 0.360 1
1 39 . 14 1 1 A 7 7 HIS CA C 7 55.200 54.833 0.367 1
1 40 . 14 1 1 A 7 7 HIS CB C 7 29.300 29.723 -0.423 1
1 41 . 14 1 1 A 7 7 HIS N N 7 121.400 119.536 1.864 1
1 42 . 14 1 1 A 8 8 HIS H H 8 8.660 9.001 -0.341 1
1 43 . 14 1 1 A 8 8 HIS HA H 8 4.700 5.276 -0.576 1
1 46 . 14 1 1 A 8 8 HIS C C 8 174.200 172.748 1.452 1
1 47 . 14 1 1 A 8 8 HIS CA C 8 55.000 53.713 1.287 1
1 48 . 14 1 1 A 8 8 HIS CB C 8 29.300 31.962 -2.662 1
1 49 . 14 1 1 A 8 8 HIS N N 8 120.400 125.023 -4.623 1
1 50 . 14 1 1 A 9 9 SER H H 9 8.490 8.967 -0.477 1
1 51 . 14 1 1 A 9 9 SER HA H 9 4.390 4.767 -0.377 1
1 54 . 14 1 1 A 9 9 SER C C 9 174.100 173.105 0.995 1
1 55 . 14 1 1 A 9 9 SER CA C 9 58.300 55.980 2.320 1
1 56 . 14 1 1 A 9 9 SER CB C 9 63.700 64.860 -1.160 1
1 57 . 14 1 1 A 9 9 SER N N 9 118.100 124.139 -6.039 1
1 58 . 14 1 1 A 10 10 HIS H H 10 8.710 8.640 0.070 1
1 59 . 14 1 1 A 10 10 HIS HA H 10 4.690 5.166 -0.476 1
1 63 . 14 1 1 A 10 10 HIS C C 10 174.200 172.574 1.626 1
1 64 . 14 1 1 A 10 10 HIS CA C 10 55.200 54.638 0.562 1
1 65 . 14 1 1 A 10 10 HIS CB C 10 28.800 32.113 -3.313 1
1 66 . 14 1 1 A 10 10 HIS N N 10 120.700 117.573 3.127 1
1 67 . 14 1 1 A 11 11 MET H H 11 8.410 8.847 -0.437 1
1 68 . 14 1 1 A 11 11 MET HA H 11 4.420 4.905 -0.485 1
1 76 . 14 1 1 A 11 11 MET C C 11 175.800 175.763 0.037 1
1 77 . 14 1 1 A 11 11 MET CA C 11 55.100 54.072 1.028 1
1 78 . 14 1 1 A 11 11 MET CB C 11 32.800 33.531 -0.731 1
1 81 . 14 1 1 A 11 11 MET N N 11 122.300 119.662 2.638 1
1 82 . 14 1 1 A 12 12 ALA H H 12 8.440 8.455 -0.015 1
1 83 . 14 1 1 A 12 12 ALA HA H 12 4.280 4.480 -0.200 1
1 87 . 14 1 1 A 12 12 ALA C C 12 177.400 177.610 -0.210 1
1 88 . 14 1 1 A 12 12 ALA CA C 12 52.400 51.424 0.976 1
1 89 . 14 1 1 A 12 12 ALA CB C 12 18.800 19.748 -0.948 1
1 90 . 14 1 1 A 12 12 ALA N N 12 125.900 127.758 -1.858 1
1 91 . 14 1 1 A 13 13 ASN H H 13 8.440 8.884 -0.444 1
1 92 . 14 1 1 A 13 13 ASN HA H 13 4.660 4.640 0.020 1
1 97 . 14 1 1 A 13 13 ASN C C 13 175.900 175.652 0.248 1
1 98 . 14 1 1 A 13 13 ASN CA C 13 53.200 54.122 -0.922 1
1 99 . 14 1 1 A 13 13 ASN CB C 13 38.800 39.371 -0.571 1
1 100 . 14 1 1 A 13 13 ASN N N 13 118.300 119.136 -0.836 1
1 102 . 14 1 1 A 14 14 GLY H H 14 8.370 8.455 -0.085 1
1 103 . 14 1 1 A 14 14 GLY HA2 H 14 3.920 4.167 -0.247 1
1 104 . 14 1 1 A 14 14 GLY HA3 H 14 3.920 4.167 -0.247 1
1 105 . 14 1 1 A 14 14 GLY C C 14 174.000 174.132 -0.132 1
1 106 . 14 1 1 A 14 14 GLY CA C 14 45.200 45.630 -0.430 1
1 107 . 14 1 1 A 14 14 GLY N N 14 109.600 109.454 0.146 1
1 108 . 14 1 1 A 15 15 ALA H H 15 8.140 7.710 0.430 1
1 109 . 14 1 1 A 15 15 ALA HA H 15 4.280 4.274 0.006 1
1 113 . 14 1 1 A 15 15 ALA C C 15 177.300 177.893 -0.593 1
1 114 . 14 1 1 A 15 15 ALA CA C 15 52.500 52.052 0.448 1
1 115 . 14 1 1 A 15 15 ALA CB C 15 19.100 20.072 -0.972 1
1 116 . 14 1 1 A 15 15 ALA N N 15 123.800 124.046 -0.246 1
1 117 . 14 1 1 A 16 16 ALA H H 16 8.030 9.064 -1.034 1
1 118 . 14 1 1 A 16 16 ALA HA H 16 4.280 4.066 0.214 1
1 122 . 14 1 1 A 16 16 ALA C C 16 178.400 177.256 1.144 1
1 123 . 14 1 1 A 16 16 ALA CA C 16 52.600 53.382 -0.782 1
1 124 . 14 1 1 A 16 16 ALA CB C 16 19.100 17.886 1.214 1
1 125 . 14 1 1 A 16 16 ALA N N 16 122.300 120.712 1.588 1
1 126 . 14 1 1 A 17 17 GLY H H 17 8.320 8.398 -0.078 1
1 127 . 14 1 1 A 17 17 GLY HA2 H 17 3.960 3.905 0.055 1
1 128 . 14 1 1 A 17 17 GLY HA3 H 17 3.960 3.906 0.054 1
1 129 . 14 1 1 A 17 17 GLY C C 17 174.500 175.278 -0.778 1
1 130 . 14 1 1 A 17 17 GLY CA C 17 45.200 45.791 -0.591 1
1 131 . 14 1 1 A 17 17 GLY N N 17 107.800 103.379 4.421 1
1 132 . 14 1 1 A 18 18 THR H H 18 7.970 8.131 -0.161 1
1 133 . 14 1 1 A 18 18 THR HA H 18 4.290 3.988 0.302 1
1 138 . 14 1 1 A 18 18 THR C C 18 174.600 176.878 -2.278 1
1 139 . 14 1 1 A 18 18 THR CA C 18 62.000 66.348 -4.348 1
1 140 . 14 1 1 A 18 18 THR CB C 18 69.700 68.636 1.064 1
1 142 . 14 1 1 A 18 18 THR N N 18 113.800 115.517 -1.717 1
1 143 . 14 1 1 A 19 19 LYS H H 19 8.350 8.341 0.009 1
1 144 . 14 1 1 A 19 19 LYS HA H 19 4.270 4.207 0.063 1
1 153 . 14 1 1 A 19 19 LYS C C 19 176.600 176.747 -0.147 1
1 154 . 14 1 1 A 19 19 LYS CA C 19 56.500 58.108 -1.608 1
1 155 . 14 1 1 A 19 19 LYS CB C 19 32.800 31.600 1.200 1
1 159 . 14 1 1 A 19 19 LYS N N 19 124.000 119.365 4.635 1
1 160 . 14 1 1 A 20 20 VAL H H 20 8.060 7.548 0.512 1
1 161 . 14 1 1 A 20 20 VAL HA H 20 3.990 4.429 -0.439 1
1 169 . 14 1 1 A 20 20 VAL C C 20 175.900 175.199 0.701 1
1 170 . 14 1 1 A 20 20 VAL CA C 20 62.400 61.722 0.678 1
1 171 . 14 1 1 A 20 20 VAL CB C 20 32.600 31.895 0.705 1
1 174 . 14 1 1 A 20 20 VAL N N 20 121.700 119.242 2.458 1
1 175 . 14 1 1 A 21 21 ALA H H 21 8.310 8.092 0.218 1
1 176 . 14 1 1 A 21 21 ALA HA H 21 4.290 4.529 -0.239 1
1 180 . 14 1 1 A 21 21 ALA C C 21 177.600 178.378 -0.778 1
1 181 . 14 1 1 A 21 21 ALA CA C 21 52.400 53.121 -0.721 1
1 182 . 14 1 1 A 21 21 ALA CB C 21 19.000 20.549 -1.549 1
1 183 . 14 1 1 A 21 21 ALA N N 21 127.700 127.207 0.493 1
1 184 . 14 1 1 A 22 22 LEU H H 22 8.150 7.985 0.165 1
1 185 . 14 1 1 A 22 22 LEU HA H 22 4.280 4.281 -0.001 1
1 195 . 14 1 1 A 22 22 LEU C C 22 177.400 176.414 0.986 1
1 196 . 14 1 1 A 22 22 LEU CA C 22 55.200 55.434 -0.234 1
1 197 . 14 1 1 A 22 22 LEU CB C 22 42.200 41.892 0.308 1
1 201 . 14 1 1 A 22 22 LEU N N 22 121.800 116.937 4.863 1
1 202 . 14 1 1 A 23 23 ARG H H 23 8.240 7.614 0.626 1
1 203 . 14 1 1 A 23 23 ARG HA H 23 4.290 4.676 -0.386 1
1 211 . 14 1 1 A 23 23 ARG C C 23 176.300 176.047 0.253 1
1 212 . 14 1 1 A 23 23 ARG CA C 23 56.000 54.871 1.129 1
1 213 . 14 1 1 A 23 23 ARG CB C 23 30.600 30.949 -0.349 1
1 216 . 14 1 1 A 23 23 ARG N N 23 122.000 115.357 6.643 1
1 218 . 14 1 1 A 24 24 LYS H H 24 8.370 8.326 0.044 1
1 219 . 14 1 1 A 24 24 LYS HA H 24 4.330 4.271 0.059 1
1 228 . 14 1 1 A 24 24 LYS C C 24 176.800 176.589 0.211 1
1 229 . 14 1 1 A 24 24 LYS CA C 24 56.400 57.902 -1.502 1
1 230 . 14 1 1 A 24 24 LYS CB C 24 32.700 32.972 -0.272 1
1 234 . 14 1 1 A 24 24 LYS N N 24 122.900 123.984 -1.084 1
1 235 . 14 1 1 A 25 25 THR H H 25 8.100 7.740 0.360 1
1 236 . 14 1 1 A 25 25 THR HA H 25 4.290 4.588 -0.298 1
1 241 . 14 1 1 A 25 25 THR C C 25 174.600 174.550 0.050 1
1 242 . 14 1 1 A 25 25 THR CA C 25 61.500 61.125 0.375 1
1 243 . 14 1 1 A 25 25 THR CB C 25 69.800 70.524 -0.724 1
1 245 . 14 1 1 A 25 25 THR N N 25 115.500 113.392 2.108 1
1 246 . 14 1 1 A 26 26 LYS H H 26 8.370 8.851 -0.481 1
1 247 . 14 1 1 A 26 26 LYS HA H 26 4.270 4.344 -0.074 1
1 256 . 14 1 1 A 26 26 LYS C C 26 176.600 177.620 -1.020 1
1 257 . 14 1 1 A 26 26 LYS CA C 26 56.600 55.660 0.940 1
1 258 . 14 1 1 A 26 26 LYS CB C 26 32.700 33.260 -0.560 1
1 262 . 14 1 1 A 26 26 LYS N N 26 123.700 124.952 -1.252 1
1 263 . 14 1 1 A 27 27 GLN H H 27 8.390 8.904 -0.514 1
1 264 . 14 1 1 A 27 27 GLN HA H 27 4.240 4.395 -0.155 1
1 271 . 14 1 1 A 27 27 GLN C C 27 175.900 175.760 0.140 1
1 272 . 14 1 1 A 27 27 GLN CA C 27 56.100 57.722 -1.622 1
1 273 . 14 1 1 A 27 27 GLN CB C 27 29.300 28.965 0.335 1
1 275 . 14 1 1 A 27 27 GLN N N 27 121.700 120.832 0.868 1
1 277 . 14 1 1 A 28 28 ALA H H 28 8.330 7.734 0.596 1
1 278 . 14 1 1 A 28 28 ALA HA H 28 4.240 4.506 -0.266 1
1 282 . 14 1 1 A 28 28 ALA C C 28 177.700 177.370 0.330 1
1 283 . 14 1 1 A 28 28 ALA CA C 28 52.500 51.359 1.141 1
1 284 . 14 1 1 A 28 28 ALA CB C 28 19.100 22.505 -3.405 1
1 285 . 14 1 1 A 28 28 ALA N N 28 125.400 119.305 6.095 1
1 286 . 14 1 1 A 29 29 ALA H H 29 8.250 8.926 -0.676 1
1 287 . 14 1 1 A 29 29 ALA HA H 29 4.230 3.990 0.240 1
1 291 . 14 1 1 A 29 29 ALA C C 29 178.000 179.646 -1.646 1
1 292 . 14 1 1 A 29 29 ALA CA C 29 52.500 55.494 -2.994 1
1 293 . 14 1 1 A 29 29 ALA CB C 29 19.100 18.217 0.883 1
1 294 . 14 1 1 A 29 29 ALA N N 29 123.000 124.895 -1.895 1
1 295 . 14 1 1 A 30 30 GLU H H 30 8.260 8.311 -0.051 1
1 296 . 14 1 1 A 30 30 GLU HA H 30 4.220 4.061 0.159 1
1 301 . 14 1 1 A 30 30 GLU C C 30 176.500 177.290 -0.790 1
1 302 . 14 1 1 A 30 30 GLU CA C 30 56.400 59.812 -3.412 1
1 303 . 14 1 1 A 30 30 GLU CB C 30 29.500 29.624 -0.124 1
1 305 . 14 1 1 A 30 30 GLU N N 30 119.700 119.145 0.555 1
1 306 . 14 1 1 A 31 31 LYS H H 31 8.230 8.145 0.085 1
1 307 . 14 1 1 A 31 31 LYS HA H 31 4.280 4.502 -0.222 1
1 316 . 14 1 1 A 31 31 LYS C C 31 176.500 176.544 -0.044 1
1 317 . 14 1 1 A 31 31 LYS CA C 31 56.400 55.841 0.559 1
1 318 . 14 1 1 A 31 31 LYS CB C 31 32.800 33.446 -0.646 1
1 322 . 14 1 1 A 31 31 LYS N N 31 122.700 117.997 4.703 1
1 323 . 14 1 1 A 32 32 ILE H H 32 8.140 7.480 0.660 1
1 324 . 14 1 1 A 32 32 ILE HA H 32 4.110 4.269 -0.159 1
1 334 . 14 1 1 A 32 32 ILE C C 32 176.400 177.339 -0.939 1
1 335 . 14 1 1 A 32 32 ILE CA C 32 61.200 61.277 -0.077 1
1 336 . 14 1 1 A 32 32 ILE CB C 32 38.600 37.792 0.808 1
1 340 . 14 1 1 A 32 32 ILE N N 32 122.300 121.678 0.622 1
1 341 . 14 1 1 A 33 33 SER H H 33 8.230 8.975 -0.745 1
1 342 . 14 1 1 A 33 33 SER HA H 33 4.400 4.053 0.347 1
1 345 . 14 1 1 A 33 33 SER C C 33 174.800 176.313 -1.513 1
1 346 . 14 1 1 A 33 33 SER CA C 33 58.300 61.700 -3.400 1
1 347 . 14 1 1 A 33 33 SER CB C 33 63.700 62.312 1.388 1
1 348 . 14 1 1 A 33 33 SER N N 33 119.600 122.580 -2.980 1
1 349 . 14 1 1 A 34 34 ALA H H 34 8.430 8.304 0.126 1
1 350 . 14 1 1 A 34 34 ALA HA H 34 4.220 4.069 0.151 1
1 354 . 14 1 1 A 34 34 ALA C C 34 179.500 179.602 -0.102 1
1 355 . 14 1 1 A 34 34 ALA CA C 34 53.500 54.635 -1.135 1
1 356 . 14 1 1 A 34 34 ALA CB C 34 18.800 18.326 0.474 1
1 357 . 14 1 1 A 34 34 ALA N N 34 126.000 123.123 2.877 1
1 358 . 14 1 1 A 35 35 ASP H H 35 8.380 7.562 0.818 1
1 359 . 14 1 1 A 35 35 ASP HA H 35 4.520 4.361 0.159 1
1 362 . 14 1 1 A 35 35 ASP C C 35 176.500 178.680 -2.180 1
1 363 . 14 1 1 A 35 35 ASP CA C 35 54.800 56.386 -1.586 1
1 364 . 14 1 1 A 35 35 ASP CB C 35 40.200 40.727 -0.527 1
1 365 . 14 1 1 A 35 35 ASP N N 35 118.200 118.608 -0.408 1
1 366 . 14 1 1 A 36 36 LYS H H 36 8.000 7.830 0.170 1
1 367 . 14 1 1 A 36 36 LYS HA H 36 4.270 4.042 0.228 1
1 376 . 14 1 1 A 36 36 LYS C C 36 177.000 177.094 -0.094 1
1 377 . 14 1 1 A 36 36 LYS CA C 36 56.800 58.729 -1.929 1
1 378 . 14 1 1 A 36 36 LYS CB C 36 32.900 31.913 0.987 1
1 382 . 14 1 1 A 36 36 LYS N N 36 120.900 118.520 2.380 1
1 383 . 14 1 1 A 37 37 ILE H H 37 7.970 7.275 0.695 1
1 384 . 14 1 1 A 37 37 ILE HA H 37 4.020 3.935 0.085 1
1 394 . 14 1 1 A 37 37 ILE C C 37 176.100 174.838 1.262 1
1 395 . 14 1 1 A 37 37 ILE CA C 37 61.300 61.327 -0.027 1
1 396 . 14 1 1 A 37 37 ILE CB C 37 38.100 37.190 0.910 1
1 400 . 14 1 1 A 37 37 ILE N N 37 121.800 121.034 0.766 1
1 401 . 14 1 1 A 38 38 SER H H 38 7.980 8.272 -0.292 1
1 402 . 14 1 1 A 38 38 SER HA H 38 4.540 4.820 -0.280 1
1 405 . 14 1 1 A 38 38 SER C C 38 174.700 175.605 -0.905 1
1 406 . 14 1 1 A 38 38 SER CA C 38 58.200 57.315 0.885 1
1 407 . 14 1 1 A 38 38 SER CB C 38 64.400 65.277 -0.877 1
1 408 . 14 1 1 A 38 38 SER N N 38 119.000 124.467 -5.467 1
1 409 . 14 1 1 A 39 39 LYS H H 39 8.690 9.105 -0.415 1
1 410 . 14 1 1 A 39 39 LYS HA H 39 3.400 3.621 -0.221 1
1 419 . 14 1 1 A 39 39 LYS C C 39 177.400 178.127 -0.727 1
1 420 . 14 1 1 A 39 39 LYS CA C 39 59.800 60.348 -0.548 1
1 421 . 14 1 1 A 39 39 LYS CB C 39 32.400 32.173 0.227 1
1 425 . 14 1 1 A 39 39 LYS N N 39 124.200 124.611 -0.411 1
1 426 . 14 1 1 A 40 40 GLU H H 40 8.280 8.448 -0.168 1
1 427 . 14 1 1 A 40 40 GLU HA H 40 3.840 4.030 -0.190 1
1 432 . 14 1 1 A 40 40 GLU C C 40 178.400 178.663 -0.263 1
1 433 . 14 1 1 A 40 40 GLU CA C 40 59.400 59.369 0.031 1
1 434 . 14 1 1 A 40 40 GLU CB C 40 28.300 28.954 -0.654 1
1 436 . 14 1 1 A 40 40 GLU N N 40 116.300 117.496 -1.196 1
1 437 . 14 1 1 A 41 41 ALA H H 41 7.890 8.012 -0.122 1
1 438 . 14 1 1 A 41 41 ALA HA H 41 3.910 4.119 -0.209 1
1 442 . 14 1 1 A 41 41 ALA C C 41 179.900 179.779 0.121 1
1 443 . 14 1 1 A 41 41 ALA CA C 41 54.700 54.986 -0.286 1
1 444 . 14 1 1 A 41 41 ALA CB C 41 17.900 18.623 -0.723 1
1 445 . 14 1 1 A 41 41 ALA N N 41 122.300 122.417 -0.117 1
1 446 . 14 1 1 A 42 42 LEU H H 42 7.490 7.957 -0.467 1
1 447 . 14 1 1 A 42 42 LEU HA H 42 3.480 4.116 -0.636 1
1 457 . 14 1 1 A 42 42 LEU C C 42 178.900 178.505 0.395 1
1 458 . 14 1 1 A 42 42 LEU CA C 42 59.800 57.500 2.300 1
1 459 . 14 1 1 A 42 42 LEU CB C 42 42.300 41.359 0.941 1
1 463 . 14 1 1 A 42 42 LEU N N 42 121.000 120.335 0.665 1
1 464 . 14 1 1 A 43 43 LEU H H 43 8.290 7.864 0.426 1
1 465 . 14 1 1 A 43 43 LEU HA H 43 3.780 3.790 -0.010 1
1 475 . 14 1 1 A 43 43 LEU C C 43 179.400 178.779 0.621 1
1 476 . 14 1 1 A 43 43 LEU CA C 43 57.600 58.159 -0.559 1
1 477 . 14 1 1 A 43 43 LEU CB C 43 40.900 41.669 -0.769 1
1 481 . 14 1 1 A 43 43 LEU N N 43 119.200 118.142 1.058 1
1 482 . 14 1 1 A 44 44 GLU H H 44 8.330 8.135 0.195 1
1 483 . 14 1 1 A 44 44 GLU HA H 44 4.050 4.057 -0.007 1
1 488 . 14 1 1 A 44 44 GLU C C 44 178.600 178.539 0.061 1
1 489 . 14 1 1 A 44 44 GLU CA C 44 58.900 59.115 -0.215 1
1 490 . 14 1 1 A 44 44 GLU CB C 44 28.300 29.430 -1.130 1
1 492 . 14 1 1 A 44 44 GLU N N 44 119.600 116.983 2.617 1
1 493 . 14 1 1 A 45 45 CYS H H 45 7.690 8.115 -0.425 1
1 494 . 14 1 1 A 45 45 CYS HA H 45 4.120 4.007 0.113 1
1 497 . 14 1 1 A 45 45 CYS C C 45 176.100 176.642 -0.542 1
1 498 . 14 1 1 A 45 45 CYS CA C 45 62.500 62.840 -0.340 1
1 499 . 14 1 1 A 45 45 CYS CB C 45 26.200 25.930 0.270 1
1 500 . 14 1 1 A 45 45 CYS N N 45 120.900 118.830 2.070 1
1 501 . 14 1 1 A 46 46 ALA H H 46 8.540 7.616 0.924 1
1 502 . 14 1 1 A 46 46 ALA HA H 46 3.900 3.981 -0.081 1
1 506 . 14 1 1 A 46 46 ALA C C 46 179.200 179.887 -0.687 1
1 507 . 14 1 1 A 46 46 ALA CA C 46 55.500 55.355 0.145 1
1 508 . 14 1 1 A 46 46 ALA CB C 46 16.800 18.178 -1.378 1
1 509 . 14 1 1 A 46 46 ALA N N 46 121.500 121.930 -0.430 1
1 510 . 14 1 1 A 47 47 ASP H H 47 8.460 8.385 0.075 1
1 511 . 14 1 1 A 47 47 ASP HA H 47 4.340 4.383 -0.043 1
1 514 . 14 1 1 A 47 47 ASP C C 47 178.800 179.025 -0.225 1
1 515 . 14 1 1 A 47 47 ASP CA C 47 56.600 57.446 -0.846 1
1 516 . 14 1 1 A 47 47 ASP CB C 47 39.800 40.508 -0.708 1
1 517 . 14 1 1 A 47 47 ASP N N 47 119.000 119.607 -0.607 1
1 518 . 14 1 1 A 48 48 LEU H H 48 8.040 7.852 0.188 1
1 519 . 14 1 1 A 48 48 LEU HA H 48 4.110 3.920 0.190 1
1 529 . 14 1 1 A 48 48 LEU C C 48 180.000 179.180 0.820 1
1 530 . 14 1 1 A 48 48 LEU CA C 48 58.000 57.894 0.106 1
1 531 . 14 1 1 A 48 48 LEU CB C 48 41.700 41.879 -0.179 1
1 535 . 14 1 1 A 48 48 LEU N N 48 123.000 121.083 1.917 1
1 536 . 14 1 1 A 49 49 LEU H H 49 8.300 7.692 0.608 1
1 537 . 14 1 1 A 49 49 LEU HA H 49 4.110 3.818 0.292 1
1 547 . 14 1 1 A 49 49 LEU C C 49 177.200 178.889 -1.689 1
1 548 . 14 1 1 A 49 49 LEU CA C 49 57.600 58.023 -0.423 1
1 549 . 14 1 1 A 49 49 LEU CB C 49 41.200 41.456 -0.256 1
1 553 . 14 1 1 A 49 49 LEU N N 49 120.900 118.365 2.535 1
1 554 . 14 1 1 A 50 50 SER H H 50 8.660 8.131 0.529 1
1 555 . 14 1 1 A 50 50 SER HA H 50 4.000 4.069 -0.069 1
1 558 . 14 1 1 A 50 50 SER C C 50 176.800 177.071 -0.271 1
1 559 . 14 1 1 A 50 50 SER CA C 50 62.500 61.646 0.854 1
1 560 . 14 1 1 A 50 50 SER CB C 50 62.600 62.865 -0.265 1
1 561 . 14 1 1 A 50 50 SER N N 50 113.300 114.353 -1.053 1
1 562 . 14 1 1 A 51 51 SER H H 51 7.980 8.238 -0.258 1
1 563 . 14 1 1 A 51 51 SER HA H 51 4.220 4.187 0.033 1
1 566 . 14 1 1 A 51 51 SER C C 51 176.300 176.936 -0.636 1
1 567 . 14 1 1 A 51 51 SER CA C 51 61.200 61.462 -0.262 1
1 568 . 14 1 1 A 51 51 SER CB C 51 62.700 62.578 0.122 1
1 569 . 14 1 1 A 51 51 SER N N 51 115.900 115.477 0.423 1
1 570 . 14 1 1 A 52 52 ALA H H 52 8.030 8.173 -0.143 1
1 571 . 14 1 1 A 52 52 ALA HA H 52 4.130 4.199 -0.069 1
1 575 . 14 1 1 A 52 52 ALA C C 52 178.500 179.804 -1.304 1
1 576 . 14 1 1 A 52 52 ALA CA C 52 54.500 55.034 -0.534 1
1 577 . 14 1 1 A 52 52 ALA CB C 52 18.000 18.153 -0.153 1
1 578 . 14 1 1 A 52 52 ALA N N 52 125.400 123.481 1.919 1
1 579 . 14 1 1 A 53 53 LEU H H 53 7.710 8.032 -0.322 1
1 580 . 14 1 1 A 53 53 LEU HA H 53 4.180 4.154 0.026 1
1 590 . 14 1 1 A 53 53 LEU C C 53 177.700 178.519 -0.819 1
1 591 . 14 1 1 A 53 53 LEU CA C 53 56.500 56.750 -0.250 1
1 592 . 14 1 1 A 53 53 LEU CB C 53 42.400 41.495 0.905 1
1 596 . 14 1 1 A 53 53 LEU N N 53 113.800 118.358 -4.558 1
1 597 . 14 1 1 A 54 54 THR H H 54 7.550 7.435 0.115 1
1 598 . 14 1 1 A 54 54 THR HA H 54 4.420 4.305 0.115 1
1 603 . 14 1 1 A 54 54 THR C C 54 174.100 173.543 0.557 1
1 604 . 14 1 1 A 54 54 THR CA C 54 61.600 62.599 -0.999 1
1 605 . 14 1 1 A 54 54 THR CB C 54 69.300 69.237 0.063 1
1 607 . 14 1 1 A 54 54 THR N N 54 107.700 108.299 -0.599 1
1 608 . 14 1 1 A 55 55 GLU H H 55 7.750 7.602 0.148 1
1 609 . 14 1 1 A 55 55 GLU HA H 55 4.760 5.024 -0.264 1
1 614 . 14 1 1 A 55 55 GLU CA C 55 53.400 53.764 -0.364 1
1 615 . 14 1 1 A 55 55 GLU CB C 55 30.100 32.425 -2.325 1
1 617 . 14 1 1 A 55 55 GLU N N 55 122.800 118.199 4.601 1
1 618 . 14 1 1 A 56 56 PRO HA H 56 4.670 4.653 0.017 1
1 625 . 14 1 1 A 56 56 PRO C C 56 176.200 176.393 -0.193 1
1 626 . 14 1 1 A 56 56 PRO CA C 56 62.900 63.143 -0.243 1
1 627 . 14 1 1 A 56 56 PRO CB C 56 29.200 31.791 -2.591 1
1 630 . 14 1 1 A 57 57 VAL H H 57 8.010 8.389 -0.379 1
1 631 . 14 1 1 A 57 57 VAL HA H 57 4.590 4.934 -0.344 1
1 639 . 14 1 1 A 57 57 VAL CA C 57 58.600 58.277 0.323 1
1 640 . 14 1 1 A 57 57 VAL CB C 57 32.800 34.797 -1.997 1
1 643 . 14 1 1 A 57 57 VAL N N 57 121.400 117.187 4.213 1
1 644 . 14 1 1 A 58 58 PRO HA H 58 4.450 4.567 -0.117 1
1 651 . 14 1 1 A 58 58 PRO C C 58 177.500 177.750 -0.250 1
1 652 . 14 1 1 A 58 58 PRO CA C 58 62.600 62.682 -0.082 1
1 653 . 14 1 1 A 58 58 PRO CB C 58 32.200 32.849 -0.649 1
1 656 . 14 1 1 A 59 59 ASN H H 59 8.890 9.049 -0.159 1
1 657 . 14 1 1 A 59 59 ASN HA H 59 4.330 4.458 -0.128 1
1 662 . 14 1 1 A 59 59 ASN C C 59 177.600 177.154 0.446 1
1 663 . 14 1 1 A 59 59 ASN CA C 59 56.300 56.202 0.098 1
1 664 . 14 1 1 A 59 59 ASN CB C 59 38.400 39.005 -0.605 1
1 665 . 14 1 1 A 59 59 ASN N N 59 122.200 122.810 -0.610 1
1 667 . 14 1 1 A 60 60 SER H H 60 8.660 8.112 0.548 1
1 668 . 14 1 1 A 60 60 SER HA H 60 4.010 4.054 -0.044 1
1 671 . 14 1 1 A 60 60 SER C C 60 176.200 177.395 -1.195 1
1 672 . 14 1 1 A 60 60 SER CA C 60 60.800 61.391 -0.591 1
1 673 . 14 1 1 A 60 60 SER CB C 60 61.500 62.930 -1.430 1
1 674 . 14 1 1 A 60 60 SER N N 60 113.200 113.665 -0.465 1
1 675 . 14 1 1 A 61 61 GLN H H 61 7.420 7.914 -0.494 1
1 676 . 14 1 1 A 61 61 GLN HA H 61 4.280 4.007 0.273 1
1 683 . 14 1 1 A 61 61 GLN C C 61 178.600 178.459 0.141 1
1 684 . 14 1 1 A 61 61 GLN CA C 61 57.900 58.811 -0.911 1
1 685 . 14 1 1 A 61 61 GLN CB C 61 28.600 28.213 0.387 1
1 687 . 14 1 1 A 61 61 GLN N N 61 122.200 120.496 1.704 1
1 689 . 14 1 1 A 62 62 LEU H H 62 7.430 7.805 -0.375 1
1 690 . 14 1 1 A 62 62 LEU HA H 62 3.850 4.019 -0.169 1
1 700 . 14 1 1 A 62 62 LEU C C 62 178.800 179.016 -0.216 1
1 701 . 14 1 1 A 62 62 LEU CA C 62 57.900 58.045 -0.145 1
1 702 . 14 1 1 A 62 62 LEU CB C 62 42.100 42.316 -0.216 1
1 706 . 14 1 1 A 62 62 LEU N N 62 120.600 120.058 0.542 1
1 707 . 14 1 1 A 63 63 VAL H H 63 8.200 8.234 -0.034 1
1 708 . 14 1 1 A 63 63 VAL HA H 63 3.370 3.495 -0.125 1
1 716 . 14 1 1 A 63 63 VAL C C 63 178.000 178.056 -0.056 1
1 717 . 14 1 1 A 63 63 VAL CA C 63 66.600 66.992 -0.392 1
1 718 . 14 1 1 A 63 63 VAL CB C 63 31.700 31.229 0.471 1
1 721 . 14 1 1 A 63 63 VAL N N 63 118.200 117.178 1.022 1
1 722 . 14 1 1 A 64 64 ASP H H 64 7.960 8.299 -0.339 1
1 723 . 14 1 1 A 64 64 ASP HA H 64 4.460 4.350 0.110 1
1 726 . 14 1 1 A 64 64 ASP C C 64 178.100 178.569 -0.469 1
1 727 . 14 1 1 A 64 64 ASP CA C 64 57.700 57.500 0.200 1
1 728 . 14 1 1 A 64 64 ASP CB C 64 39.800 41.380 -1.580 1
1 729 . 14 1 1 A 64 64 ASP N N 64 120.200 120.385 -0.185 1
1 730 . 14 1 1 A 65 65 THR H H 65 8.380 8.273 0.107 1
1 731 . 14 1 1 A 65 65 THR HA H 65 3.970 3.991 -0.021 1
1 736 . 14 1 1 A 65 65 THR C C 65 176.500 177.270 -0.770 1
1 737 . 14 1 1 A 65 65 THR CA C 65 66.500 66.616 -0.116 1
1 738 . 14 1 1 A 65 65 THR CB C 65 67.800 68.068 -0.268 1
1 740 . 14 1 1 A 65 65 THR N N 65 118.100 115.114 2.986 1
1 741 . 14 1 1 A 66 66 GLY H H 66 8.900 8.689 0.211 1
1 742 . 14 1 1 A 66 66 GLY HA2 H 66 3.630 3.746 -0.116 1
1 743 . 14 1 1 A 66 66 GLY HA3 H 66 3.630 3.768 -0.138 1
1 744 . 14 1 1 A 66 66 GLY C C 66 174.200 175.673 -1.473 1
1 745 . 14 1 1 A 66 66 GLY CA C 66 47.500 46.990 0.510 1
1 746 . 14 1 1 A 66 66 GLY N N 66 110.500 107.563 2.937 1
1 747 . 14 1 1 A 67 67 HIS H H 67 8.650 8.270 0.380 1
1 748 . 14 1 1 A 67 67 HIS HA H 67 4.220 4.104 0.116 1
1 752 . 14 1 1 A 67 67 HIS C C 67 176.900 177.426 -0.526 1
1 753 . 14 1 1 A 67 67 HIS CA C 67 59.000 59.400 -0.400 1
1 754 . 14 1 1 A 67 67 HIS CB C 67 27.800 29.765 -1.965 1
1 756 . 14 1 1 A 67 67 HIS N N 67 120.100 122.136 -2.036 1
1 757 . 14 1 1 A 68 68 GLN H H 68 7.860 8.389 -0.529 1
1 758 . 14 1 1 A 68 68 GLN HA H 68 3.990 3.971 0.019 1
1 765 . 14 1 1 A 68 68 GLN C C 68 177.800 177.941 -0.141 1
1 766 . 14 1 1 A 68 68 GLN CA C 68 58.800 58.567 0.233 1
1 767 . 14 1 1 A 68 68 GLN CB C 68 28.200 27.597 0.603 1
1 769 . 14 1 1 A 68 68 GLN N N 68 121.400 116.906 4.494 1
1 771 . 14 1 1 A 69 69 LEU H H 69 8.300 7.783 0.517 1
1 772 . 14 1 1 A 69 69 LEU HA H 69 4.330 3.986 0.344 1
1 782 . 14 1 1 A 69 69 LEU C C 69 179.300 179.616 -0.316 1
1 783 . 14 1 1 A 69 69 LEU CA C 69 58.200 58.138 0.062 1
1 784 . 14 1 1 A 69 69 LEU CB C 69 40.500 41.247 -0.747 1
1 788 . 14 1 1 A 69 69 LEU N N 69 120.300 121.890 -1.590 1
1 789 . 14 1 1 A 70 70 LEU H H 70 8.460 8.137 0.323 1
1 790 . 14 1 1 A 70 70 LEU HA H 70 3.880 3.944 -0.064 1
1 800 . 14 1 1 A 70 70 LEU C C 70 179.100 179.393 -0.293 1
1 801 . 14 1 1 A 70 70 LEU CA C 70 58.300 58.049 0.251 1
1 802 . 14 1 1 A 70 70 LEU CB C 70 41.500 40.233 1.267 1
1 806 . 14 1 1 A 70 70 LEU N N 70 121.200 119.709 1.491 1
1 807 . 14 1 1 A 71 71 ASP H H 71 8.140 8.217 -0.077 1
1 808 . 14 1 1 A 71 71 ASP HA H 71 4.420 4.319 0.101 1
1 811 . 14 1 1 A 71 71 ASP C C 71 180.000 178.328 1.672 1
1 812 . 14 1 1 A 71 71 ASP CA C 71 57.300 57.249 0.051 1
1 813 . 14 1 1 A 71 71 ASP CB C 71 39.300 40.997 -1.697 1
1 814 . 14 1 1 A 71 71 ASP N N 71 121.100 119.511 1.589 1
1 815 . 14 1 1 A 72 72 TYR H H 72 8.320 8.458 -0.138 1
1 816 . 14 1 1 A 72 72 TYR HA H 72 4.550 4.429 0.121 1
1 823 . 14 1 1 A 72 72 TYR C C 72 179.100 178.674 0.426 1
1 824 . 14 1 1 A 72 72 TYR CA C 72 60.500 60.632 -0.132 1
1 825 . 14 1 1 A 72 72 TYR CB C 72 37.600 38.074 -0.474 1
1 828 . 14 1 1 A 72 72 TYR N N 72 120.300 118.345 1.955 1
1 829 . 14 1 1 A 73 73 CYS H H 73 8.850 8.655 0.195 1
1 830 . 14 1 1 A 73 73 CYS HA H 73 4.380 4.590 -0.210 1
1 834 . 14 1 1 A 73 73 CYS C C 73 177.300 177.305 -0.005 1
1 835 . 14 1 1 A 73 73 CYS CA C 73 64.400 63.542 0.858 1
1 836 . 14 1 1 A 73 73 CYS CB C 73 27.600 26.660 0.940 1
1 837 . 14 1 1 A 73 73 CYS N N 73 116.800 118.690 -1.890 1
1 838 . 14 1 1 A 74 74 SER H H 74 8.410 8.363 0.047 1
1 839 . 14 1 1 A 74 74 SER HA H 74 4.290 4.269 0.021 1
1 842 . 14 1 1 A 74 74 SER C C 74 176.300 176.934 -0.634 1
1 843 . 14 1 1 A 74 74 SER CA C 74 61.400 61.154 0.246 1
1 844 . 14 1 1 A 74 74 SER CB C 74 62.600 63.102 -0.502 1
1 845 . 14 1 1 A 74 74 SER N N 74 115.900 115.941 -0.041 1
1 846 . 14 1 1 A 75 75 GLY H H 75 7.790 8.133 -0.343 1
1 847 . 14 1 1 A 75 75 GLY HA2 H 75 4.320 3.739 0.581 1
1 848 . 14 1 1 A 75 75 GLY HA3 H 75 3.900 3.741 0.159 1
1 849 . 14 1 1 A 75 75 GLY C C 75 174.600 175.407 -0.807 1
1 850 . 14 1 1 A 75 75 GLY CA C 75 45.600 47.040 -1.440 1
1 851 . 14 1 1 A 75 75 GLY N N 75 107.500 107.135 0.365 1
1 852 . 14 1 1 A 76 76 TYR H H 76 8.040 8.458 -0.418 1
1 853 . 14 1 1 A 76 76 TYR HA H 76 4.310 4.019 0.291 1
1 860 . 14 1 1 A 76 76 TYR C C 76 176.200 177.726 -1.526 1
1 861 . 14 1 1 A 76 76 TYR CA C 76 60.000 61.032 -1.032 1
1 862 . 14 1 1 A 76 76 TYR CB C 76 40.700 38.668 2.032 1
1 865 . 14 1 1 A 76 76 TYR N N 76 121.900 123.450 -1.550 1
1 866 . 14 1 1 A 77 77 VAL H H 77 7.540 8.385 -0.845 1
1 867 . 14 1 1 A 77 77 VAL HA H 77 3.450 3.612 -0.162 1
1 875 . 14 1 1 A 77 77 VAL C C 77 175.500 177.149 -1.649 1
1 876 . 14 1 1 A 77 77 VAL CA C 77 65.500 64.207 1.293 1
1 877 . 14 1 1 A 77 77 VAL CB C 77 31.600 31.409 0.191 1
1 880 . 14 1 1 A 77 77 VAL N N 77 116.600 118.844 -2.244 1
1 881 . 14 1 1 A 78 78 ASP H H 78 7.580 7.836 -0.256 1
1 882 . 14 1 1 A 78 78 ASP HA H 78 4.380 4.374 0.006 1
1 885 . 14 1 1 A 78 78 ASP C C 78 177.000 176.955 0.045 1
1 886 . 14 1 1 A 78 78 ASP CA C 78 55.800 56.403 -0.603 1
1 887 . 14 1 1 A 78 78 ASP CB C 78 39.900 40.763 -0.863 1
1 888 . 14 1 1 A 78 78 ASP N N 78 116.400 120.732 -4.332 1
1 889 . 14 1 1 A 79 79 CYS H H 79 8.040 7.774 0.266 1
1 890 . 14 1 1 A 79 79 CYS HA H 79 4.110 4.508 -0.398 1
1 893 . 14 1 1 A 79 79 CYS C C 79 174.200 173.922 0.278 1
1 894 . 14 1 1 A 79 79 CYS CA C 79 58.600 57.800 0.800 1
1 895 . 14 1 1 A 79 79 CYS CB C 79 27.200 28.264 -1.064 1
1 896 . 14 1 1 A 79 79 CYS N N 79 117.000 115.611 1.389 1
1 897 . 14 1 1 A 80 80 ILE H H 80 6.960 7.298 -0.338 1
1 898 . 14 1 1 A 80 80 ILE HA H 80 4.120 4.006 0.114 1
1 908 . 14 1 1 A 80 80 ILE CA C 80 58.700 58.911 -0.211 1
1 909 . 14 1 1 A 80 80 ILE CB C 80 38.500 37.288 1.212 1
1 913 . 14 1 1 A 80 80 ILE N N 80 123.200 122.720 0.480 1
1 914 . 14 1 1 A 81 81 PRO HA H 81 4.340 4.290 0.050 1
1 921 . 14 1 1 A 81 81 PRO C C 81 178.000 176.403 1.597 1
1 922 . 14 1 1 A 81 81 PRO CA C 81 64.700 65.193 -0.493 1
1 923 . 14 1 1 A 81 81 PRO CB C 81 32.600 31.796 0.804 1
1 926 . 14 1 1 A 82 82 GLN H H 82 7.560 8.083 -0.523 1
1 927 . 14 1 1 A 82 82 GLN HA H 82 4.600 4.454 0.146 1
1 934 . 14 1 1 A 82 82 GLN C C 82 177.400 176.123 1.277 1
1 935 . 14 1 1 A 82 82 GLN CA C 82 55.600 55.785 -0.185 1
1 936 . 14 1 1 A 82 82 GLN CB C 82 28.800 29.337 -0.537 1
1 938 . 14 1 1 A 82 82 GLN N N 82 115.900 117.394 -1.494 1
1 940 . 14 1 1 A 83 83 THR H H 83 8.880 8.482 0.398 1
1 941 . 14 1 1 A 83 83 THR HA H 83 3.750 3.926 -0.176 1
1 946 . 14 1 1 A 83 83 THR C C 83 176.300 176.266 0.034 1
1 947 . 14 1 1 A 83 83 THR CA C 83 66.500 66.759 -0.259 1
1 948 . 14 1 1 A 83 83 THR CB C 83 68.700 68.764 -0.064 1
1 950 . 14 1 1 A 83 83 THR N N 83 122.700 119.944 2.756 1
1 951 . 14 1 1 A 84 84 ARG H H 84 8.990 8.149 0.841 1
1 952 . 14 1 1 A 84 84 ARG HA H 84 4.250 4.053 0.197 1
1 960 . 14 1 1 A 84 84 ARG C C 84 178.900 179.322 -0.422 1
1 961 . 14 1 1 A 84 84 ARG CA C 84 59.100 59.632 -0.532 1
1 962 . 14 1 1 A 84 84 ARG CB C 84 29.300 30.353 -1.053 1
1 965 . 14 1 1 A 84 84 ARG N N 84 120.100 121.268 -1.168 1
1 967 . 14 1 1 A 85 85 ASN H H 85 7.270 8.276 -1.006 1
1 968 . 14 1 1 A 85 85 ASN HA H 85 4.810 4.635 0.175 1
1 973 . 14 1 1 A 85 85 ASN C C 85 176.800 177.852 -1.052 1
1 974 . 14 1 1 A 85 85 ASN CA C 85 54.800 56.105 -1.305 1
1 975 . 14 1 1 A 85 85 ASN CB C 85 37.600 37.959 -0.359 1
1 976 . 14 1 1 A 85 85 ASN N N 85 117.400 118.390 -0.990 1
1 978 . 14 1 1 A 86 86 LYS H H 86 8.340 8.120 0.220 1
1 979 . 14 1 1 A 86 86 LYS HA H 86 3.890 4.092 -0.202 1
1 988 . 14 1 1 A 86 86 LYS C C 86 178.600 179.197 -0.597 1
1 989 . 14 1 1 A 86 86 LYS CA C 86 60.800 58.905 1.895 1
1 990 . 14 1 1 A 86 86 LYS CB C 86 32.700 32.081 0.619 1
1 994 . 14 1 1 A 86 86 LYS N N 86 124.200 120.705 3.495 1
1 995 . 14 1 1 A 87 87 PHE H H 87 8.120 8.772 -0.652 1
1 996 . 14 1 1 A 87 87 PHE HA H 87 4.260 4.165 0.095 1
1 1004 . 14 1 1 A 87 87 PHE C C 87 178.100 177.527 0.573 1
1 1005 . 14 1 1 A 87 87 PHE CA C 87 61.300 61.832 -0.532 1
1 1006 . 14 1 1 A 87 87 PHE CB C 87 38.200 39.228 -1.028 1
1 1010 . 14 1 1 A 87 87 PHE N N 87 118.300 121.285 -2.985 1
1 1011 . 14 1 1 A 88 88 ALA H H 88 7.860 8.552 -0.692 1
1 1012 . 14 1 1 A 88 88 ALA HA H 88 4.200 4.118 0.082 1
1 1016 . 14 1 1 A 88 88 ALA C C 88 180.600 179.904 0.696 1
1 1017 . 14 1 1 A 88 88 ALA CA C 88 54.900 55.148 -0.248 1
1 1018 . 14 1 1 A 88 88 ALA CB C 88 18.100 17.906 0.194 1
1 1019 . 14 1 1 A 88 88 ALA N N 88 121.700 120.955 0.745 1
1 1020 . 14 1 1 A 89 89 PHE H H 89 8.690 8.261 0.429 1
1 1021 . 14 1 1 A 89 89 PHE HA H 89 4.080 4.117 -0.037 1
1 1029 . 14 1 1 A 89 89 PHE C C 89 176.300 177.824 -1.524 1
1 1030 . 14 1 1 A 89 89 PHE CA C 89 62.000 61.331 0.669 1
1 1031 . 14 1 1 A 89 89 PHE CB C 89 39.800 39.296 0.504 1
1 1035 . 14 1 1 A 89 89 PHE N N 89 120.100 119.992 0.108 1
1 1036 . 14 1 1 A 90 90 ARG H H 90 8.560 8.414 0.146 1
1 1037 . 14 1 1 A 90 90 ARG HA H 90 3.790 3.789 0.001 1
1 1045 . 14 1 1 A 90 90 ARG C C 90 179.600 178.707 0.893 1
1 1046 . 14 1 1 A 90 90 ARG CA C 90 60.000 59.577 0.423 1
1 1047 . 14 1 1 A 90 90 ARG CB C 90 30.000 29.839 0.161 1
1 1050 . 14 1 1 A 90 90 ARG N N 90 118.000 118.398 -0.398 1
1 1052 . 14 1 1 A 91 91 GLU H H 91 8.120 8.357 -0.237 1
1 1053 . 14 1 1 A 91 91 GLU HA H 91 3.980 3.880 0.100 1
1 1058 . 14 1 1 A 91 91 GLU C C 91 178.400 178.845 -0.445 1
1 1059 . 14 1 1 A 91 91 GLU CA C 91 58.900 59.183 -0.283 1
1 1060 . 14 1 1 A 91 91 GLU CB C 91 28.800 29.159 -0.359 1
1 1062 . 14 1 1 A 91 91 GLU N N 91 119.300 118.087 1.213 1
1 1063 . 14 1 1 A 92 92 ALA H H 92 7.820 7.465 0.355 1
1 1064 . 14 1 1 A 92 92 ALA HA H 92 4.050 3.975 0.075 1
1 1068 . 14 1 1 A 92 92 ALA C C 92 179.800 179.811 -0.011 1
1 1069 . 14 1 1 A 92 92 ALA CA C 92 55.000 55.114 -0.114 1
1 1070 . 14 1 1 A 92 92 ALA CB C 92 18.000 18.322 -0.322 1
1 1071 . 14 1 1 A 92 92 ALA N N 92 123.400 122.189 1.211 1
1 1072 . 14 1 1 A 93 93 VAL H H 93 8.430 7.986 0.444 1
1 1073 . 14 1 1 A 93 93 VAL HA H 93 3.250 3.315 -0.065 1
1 1081 . 14 1 1 A 93 93 VAL C C 93 177.900 177.924 -0.024 1
1 1082 . 14 1 1 A 93 93 VAL CA C 93 66.800 66.773 0.027 1
1 1083 . 14 1 1 A 93 93 VAL CB C 93 31.300 31.271 0.029 1
1 1086 . 14 1 1 A 93 93 VAL N N 93 119.900 118.349 1.551 1
1 1087 . 14 1 1 A 94 94 SER H H 94 7.990 8.290 -0.300 1
1 1088 . 14 1 1 A 94 94 SER HA H 94 4.230 3.960 0.270 1
1 1091 . 14 1 1 A 94 94 SER C C 94 177.200 177.296 -0.096 1
1 1092 . 14 1 1 A 94 94 SER CA C 94 61.600 61.517 0.083 1
1 1093 . 14 1 1 A 94 94 SER CB C 94 62.700 62.733 -0.033 1
1 1094 . 14 1 1 A 94 94 SER N N 94 116.000 115.961 0.039 1
1 1095 . 14 1 1 A 95 95 LYS H H 95 7.710 7.787 -0.077 1
1 1096 . 14 1 1 A 95 95 LYS HA H 95 4.020 4.047 -0.027 1
1 1105 . 14 1 1 A 95 95 LYS C C 95 179.400 179.297 0.103 1
1 1106 . 14 1 1 A 95 95 LYS CA C 95 59.600 58.919 0.681 1
1 1107 . 14 1 1 A 95 95 LYS CB C 95 32.300 31.891 0.409 1
1 1111 . 14 1 1 A 95 95 LYS N N 95 121.400 122.002 -0.602 1
1 1112 . 14 1 1 A 96 96 LEU H H 96 8.270 8.084 0.186 1
1 1113 . 14 1 1 A 96 96 LEU HA H 96 4.040 3.950 0.090 1
1 1123 . 14 1 1 A 96 96 LEU C C 96 177.700 178.301 -0.601 1
1 1124 . 14 1 1 A 96 96 LEU CA C 96 58.600 58.141 0.459 1
1 1125 . 14 1 1 A 96 96 LEU CB C 96 41.000 41.836 -0.836 1
1 1129 . 14 1 1 A 96 96 LEU N N 96 124.800 121.638 3.162 1
1 1130 . 14 1 1 A 97 97 GLU H H 97 8.500 8.337 0.163 1
1 1131 . 14 1 1 A 97 97 GLU HA H 97 3.760 4.109 -0.349 1
1 1136 . 14 1 1 A 97 97 GLU C C 97 179.100 179.554 -0.454 1
1 1137 . 14 1 1 A 97 97 GLU CA C 97 59.900 59.040 0.860 1
1 1138 . 14 1 1 A 97 97 GLU CB C 97 28.700 29.310 -0.610 1
1 1140 . 14 1 1 A 97 97 GLU N N 97 119.000 117.320 1.680 1
1 1141 . 14 1 1 A 98 98 LEU H H 98 7.740 7.932 -0.192 1
1 1142 . 14 1 1 A 98 98 LEU HA H 98 4.110 3.968 0.142 1
1 1152 . 14 1 1 A 98 98 LEU C C 98 179.700 179.069 0.631 1
1 1153 . 14 1 1 A 98 98 LEU CA C 98 57.900 57.841 0.059 1
1 1154 . 14 1 1 A 98 98 LEU CB C 98 41.800 41.519 0.281 1
1 1158 . 14 1 1 A 98 98 LEU N N 98 119.200 120.928 -1.728 1
1 1159 . 14 1 1 A 99 99 SER H H 99 8.290 8.099 0.191 1
1 1160 . 14 1 1 A 99 99 SER HA H 99 4.220 4.242 -0.022 1
1 1163 . 14 1 1 A 99 99 SER C C 99 176.600 177.204 -0.604 1
1 1164 . 14 1 1 A 99 99 SER CA C 99 62.400 61.187 1.213 1
1 1165 . 14 1 1 A 99 99 SER CB C 99 63.200 62.919 0.281 1
1 1166 . 14 1 1 A 99 99 SER N N 99 116.300 113.810 2.490 1
1 1167 . 14 1 1 A 100 100 LEU H H 100 8.490 8.279 0.211 1
1 1168 . 14 1 1 A 100 100 LEU HA H 100 3.960 4.011 -0.051 1
1 1178 . 14 1 1 A 100 100 LEU C C 100 179.300 179.324 -0.024 1
1 1179 . 14 1 1 A 100 100 LEU CA C 100 57.700 58.061 -0.361 1
1 1180 . 14 1 1 A 100 100 LEU CB C 100 41.300 41.329 -0.029 1
1 1184 . 14 1 1 A 100 100 LEU N N 100 120.900 123.074 -2.174 1
1 1185 . 14 1 1 A 101 101 GLN H H 101 7.680 8.629 -0.949 1
1 1186 . 14 1 1 A 101 101 GLN HA H 101 4.100 3.971 0.129 1
1 1193 . 14 1 1 A 101 101 GLN C C 101 178.700 177.928 0.772 1
1 1194 . 14 1 1 A 101 101 GLN CA C 101 58.800 58.811 -0.011 1
1 1195 . 14 1 1 A 101 101 GLN CB C 101 27.900 27.847 0.053 1
1 1197 . 14 1 1 A 101 101 GLN N N 101 119.100 117.564 1.536 1
1 1199 . 14 1 1 A 102 102 GLU H H 102 7.850 8.182 -0.332 1
1 1200 . 14 1 1 A 102 102 GLU HA H 102 4.050 4.109 -0.059 1
1 1205 . 14 1 1 A 102 102 GLU C C 102 179.100 178.904 0.196 1
1 1206 . 14 1 1 A 102 102 GLU CA C 102 58.400 59.392 -0.992 1
1 1207 . 14 1 1 A 102 102 GLU CB C 102 28.600 29.223 -0.623 1
1 1209 . 14 1 1 A 102 102 GLU N N 102 118.400 119.271 -0.871 1
1 1210 . 14 1 1 A 103 103 LEU H H 103 8.080 8.137 -0.057 1
1 1211 . 14 1 1 A 103 103 LEU HA H 103 4.020 4.042 -0.022 1
1 1221 . 14 1 1 A 103 103 LEU C C 103 178.200 178.316 -0.116 1
1 1222 . 14 1 1 A 103 103 LEU CA C 103 57.000 58.032 -1.032 1
1 1223 . 14 1 1 A 103 103 LEU CB C 103 41.900 41.766 0.134 1
1 1227 . 14 1 1 A 103 103 LEU N N 103 120.600 123.369 -2.769 1
1 1228 . 14 1 1 A 104 104 GLN H H 104 7.900 8.621 -0.721 1
1 1229 . 14 1 1 A 104 104 GLN HA H 104 4.090 4.180 -0.090 1
1 1236 . 14 1 1 A 104 104 GLN C C 104 177.300 177.291 0.009 1
1 1237 . 14 1 1 A 104 104 GLN CA C 104 58.100 58.306 -0.206 1
1 1238 . 14 1 1 A 104 104 GLN CB C 104 29.400 27.939 1.461 1
1 1240 . 14 1 1 A 104 104 GLN N N 104 117.700 116.396 1.304 1
1 1242 . 14 1 1 A 105 105 VAL H H 105 7.620 7.382 0.238 1
1 1243 . 14 1 1 A 105 105 VAL HA H 105 4.190 4.174 0.016 1
1 1251 . 14 1 1 A 105 105 VAL C C 105 176.800 176.287 0.513 1
1 1252 . 14 1 1 A 105 105 VAL CA C 105 62.600 63.129 -0.529 1
1 1253 . 14 1 1 A 105 105 VAL CB C 105 32.000 32.387 -0.387 1
1 1256 . 14 1 1 A 105 105 VAL N N 105 114.900 115.986 -1.086 1
1 1257 . 14 1 1 A 106 106 SER H H 106 7.900 7.896 0.004 1
1 1258 . 14 1 1 A 106 106 SER HA H 106 4.460 4.652 -0.192 1
1 1261 . 14 1 1 A 106 106 SER C C 106 175.000 175.665 -0.665 1
1 1262 . 14 1 1 A 106 106 SER CA C 106 58.900 57.094 1.806 1
1 1263 . 14 1 1 A 106 106 SER CB C 106 63.900 63.324 0.576 1
1 1264 . 14 1 1 A 106 106 SER N N 106 116.900 117.543 -0.643 1
1 1265 . 14 1 1 A 107 107 SER H H 107 8.230 7.872 0.358 1
1 1266 . 14 1 1 A 107 107 SER HA H 107 4.390 4.133 0.257 1
1 1269 . 14 1 1 A 107 107 SER C C 107 174.600 174.753 -0.153 1
1 1270 . 14 1 1 A 107 107 SER CA C 107 58.400 61.265 -2.865 1
1 1271 . 14 1 1 A 107 107 SER CB C 107 63.600 62.949 0.651 1
1 1272 . 14 1 1 A 107 107 SER N N 107 117.500 115.814 1.686 1
1 1273 . 14 1 1 A 108 108 ALA H H 108 8.080 7.965 0.115 1
1 1274 . 14 1 1 A 108 108 ALA HA H 108 4.280 3.960 0.320 1
1 1278 . 14 1 1 A 108 108 ALA C C 108 177.500 175.835 1.665 1
1 1279 . 14 1 1 A 108 108 ALA CA C 108 52.700 53.402 -0.702 1
1 1280 . 14 1 1 A 108 108 ALA CB C 108 19.200 17.974 1.226 1
1 1281 . 14 1 1 A 108 108 ALA N N 108 124.900 120.608 4.292 1
1 1282 . 14 1 1 A 109 109 ALA H H 109 8.080 7.358 0.722 1
1 1283 . 14 1 1 A 109 109 ALA HA H 109 4.280 4.583 -0.303 1
1 1287 . 14 1 1 A 109 109 ALA C C 109 177.700 175.803 1.897 1
1 1288 . 14 1 1 A 109 109 ALA CA C 109 52.400 51.517 0.883 1
1 1289 . 14 1 1 A 109 109 ALA CB C 109 19.400 23.027 -3.627 1
1 1290 . 14 1 1 A 109 109 ALA N N 109 123.000 116.617 6.383 1
1 1291 . 14 1 1 A 110 110 ALA H H 110 8.300 8.162 0.138 1
1 1292 . 14 1 1 A 110 110 ALA HA H 110 4.280 4.649 -0.369 1
1 1296 . 14 1 1 A 110 110 ALA C C 110 178.200 177.533 0.667 1
1 1297 . 14 1 1 A 110 110 ALA CA C 110 52.700 51.397 1.303 1
1 1298 . 14 1 1 A 110 110 ALA CB C 110 19.200 18.672 0.528 1
1 1299 . 14 1 1 A 110 110 ALA N N 110 123.200 122.542 0.658 1
1 1300 . 14 1 1 A 111 111 GLY H H 111 8.300 7.942 0.358 1
1 1301 . 14 1 1 A 111 111 GLY HA2 H 111 3.930 3.972 -0.042 1
1 1302 . 14 1 1 A 111 111 GLY HA3 H 111 3.940 3.972 -0.032 1
1 1303 . 14 1 1 A 111 111 GLY C C 111 173.700 174.329 -0.629 1
1 1304 . 14 1 1 A 111 111 GLY CA C 111 45.100 45.897 -0.797 1
1 1305 . 14 1 1 A 111 111 GLY N N 111 108.000 106.464 1.536 1
1 1306 . 14 1 1 A 112 112 VAL H H 112 7.930 7.843 0.087 1
1 1307 . 14 1 1 A 112 112 VAL HA H 112 4.420 4.270 0.150 1
1 1315 . 14 1 1 A 112 112 VAL CA C 112 60.000 59.201 0.799 1
1 1316 . 14 1 1 A 112 112 VAL CB C 112 32.200 32.993 -0.793 1
1 1319 . 14 1 1 A 112 112 VAL N N 112 120.400 120.983 -0.583 1
1 1320 . 14 1 1 A 113 113 PRO HA H 113 4.370 4.300 0.070 1
1 1327 . 14 1 1 A 113 113 PRO C C 113 177.300 177.736 -0.436 1
1 1328 . 14 1 1 A 113 113 PRO CA C 113 63.900 63.669 0.231 1
1 1329 . 14 1 1 A 113 113 PRO CB C 113 31.800 31.633 0.167 1
1 1332 . 14 1 1 A 114 114 GLY H H 114 8.570 8.738 -0.168 1
1 1333 . 14 1 1 A 114 114 GLY HA2 H 114 3.880 3.900 -0.020 1
1 1334 . 14 1 1 A 114 114 GLY HA3 H 114 4.120 3.900 0.220 1
1 1335 . 14 1 1 A 114 114 GLY C C 114 174.900 175.318 -0.418 1
1 1336 . 14 1 1 A 114 114 GLY CA C 114 45.200 45.415 -0.215 1
1 1337 . 14 1 1 A 114 114 GLY N N 114 109.000 111.813 -2.813 1
1 1338 . 14 1 1 A 115 115 THR H H 115 7.900 7.747 0.153 1
1 1339 . 14 1 1 A 115 115 THR HA H 115 4.400 3.971 0.429 1
1 1344 . 14 1 1 A 115 115 THR C C 115 174.300 173.559 0.741 1
1 1345 . 14 1 1 A 115 115 THR CA C 115 61.700 64.889 -3.189 1
1 1346 . 14 1 1 A 115 115 THR CB C 115 69.700 69.563 0.137 1
1 1348 . 14 1 1 A 115 115 THR N N 115 111.400 115.729 -4.329 1
1 1349 . 14 1 1 A 116 116 ASN H H 116 8.450 8.083 0.367 1
1 1350 . 14 1 1 A 116 116 ASN HA H 116 4.970 5.187 -0.217 1
1 1355 . 14 1 1 A 116 116 ASN CA C 116 51.500 49.459 2.041 1
1 1356 . 14 1 1 A 116 116 ASN CB C 116 38.900 40.086 -1.186 1
1 1357 . 14 1 1 A 116 116 ASN N N 116 123.100 116.361 6.739 1
1 1359 . 14 1 1 A 117 117 PRO HA H 117 4.370 4.327 0.043 1
1 1366 . 14 1 1 A 117 117 PRO C C 117 178.400 178.061 0.339 1
1 1367 . 14 1 1 A 117 117 PRO CA C 117 64.800 64.561 0.239 1
1 1368 . 14 1 1 A 117 117 PRO CB C 117 32.100 32.029 0.071 1
1 1371 . 14 1 1 A 118 118 VAL H H 118 7.750 7.554 0.196 1
1 1372 . 14 1 1 A 118 118 VAL HA H 118 3.810 3.744 0.066 1
1 1380 . 14 1 1 A 118 118 VAL C C 118 178.300 178.192 0.108 1
1 1381 . 14 1 1 A 118 118 VAL CA C 118 65.200 65.317 -0.117 1
1 1382 . 14 1 1 A 118 118 VAL CB C 118 31.500 31.488 0.012 1
1 1385 . 14 1 1 A 118 118 VAL N N 118 118.300 116.327 1.973 1
1 1386 . 14 1 1 A 119 119 LEU H H 119 7.540 7.926 -0.386 1
1 1387 . 14 1 1 A 119 119 LEU HA H 119 4.030 3.895 0.135 1
1 1397 . 14 1 1 A 119 119 LEU C C 119 178.900 179.251 -0.351 1
1 1398 . 14 1 1 A 119 119 LEU CA C 119 57.800 57.990 -0.190 1
1 1399 . 14 1 1 A 119 119 LEU CB C 119 40.700 41.200 -0.500 1
1 1403 . 14 1 1 A 119 119 LEU N N 119 119.700 120.190 -0.490 1
1 1404 . 14 1 1 A 120 120 ASN H H 120 8.080 8.329 -0.249 1
1 1405 . 14 1 1 A 120 120 ASN HA H 120 4.420 4.394 0.026 1
1 1410 . 14 1 1 A 120 120 ASN C C 120 178.100 177.373 0.727 1
1 1411 . 14 1 1 A 120 120 ASN CA C 120 56.100 56.729 -0.629 1
1 1412 . 14 1 1 A 120 120 ASN CB C 120 37.800 38.696 -0.896 1
1 1413 . 14 1 1 A 120 120 ASN N N 120 117.700 118.000 -0.300 1
1 1415 . 14 1 1 A 121 121 ASN H H 121 8.120 8.224 -0.104 1
1 1416 . 14 1 1 A 121 121 ASN HA H 121 4.490 4.490 0.000 1
1 1421 . 14 1 1 A 121 121 ASN C C 121 178.000 178.244 -0.244 1
1 1422 . 14 1 1 A 121 121 ASN CA C 121 56.100 56.434 -0.334 1
1 1423 . 14 1 1 A 121 121 ASN CB C 121 37.800 38.208 -0.408 1
1 1424 . 14 1 1 A 121 121 ASN N N 121 120.000 117.656 2.344 1
1 1426 . 14 1 1 A 122 122 LEU H H 122 8.180 8.242 -0.062 1
1 1427 . 14 1 1 A 122 122 LEU HA H 122 4.050 3.946 0.104 1
1 1437 . 14 1 1 A 122 122 LEU C C 122 173.800 178.893 -5.093 1
1 1438 . 14 1 1 A 122 122 LEU CA C 122 58.500 57.894 0.606 1
1 1439 . 14 1 1 A 122 122 LEU CB C 122 41.900 42.017 -0.117 1
1 1443 . 14 1 1 A 122 122 LEU N N 122 122.600 120.981 1.619 1
1 1444 . 14 1 1 A 123 123 LEU H H 123 8.260 7.938 0.322 1
1 1445 . 14 1 1 A 123 123 LEU HA H 123 3.850 3.990 -0.140 1
1 1455 . 14 1 1 A 123 123 LEU C C 123 178.900 178.432 0.468 1
1 1456 . 14 1 1 A 123 123 LEU CA C 123 58.500 58.342 0.158 1
1 1457 . 14 1 1 A 123 123 LEU CB C 123 41.200 41.513 -0.313 1
1 1461 . 14 1 1 A 123 123 LEU N N 123 119.700 120.312 -0.612 1
1 1462 . 14 1 1 A 124 124 SER H H 124 7.950 8.324 -0.374 1
1 1463 . 14 1 1 A 124 124 SER HA H 124 4.240 4.066 0.174 1
1 1466 . 14 1 1 A 124 124 SER C C 124 177.500 177.202 0.298 1
1 1467 . 14 1 1 A 124 124 SER CA C 124 61.600 61.789 -0.189 1
1 1468 . 14 1 1 A 124 124 SER CB C 124 62.600 62.914 -0.314 1
1 1469 . 14 1 1 A 124 124 SER N N 124 113.400 113.826 -0.426 1
1 1470 . 14 1 1 A 125 125 CYS H H 125 8.040 8.412 -0.372 1
1 1471 . 14 1 1 A 125 125 CYS HA H 125 4.350 4.120 0.230 1
1 1474 . 14 1 1 A 125 125 CYS C C 125 176.800 176.988 -0.188 1
1 1475 . 14 1 1 A 125 125 CYS CA C 125 62.600 63.922 -1.322 1
1 1476 . 14 1 1 A 125 125 CYS CB C 125 27.100 26.860 0.240 1
1 1477 . 14 1 1 A 125 125 CYS N N 125 119.800 119.362 0.438 1
1 1478 . 14 1 1 A 126 126 VAL H H 126 8.290 8.554 -0.264 1
1 1479 . 14 1 1 A 126 126 VAL HA H 126 3.430 3.453 -0.023 1
1 1487 . 14 1 1 A 126 126 VAL C C 126 177.800 178.002 -0.202 1
1 1488 . 14 1 1 A 126 126 VAL CA C 126 67.100 66.779 0.321 1
1 1489 . 14 1 1 A 126 126 VAL CB C 126 31.400 31.612 -0.212 1
1 1492 . 14 1 1 A 126 126 VAL N N 126 121.900 120.646 1.254 1
1 1493 . 14 1 1 A 127 127 GLN H H 127 8.200 8.157 0.043 1
1 1494 . 14 1 1 A 127 127 GLN HA H 127 3.970 4.016 -0.046 1
1 1501 . 14 1 1 A 127 127 GLN C C 127 178.200 178.632 -0.432 1
1 1502 . 14 1 1 A 127 127 GLN CA C 127 58.700 58.822 -0.122 1
1 1503 . 14 1 1 A 127 127 GLN CB C 127 27.800 28.049 -0.249 1
1 1505 . 14 1 1 A 127 127 GLN N N 127 119.700 117.724 1.976 1
1 1507 . 14 1 1 A 128 128 GLU H H 128 7.880 7.799 0.081 1
1 1508 . 14 1 1 A 128 128 GLU HA H 128 4.200 4.162 0.038 1
1 1513 . 14 1 1 A 128 128 GLU C C 128 178.400 179.059 -0.659 1
1 1514 . 14 1 1 A 128 128 GLU CA C 128 59.000 58.891 0.109 1
1 1515 . 14 1 1 A 128 128 GLU CB C 128 28.400 29.532 -1.132 1
1 1517 . 14 1 1 A 128 128 GLU N N 128 119.800 119.280 0.520 1
1 1518 . 14 1 1 A 129 129 ILE H H 129 8.000 8.376 -0.376 1
1 1519 . 14 1 1 A 129 129 ILE HA H 129 3.460 3.606 -0.146 1
1 1529 . 14 1 1 A 129 129 ILE C C 129 176.800 178.094 -1.294 1
1 1530 . 14 1 1 A 129 129 ILE CA C 129 66.100 65.553 0.547 1
1 1531 . 14 1 1 A 129 129 ILE CB C 129 38.200 37.479 0.721 1
1 1535 . 14 1 1 A 129 129 ILE N N 129 119.500 120.744 -1.244 1
1 1536 . 14 1 1 A 130 130 SER H H 130 8.040 8.327 -0.287 1
1 1537 . 14 1 1 A 130 130 SER HA H 130 3.780 4.184 -0.404 1
1 1540 . 14 1 1 A 130 130 SER C C 130 176.200 175.972 0.228 1
1 1541 . 14 1 1 A 130 130 SER CA C 130 62.100 61.357 0.743 1
1 1542 . 14 1 1 A 130 130 SER CB C 130 62.600 62.490 0.110 1
1 1543 . 14 1 1 A 130 130 SER N N 130 112.800 114.811 -2.011 1
1 1544 . 14 1 1 A 131 131 ASP H H 131 8.270 8.073 0.197 1
1 1545 . 14 1 1 A 131 131 ASP HA H 131 4.310 4.323 -0.013 1
1 1548 . 14 1 1 A 131 131 ASP C C 131 179.200 178.592 0.608 1
1 1549 . 14 1 1 A 131 131 ASP CA C 131 56.800 57.729 -0.929 1
1 1550 . 14 1 1 A 131 131 ASP CB C 131 40.900 41.866 -0.966 1
1 1551 . 14 1 1 A 131 131 ASP N N 131 119.600 121.775 -2.175 1
1 1552 . 14 1 1 A 132 132 VAL H H 132 8.470 8.414 0.056 1
1 1553 . 14 1 1 A 132 132 VAL HA H 132 3.520 3.697 -0.177 1
1 1561 . 14 1 1 A 132 132 VAL C C 132 178.700 178.600 0.100 1
1 1562 . 14 1 1 A 132 132 VAL CA C 132 66.500 66.591 -0.091 1
1 1563 . 14 1 1 A 132 132 VAL CB C 132 31.500 31.669 -0.169 1
1 1566 . 14 1 1 A 132 132 VAL N N 132 118.100 119.078 -0.978 1
1 1567 . 14 1 1 A 133 133 VAL H H 133 8.140 8.184 -0.044 1
1 1568 . 14 1 1 A 133 133 VAL HA H 133 3.770 3.741 0.029 1
1 1576 . 14 1 1 A 133 133 VAL C C 133 176.500 176.751 -0.251 1
1 1577 . 14 1 1 A 133 133 VAL CA C 133 65.100 66.703 -1.603 1
1 1578 . 14 1 1 A 133 133 VAL CB C 133 31.600 31.479 0.121 1
1 1581 . 14 1 1 A 133 133 VAL N N 133 117.000 120.652 -3.652 1
1 1582 . 14 1 1 A 134 134 GLN H H 134 7.490 7.639 -0.149 1
1 1583 . 14 1 1 A 134 134 GLN HA H 134 4.350 4.366 -0.016 1
1 1590 . 14 1 1 A 134 134 GLN C C 134 175.400 176.291 -0.891 1
1 1591 . 14 1 1 A 134 134 GLN CA C 134 56.700 56.136 0.564 1
1 1592 . 14 1 1 A 134 134 GLN CB C 134 30.500 28.977 1.523 1
1 1594 . 14 1 1 A 134 134 GLN N N 134 116.300 117.917 -1.617 1
1 1 . 15 1 1 A 2 2 GLY HA2 H 2 3.890 4.011 -0.121 1
1 2 . 15 1 1 A 2 2 GLY HA3 H 2 3.890 4.110 -0.220 1
1 3 . 15 1 1 A 2 2 GLY C C 2 174.200 174.747 -0.547 1
1 4 . 15 1 1 A 2 2 GLY CA C 2 44.700 45.558 -0.858 1
1 5 . 15 1 1 A 3 3 HIS H H 3 8.380 8.548 -0.168 1
1 6 . 15 1 1 A 3 3 HIS HA H 3 4.610 4.094 0.516 1
1 9 . 15 1 1 A 3 3 HIS C C 3 174.500 176.569 -2.069 1
1 10 . 15 1 1 A 3 3 HIS CA C 3 55.200 59.225 -4.025 1
1 11 . 15 1 1 A 3 3 HIS CB C 3 28.800 30.932 -2.132 1
1 12 . 15 1 1 A 3 3 HIS N N 3 117.600 122.746 -5.146 1
1 13 . 15 1 1 A 4 4 HIS H H 4 8.520 8.320 0.200 1
1 14 . 15 1 1 A 4 4 HIS HA H 4 4.640 4.107 0.533 1
1 17 . 15 1 1 A 4 4 HIS C C 4 174.200 175.116 -0.916 1
1 18 . 15 1 1 A 4 4 HIS CA C 4 55.100 57.313 -2.213 1
1 19 . 15 1 1 A 4 4 HIS CB C 4 28.900 28.855 0.045 1
1 20 . 15 1 1 A 4 4 HIS N N 4 119.000 116.737 2.263 1
1 21 . 15 1 1 A 5 5 HIS H H 5 8.530 7.647 0.883 1
1 22 . 15 1 1 A 5 5 HIS HA H 5 4.410 4.626 -0.216 1
1 25 . 15 1 1 A 5 5 HIS CA C 5 54.900 55.723 -0.823 1
1 26 . 15 1 1 A 5 5 HIS CB C 5 27.300 31.098 -3.798 1
1 27 . 15 1 1 A 5 5 HIS N N 5 121.600 120.361 1.239 1
1 28 . 15 1 1 A 6 6 HIS HA H 6 4.640 3.970 0.670 1
1 31 . 15 1 1 A 6 6 HIS C C 6 174.100 173.791 0.309 1
1 32 . 15 1 1 A 6 6 HIS CA C 6 55.100 56.632 -1.532 1
1 33 . 15 1 1 A 6 6 HIS CB C 6 29.100 28.159 0.941 1
1 34 . 15 1 1 A 7 7 HIS H H 7 8.690 7.831 0.859 1
1 35 . 15 1 1 A 7 7 HIS HA H 7 4.650 5.073 -0.423 1
1 38 . 15 1 1 A 7 7 HIS C C 7 174.200 172.762 1.438 1
1 39 . 15 1 1 A 7 7 HIS CA C 7 55.200 53.865 1.335 1
1 40 . 15 1 1 A 7 7 HIS CB C 7 29.300 32.035 -2.735 1
1 41 . 15 1 1 A 7 7 HIS N N 7 121.400 119.722 1.678 1
1 42 . 15 1 1 A 8 8 HIS H H 8 8.660 8.975 -0.315 1
1 43 . 15 1 1 A 8 8 HIS HA H 8 4.700 4.558 0.142 1
1 46 . 15 1 1 A 8 8 HIS C C 8 174.200 175.406 -1.206 1
1 47 . 15 1 1 A 8 8 HIS CA C 8 55.000 55.894 -0.894 1
1 48 . 15 1 1 A 8 8 HIS CB C 8 29.300 30.967 -1.667 1
1 49 . 15 1 1 A 8 8 HIS N N 8 120.400 125.208 -4.808 1
1 50 . 15 1 1 A 9 9 SER H H 9 8.490 8.064 0.426 1
1 51 . 15 1 1 A 9 9 SER HA H 9 4.390 4.452 -0.062 1
1 54 . 15 1 1 A 9 9 SER C C 9 174.100 174.016 0.084 1
1 55 . 15 1 1 A 9 9 SER CA C 9 58.300 59.054 -0.754 1
1 56 . 15 1 1 A 9 9 SER CB C 9 63.700 63.399 0.301 1
1 57 . 15 1 1 A 9 9 SER N N 9 118.100 121.373 -3.273 1
1 58 . 15 1 1 A 10 10 HIS H H 10 8.710 8.856 -0.146 1
1 59 . 15 1 1 A 10 10 HIS HA H 10 4.690 4.757 -0.067 1
1 63 . 15 1 1 A 10 10 HIS C C 10 174.200 174.513 -0.313 1
1 64 . 15 1 1 A 10 10 HIS CA C 10 55.200 55.157 0.043 1
1 65 . 15 1 1 A 10 10 HIS CB C 10 28.800 30.098 -1.298 1
1 66 . 15 1 1 A 10 10 HIS N N 10 120.700 126.013 -5.313 1
1 67 . 15 1 1 A 11 11 MET H H 11 8.410 8.406 0.004 1
1 68 . 15 1 1 A 11 11 MET HA H 11 4.420 4.399 0.021 1
1 76 . 15 1 1 A 11 11 MET C C 11 175.800 176.516 -0.716 1
1 77 . 15 1 1 A 11 11 MET CA C 11 55.100 55.312 -0.212 1
1 78 . 15 1 1 A 11 11 MET CB C 11 32.800 32.572 0.228 1
1 81 . 15 1 1 A 11 11 MET N N 11 122.300 125.229 -2.929 1
1 82 . 15 1 1 A 12 12 ALA H H 12 8.440 8.980 -0.540 1
1 83 . 15 1 1 A 12 12 ALA HA H 12 4.280 4.999 -0.719 1
1 87 . 15 1 1 A 12 12 ALA C C 12 177.400 176.136 1.264 1
1 88 . 15 1 1 A 12 12 ALA CA C 12 52.400 50.224 2.176 1
1 89 . 15 1 1 A 12 12 ALA CB C 12 18.800 22.248 -3.448 1
1 90 . 15 1 1 A 12 12 ALA N N 12 125.900 126.547 -0.647 1
1 91 . 15 1 1 A 13 13 ASN H H 13 8.440 8.566 -0.126 1
1 92 . 15 1 1 A 13 13 ASN HA H 13 4.660 5.197 -0.537 1
1 97 . 15 1 1 A 13 13 ASN C C 13 175.900 175.192 0.708 1
1 98 . 15 1 1 A 13 13 ASN CA C 13 53.200 52.858 0.342 1
1 99 . 15 1 1 A 13 13 ASN CB C 13 38.800 39.183 -0.383 1
1 100 . 15 1 1 A 13 13 ASN N N 13 118.300 117.263 1.037 1
1 102 . 15 1 1 A 14 14 GLY H H 14 8.370 8.548 -0.178 1
1 103 . 15 1 1 A 14 14 GLY HA2 H 14 3.920 4.197 -0.277 1
1 104 . 15 1 1 A 14 14 GLY HA3 H 14 3.920 4.199 -0.279 1
1 105 . 15 1 1 A 14 14 GLY C C 14 174.000 174.043 -0.043 1
1 106 . 15 1 1 A 14 14 GLY CA C 14 45.200 45.423 -0.223 1
1 107 . 15 1 1 A 14 14 GLY N N 14 109.600 109.619 -0.019 1
1 108 . 15 1 1 A 15 15 ALA H H 15 8.140 8.581 -0.441 1
1 109 . 15 1 1 A 15 15 ALA HA H 15 4.280 4.666 -0.386 1
1 113 . 15 1 1 A 15 15 ALA C C 15 177.300 177.451 -0.151 1
1 114 . 15 1 1 A 15 15 ALA CA C 15 52.500 51.152 1.348 1
1 115 . 15 1 1 A 15 15 ALA CB C 15 19.100 18.930 0.170 1
1 116 . 15 1 1 A 15 15 ALA N N 15 123.800 124.366 -0.566 1
1 117 . 15 1 1 A 16 16 ALA H H 16 8.030 7.542 0.488 1
1 118 . 15 1 1 A 16 16 ALA HA H 16 4.280 4.230 0.050 1
1 122 . 15 1 1 A 16 16 ALA C C 16 178.400 178.993 -0.593 1
1 123 . 15 1 1 A 16 16 ALA CA C 16 52.600 52.784 -0.184 1
1 124 . 15 1 1 A 16 16 ALA CB C 16 19.100 19.078 0.022 1
1 125 . 15 1 1 A 16 16 ALA N N 16 122.300 121.412 0.888 1
1 126 . 15 1 1 A 17 17 GLY H H 17 8.320 8.790 -0.470 1
1 127 . 15 1 1 A 17 17 GLY HA2 H 17 3.960 3.856 0.104 1
1 128 . 15 1 1 A 17 17 GLY HA3 H 17 3.960 3.857 0.103 1
1 129 . 15 1 1 A 17 17 GLY C C 17 174.500 175.173 -0.673 1
1 130 . 15 1 1 A 17 17 GLY CA C 17 45.200 46.667 -1.467 1
1 131 . 15 1 1 A 17 17 GLY N N 17 107.800 110.908 -3.108 1
1 132 . 15 1 1 A 18 18 THR H H 18 7.970 7.815 0.155 1
1 133 . 15 1 1 A 18 18 THR HA H 18 4.290 4.061 0.229 1
1 138 . 15 1 1 A 18 18 THR C C 18 174.600 176.132 -1.532 1
1 139 . 15 1 1 A 18 18 THR CA C 18 62.000 66.258 -4.258 1
1 140 . 15 1 1 A 18 18 THR CB C 18 69.700 68.386 1.314 1
1 142 . 15 1 1 A 18 18 THR N N 18 113.800 117.294 -3.494 1
1 143 . 15 1 1 A 19 19 LYS H H 19 8.350 8.579 -0.229 1
1 144 . 15 1 1 A 19 19 LYS HA H 19 4.270 4.163 0.107 1
1 153 . 15 1 1 A 19 19 LYS C C 19 176.600 176.767 -0.167 1
1 154 . 15 1 1 A 19 19 LYS CA C 19 56.500 58.748 -2.248 1
1 155 . 15 1 1 A 19 19 LYS CB C 19 32.800 32.124 0.676 1
1 159 . 15 1 1 A 19 19 LYS N N 19 124.000 119.602 4.398 1
1 160 . 15 1 1 A 20 20 VAL H H 20 8.060 7.632 0.428 1
1 161 . 15 1 1 A 20 20 VAL HA H 20 3.990 4.294 -0.304 1
1 169 . 15 1 1 A 20 20 VAL C C 20 175.900 176.277 -0.377 1
1 170 . 15 1 1 A 20 20 VAL CA C 20 62.400 62.188 0.212 1
1 171 . 15 1 1 A 20 20 VAL CB C 20 32.600 29.731 2.869 1
1 174 . 15 1 1 A 20 20 VAL N N 20 121.700 119.895 1.805 1
1 175 . 15 1 1 A 21 21 ALA H H 21 8.310 8.100 0.210 1
1 176 . 15 1 1 A 21 21 ALA HA H 21 4.290 4.122 0.168 1
1 180 . 15 1 1 A 21 21 ALA C C 21 177.600 178.813 -1.213 1
1 181 . 15 1 1 A 21 21 ALA CA C 21 52.400 54.460 -2.060 1
1 182 . 15 1 1 A 21 21 ALA CB C 21 19.000 18.614 0.386 1
1 183 . 15 1 1 A 21 21 ALA N N 21 127.700 129.290 -1.590 1
1 184 . 15 1 1 A 22 22 LEU H H 22 8.150 7.917 0.233 1
1 185 . 15 1 1 A 22 22 LEU HA H 22 4.280 4.278 0.002 1
1 195 . 15 1 1 A 22 22 LEU C C 22 177.400 177.722 -0.322 1
1 196 . 15 1 1 A 22 22 LEU CA C 22 55.200 54.819 0.381 1
1 197 . 15 1 1 A 22 22 LEU CB C 22 42.200 41.325 0.875 1
1 201 . 15 1 1 A 22 22 LEU N N 22 121.800 117.597 4.203 1
1 202 . 15 1 1 A 23 23 ARG H H 23 8.240 8.762 -0.522 1
1 203 . 15 1 1 A 23 23 ARG HA H 23 4.290 4.170 0.120 1
1 211 . 15 1 1 A 23 23 ARG C C 23 176.300 176.018 0.282 1
1 212 . 15 1 1 A 23 23 ARG CA C 23 56.000 56.995 -0.995 1
1 213 . 15 1 1 A 23 23 ARG CB C 23 30.600 29.627 0.973 1
1 216 . 15 1 1 A 23 23 ARG N N 23 122.000 119.784 2.216 1
1 218 . 15 1 1 A 24 24 LYS H H 24 8.370 7.903 0.467 1
1 219 . 15 1 1 A 24 24 LYS HA H 24 4.330 4.322 0.008 1
1 228 . 15 1 1 A 24 24 LYS C C 24 176.800 176.200 0.600 1
1 229 . 15 1 1 A 24 24 LYS CA C 24 56.400 56.345 0.055 1
1 230 . 15 1 1 A 24 24 LYS CB C 24 32.700 33.686 -0.986 1
1 234 . 15 1 1 A 24 24 LYS N N 24 122.900 117.762 5.138 1
1 235 . 15 1 1 A 25 25 THR H H 25 8.100 7.565 0.535 1
1 236 . 15 1 1 A 25 25 THR HA H 25 4.290 4.394 -0.104 1
1 241 . 15 1 1 A 25 25 THR C C 25 174.600 174.243 0.357 1
1 242 . 15 1 1 A 25 25 THR CA C 25 61.500 60.668 0.832 1
1 243 . 15 1 1 A 25 25 THR CB C 25 69.800 70.746 -0.946 1
1 245 . 15 1 1 A 25 25 THR N N 25 115.500 114.958 0.542 1
1 246 . 15 1 1 A 26 26 LYS H H 26 8.370 8.675 -0.305 1
1 247 . 15 1 1 A 26 26 LYS HA H 26 4.270 4.321 -0.051 1
1 256 . 15 1 1 A 26 26 LYS C C 26 176.600 176.927 -0.327 1
1 257 . 15 1 1 A 26 26 LYS CA C 26 56.600 56.442 0.158 1
1 258 . 15 1 1 A 26 26 LYS CB C 26 32.700 33.244 -0.544 1
1 262 . 15 1 1 A 26 26 LYS N N 26 123.700 123.997 -0.297 1
1 263 . 15 1 1 A 27 27 GLN H H 27 8.390 8.766 -0.376 1
1 264 . 15 1 1 A 27 27 GLN HA H 27 4.240 4.642 -0.402 1
1 271 . 15 1 1 A 27 27 GLN C C 27 175.900 175.924 -0.024 1
1 272 . 15 1 1 A 27 27 GLN CA C 27 56.100 56.052 0.048 1
1 273 . 15 1 1 A 27 27 GLN CB C 27 29.300 30.924 -1.624 1
1 275 . 15 1 1 A 27 27 GLN N N 27 121.700 118.229 3.471 1
1 277 . 15 1 1 A 28 28 ALA H H 28 8.330 7.707 0.623 1
1 278 . 15 1 1 A 28 28 ALA HA H 28 4.240 4.483 -0.243 1
1 282 . 15 1 1 A 28 28 ALA C C 28 177.700 176.943 0.757 1
1 283 . 15 1 1 A 28 28 ALA CA C 28 52.500 51.327 1.173 1
1 284 . 15 1 1 A 28 28 ALA CB C 28 19.100 22.053 -2.953 1
1 285 . 15 1 1 A 28 28 ALA N N 28 125.400 119.721 5.679 1
1 286 . 15 1 1 A 29 29 ALA H H 29 8.250 8.867 -0.617 1
1 287 . 15 1 1 A 29 29 ALA HA H 29 4.230 4.095 0.135 1
1 291 . 15 1 1 A 29 29 ALA C C 29 178.000 179.023 -1.023 1
1 292 . 15 1 1 A 29 29 ALA CA C 29 52.500 54.682 -2.182 1
1 293 . 15 1 1 A 29 29 ALA CB C 29 19.100 18.401 0.699 1
1 294 . 15 1 1 A 29 29 ALA N N 29 123.000 122.113 0.887 1
1 295 . 15 1 1 A 30 30 GLU H H 30 8.260 8.039 0.221 1
1 296 . 15 1 1 A 30 30 GLU HA H 30 4.220 4.211 0.009 1
1 301 . 15 1 1 A 30 30 GLU C C 30 176.500 176.820 -0.320 1
1 302 . 15 1 1 A 30 30 GLU CA C 30 56.400 58.368 -1.968 1
1 303 . 15 1 1 A 30 30 GLU CB C 30 29.500 29.389 0.111 1
1 305 . 15 1 1 A 30 30 GLU N N 30 119.700 117.514 2.186 1
1 306 . 15 1 1 A 31 31 LYS H H 31 8.230 8.200 0.030 1
1 307 . 15 1 1 A 31 31 LYS HA H 31 4.280 4.571 -0.291 1
1 316 . 15 1 1 A 31 31 LYS C C 31 176.500 176.300 0.200 1
1 317 . 15 1 1 A 31 31 LYS CA C 31 56.400 56.690 -0.290 1
1 318 . 15 1 1 A 31 31 LYS CB C 31 32.800 35.804 -3.004 1
1 322 . 15 1 1 A 31 31 LYS N N 31 122.700 118.871 3.829 1
1 323 . 15 1 1 A 32 32 ILE H H 32 8.140 7.357 0.783 1
1 324 . 15 1 1 A 32 32 ILE HA H 32 4.110 4.071 0.039 1
1 334 . 15 1 1 A 32 32 ILE C C 32 176.400 177.499 -1.099 1
1 335 . 15 1 1 A 32 32 ILE CA C 32 61.200 62.260 -1.060 1
1 336 . 15 1 1 A 32 32 ILE CB C 32 38.600 37.550 1.050 1
1 340 . 15 1 1 A 32 32 ILE N N 32 122.300 121.695 0.605 1
1 341 . 15 1 1 A 33 33 SER H H 33 8.230 9.159 -0.929 1
1 342 . 15 1 1 A 33 33 SER HA H 33 4.400 4.165 0.235 1
1 345 . 15 1 1 A 33 33 SER C C 33 174.800 176.690 -1.890 1
1 346 . 15 1 1 A 33 33 SER CA C 33 58.300 61.818 -3.518 1
1 347 . 15 1 1 A 33 33 SER CB C 33 63.700 62.318 1.382 1
1 348 . 15 1 1 A 33 33 SER N N 33 119.600 121.881 -2.281 1
1 349 . 15 1 1 A 34 34 ALA H H 34 8.430 8.256 0.174 1
1 350 . 15 1 1 A 34 34 ALA HA H 34 4.220 4.103 0.117 1
1 354 . 15 1 1 A 34 34 ALA C C 34 179.500 179.997 -0.497 1
1 355 . 15 1 1 A 34 34 ALA CA C 34 53.500 55.330 -1.830 1
1 356 . 15 1 1 A 34 34 ALA CB C 34 18.800 18.402 0.398 1
1 357 . 15 1 1 A 34 34 ALA N N 34 126.000 123.134 2.866 1
1 358 . 15 1 1 A 35 35 ASP H H 35 8.380 8.231 0.149 1
1 359 . 15 1 1 A 35 35 ASP HA H 35 4.520 4.366 0.154 1
1 362 . 15 1 1 A 35 35 ASP C C 35 176.500 178.456 -1.956 1
1 363 . 15 1 1 A 35 35 ASP CA C 35 54.800 57.005 -2.205 1
1 364 . 15 1 1 A 35 35 ASP CB C 35 40.200 40.443 -0.243 1
1 365 . 15 1 1 A 35 35 ASP N N 35 118.200 117.590 0.610 1
1 366 . 15 1 1 A 36 36 LYS H H 36 8.000 7.880 0.120 1
1 367 . 15 1 1 A 36 36 LYS HA H 36 4.270 4.124 0.146 1
1 376 . 15 1 1 A 36 36 LYS C C 36 177.000 177.175 -0.175 1
1 377 . 15 1 1 A 36 36 LYS CA C 36 56.800 58.872 -2.072 1
1 378 . 15 1 1 A 36 36 LYS CB C 36 32.900 32.300 0.600 1
1 382 . 15 1 1 A 36 36 LYS N N 36 120.900 118.754 2.146 1
1 383 . 15 1 1 A 37 37 ILE H H 37 7.970 7.297 0.673 1
1 384 . 15 1 1 A 37 37 ILE HA H 37 4.020 4.079 -0.059 1
1 394 . 15 1 1 A 37 37 ILE C C 37 176.100 175.541 0.559 1
1 395 . 15 1 1 A 37 37 ILE CA C 37 61.300 62.492 -1.192 1
1 396 . 15 1 1 A 37 37 ILE CB C 37 38.100 37.999 0.101 1
1 400 . 15 1 1 A 37 37 ILE N N 37 121.800 121.446 0.354 1
1 401 . 15 1 1 A 38 38 SER H H 38 7.980 8.700 -0.720 1
1 402 . 15 1 1 A 38 38 SER HA H 38 4.540 4.821 -0.281 1
1 405 . 15 1 1 A 38 38 SER C C 38 174.700 175.342 -0.642 1
1 406 . 15 1 1 A 38 38 SER CA C 38 58.200 57.633 0.567 1
1 407 . 15 1 1 A 38 38 SER CB C 38 64.400 65.142 -0.742 1
1 408 . 15 1 1 A 38 38 SER N N 38 119.000 124.677 -5.677 1
1 409 . 15 1 1 A 39 39 LYS H H 39 8.690 9.045 -0.355 1
1 410 . 15 1 1 A 39 39 LYS HA H 39 3.400 3.600 -0.200 1
1 419 . 15 1 1 A 39 39 LYS C C 39 177.400 178.036 -0.636 1
1 420 . 15 1 1 A 39 39 LYS CA C 39 59.800 60.236 -0.436 1
1 421 . 15 1 1 A 39 39 LYS CB C 39 32.400 32.049 0.351 1
1 425 . 15 1 1 A 39 39 LYS N N 39 124.200 125.339 -1.139 1
1 426 . 15 1 1 A 40 40 GLU H H 40 8.280 8.315 -0.035 1
1 427 . 15 1 1 A 40 40 GLU HA H 40 3.840 4.035 -0.195 1
1 432 . 15 1 1 A 40 40 GLU C C 40 178.400 178.684 -0.284 1
1 433 . 15 1 1 A 40 40 GLU CA C 40 59.400 59.014 0.386 1
1 434 . 15 1 1 A 40 40 GLU CB C 40 28.300 29.425 -1.125 1
1 436 . 15 1 1 A 40 40 GLU N N 40 116.300 117.297 -0.997 1
1 437 . 15 1 1 A 41 41 ALA H H 41 7.890 7.702 0.188 1
1 438 . 15 1 1 A 41 41 ALA HA H 41 3.910 3.987 -0.077 1
1 442 . 15 1 1 A 41 41 ALA C C 41 179.900 179.867 0.033 1
1 443 . 15 1 1 A 41 41 ALA CA C 41 54.700 55.030 -0.330 1
1 444 . 15 1 1 A 41 41 ALA CB C 41 17.900 18.033 -0.133 1
1 445 . 15 1 1 A 41 41 ALA N N 41 122.300 122.338 -0.038 1
1 446 . 15 1 1 A 42 42 LEU H H 42 7.490 7.716 -0.226 1
1 447 . 15 1 1 A 42 42 LEU HA H 42 3.480 3.587 -0.107 1
1 457 . 15 1 1 A 42 42 LEU C C 42 178.900 178.555 0.345 1
1 458 . 15 1 1 A 42 42 LEU CA C 42 59.800 57.864 1.936 1
1 459 . 15 1 1 A 42 42 LEU CB C 42 42.300 41.361 0.939 1
1 463 . 15 1 1 A 42 42 LEU N N 42 121.000 119.030 1.970 1
1 464 . 15 1 1 A 43 43 LEU H H 43 8.290 8.067 0.223 1
1 465 . 15 1 1 A 43 43 LEU HA H 43 3.780 3.792 -0.012 1
1 475 . 15 1 1 A 43 43 LEU C C 43 179.400 179.095 0.305 1
1 476 . 15 1 1 A 43 43 LEU CA C 43 57.600 58.108 -0.508 1
1 477 . 15 1 1 A 43 43 LEU CB C 43 40.900 41.422 -0.522 1
1 481 . 15 1 1 A 43 43 LEU N N 43 119.200 118.297 0.903 1
1 482 . 15 1 1 A 44 44 GLU H H 44 8.330 8.045 0.285 1
1 483 . 15 1 1 A 44 44 GLU HA H 44 4.050 3.877 0.173 1
1 488 . 15 1 1 A 44 44 GLU C C 44 178.600 179.196 -0.596 1
1 489 . 15 1 1 A 44 44 GLU CA C 44 58.900 59.291 -0.391 1
1 490 . 15 1 1 A 44 44 GLU CB C 44 28.300 29.206 -0.906 1
1 492 . 15 1 1 A 44 44 GLU N N 44 119.600 117.356 2.244 1
1 493 . 15 1 1 A 45 45 CYS H H 45 7.690 8.110 -0.420 1
1 494 . 15 1 1 A 45 45 CYS HA H 45 4.120 4.099 0.021 1
1 497 . 15 1 1 A 45 45 CYS C C 45 176.100 176.831 -0.731 1
1 498 . 15 1 1 A 45 45 CYS CA C 45 62.500 63.183 -0.683 1
1 499 . 15 1 1 A 45 45 CYS CB C 45 26.200 26.942 -0.742 1
1 500 . 15 1 1 A 45 45 CYS N N 45 120.900 118.684 2.216 1
1 501 . 15 1 1 A 46 46 ALA H H 46 8.540 8.151 0.389 1
1 502 . 15 1 1 A 46 46 ALA HA H 46 3.900 4.006 -0.106 1
1 506 . 15 1 1 A 46 46 ALA C C 46 179.200 178.768 0.432 1
1 507 . 15 1 1 A 46 46 ALA CA C 46 55.500 55.535 -0.035 1
1 508 . 15 1 1 A 46 46 ALA CB C 46 16.800 17.688 -0.888 1
1 509 . 15 1 1 A 46 46 ALA N N 46 121.500 122.096 -0.596 1
1 510 . 15 1 1 A 47 47 ASP H H 47 8.460 8.229 0.231 1
1 511 . 15 1 1 A 47 47 ASP HA H 47 4.340 4.369 -0.029 1
1 514 . 15 1 1 A 47 47 ASP C C 47 178.800 178.718 0.082 1
1 515 . 15 1 1 A 47 47 ASP CA C 47 56.600 56.868 -0.268 1
1 516 . 15 1 1 A 47 47 ASP CB C 47 39.800 41.903 -2.103 1
1 517 . 15 1 1 A 47 47 ASP N N 47 119.000 118.314 0.686 1
1 518 . 15 1 1 A 48 48 LEU H H 48 8.040 7.603 0.437 1
1 519 . 15 1 1 A 48 48 LEU HA H 48 4.110 3.906 0.204 1
1 529 . 15 1 1 A 48 48 LEU C C 48 180.000 179.452 0.548 1
1 530 . 15 1 1 A 48 48 LEU CA C 48 58.000 58.274 -0.274 1
1 531 . 15 1 1 A 48 48 LEU CB C 48 41.700 41.493 0.207 1
1 535 . 15 1 1 A 48 48 LEU N N 48 123.000 119.034 3.966 1
1 536 . 15 1 1 A 49 49 LEU H H 49 8.300 7.720 0.580 1
1 537 . 15 1 1 A 49 49 LEU HA H 49 4.110 3.995 0.115 1
1 547 . 15 1 1 A 49 49 LEU C C 49 177.200 178.820 -1.620 1
1 548 . 15 1 1 A 49 49 LEU CA C 49 57.600 57.787 -0.187 1
1 549 . 15 1 1 A 49 49 LEU CB C 49 41.200 41.554 -0.354 1
1 553 . 15 1 1 A 49 49 LEU N N 49 120.900 119.239 1.661 1
1 554 . 15 1 1 A 50 50 SER H H 50 8.660 7.836 0.824 1
1 555 . 15 1 1 A 50 50 SER HA H 50 4.000 4.098 -0.098 1
1 558 . 15 1 1 A 50 50 SER C C 50 176.800 176.906 -0.106 1
1 559 . 15 1 1 A 50 50 SER CA C 50 62.500 61.643 0.857 1
1 560 . 15 1 1 A 50 50 SER CB C 50 62.600 62.938 -0.338 1
1 561 . 15 1 1 A 50 50 SER N N 50 113.300 114.626 -1.326 1
1 562 . 15 1 1 A 51 51 SER H H 51 7.980 8.382 -0.402 1
1 563 . 15 1 1 A 51 51 SER HA H 51 4.220 4.117 0.103 1
1 566 . 15 1 1 A 51 51 SER C C 51 176.300 175.875 0.425 1
1 567 . 15 1 1 A 51 51 SER CA C 51 61.200 61.815 -0.615 1
1 568 . 15 1 1 A 51 51 SER CB C 51 62.700 63.254 -0.554 1
1 569 . 15 1 1 A 51 51 SER N N 51 115.900 117.006 -1.106 1
1 570 . 15 1 1 A 52 52 ALA H H 52 8.030 8.306 -0.276 1
1 571 . 15 1 1 A 52 52 ALA HA H 52 4.130 4.192 -0.062 1
1 575 . 15 1 1 A 52 52 ALA C C 52 178.500 180.272 -1.772 1
1 576 . 15 1 1 A 52 52 ALA CA C 52 54.500 55.072 -0.572 1
1 577 . 15 1 1 A 52 52 ALA CB C 52 18.000 18.202 -0.202 1
1 578 . 15 1 1 A 52 52 ALA N N 52 125.400 123.617 1.783 1
1 579 . 15 1 1 A 53 53 LEU H H 53 7.710 8.027 -0.317 1
1 580 . 15 1 1 A 53 53 LEU HA H 53 4.180 4.128 0.052 1
1 590 . 15 1 1 A 53 53 LEU C C 53 177.700 178.133 -0.433 1
1 591 . 15 1 1 A 53 53 LEU CA C 53 56.500 57.197 -0.697 1
1 592 . 15 1 1 A 53 53 LEU CB C 53 42.400 41.634 0.766 1
1 596 . 15 1 1 A 53 53 LEU N N 53 113.800 118.328 -4.528 1
1 597 . 15 1 1 A 54 54 THR H H 54 7.550 7.517 0.033 1
1 598 . 15 1 1 A 54 54 THR HA H 54 4.420 4.374 0.046 1
1 603 . 15 1 1 A 54 54 THR C C 54 174.100 173.237 0.863 1
1 604 . 15 1 1 A 54 54 THR CA C 54 61.600 62.080 -0.480 1
1 605 . 15 1 1 A 54 54 THR CB C 54 69.300 69.524 -0.224 1
1 607 . 15 1 1 A 54 54 THR N N 54 107.700 106.455 1.245 1
1 608 . 15 1 1 A 55 55 GLU H H 55 7.750 7.696 0.054 1
1 609 . 15 1 1 A 55 55 GLU HA H 55 4.760 4.912 -0.152 1
1 614 . 15 1 1 A 55 55 GLU CA C 55 53.400 53.675 -0.275 1
1 615 . 15 1 1 A 55 55 GLU CB C 55 30.100 32.383 -2.283 1
1 617 . 15 1 1 A 55 55 GLU N N 55 122.800 118.287 4.513 1
1 618 . 15 1 1 A 56 56 PRO HA H 56 4.670 4.591 0.079 1
1 625 . 15 1 1 A 56 56 PRO C C 56 176.200 176.380 -0.180 1
1 626 . 15 1 1 A 56 56 PRO CA C 56 62.900 63.189 -0.289 1
1 627 . 15 1 1 A 56 56 PRO CB C 56 29.200 31.862 -2.662 1
1 630 . 15 1 1 A 57 57 VAL H H 57 8.010 8.366 -0.356 1
1 631 . 15 1 1 A 57 57 VAL HA H 57 4.590 4.927 -0.337 1
1 639 . 15 1 1 A 57 57 VAL CA C 57 58.600 58.348 0.252 1
1 640 . 15 1 1 A 57 57 VAL CB C 57 32.800 34.674 -1.874 1
1 643 . 15 1 1 A 57 57 VAL N N 57 121.400 117.543 3.857 1
1 644 . 15 1 1 A 58 58 PRO HA H 58 4.450 5.008 -0.558 1
1 651 . 15 1 1 A 58 58 PRO C C 58 177.500 177.950 -0.450 1
1 652 . 15 1 1 A 58 58 PRO CA C 58 62.600 62.960 -0.360 1
1 653 . 15 1 1 A 58 58 PRO CB C 58 32.200 31.729 0.471 1
1 656 . 15 1 1 A 59 59 ASN H H 59 8.890 8.560 0.330 1
1 657 . 15 1 1 A 59 59 ASN HA H 59 4.330 4.374 -0.044 1
1 662 . 15 1 1 A 59 59 ASN C C 59 177.600 177.490 0.110 1
1 663 . 15 1 1 A 59 59 ASN CA C 59 56.300 56.562 -0.262 1
1 664 . 15 1 1 A 59 59 ASN CB C 59 38.400 38.337 0.063 1
1 665 . 15 1 1 A 59 59 ASN N N 59 122.200 121.993 0.207 1
1 667 . 15 1 1 A 60 60 SER H H 60 8.660 8.047 0.613 1
1 668 . 15 1 1 A 60 60 SER HA H 60 4.010 4.069 -0.059 1
1 671 . 15 1 1 A 60 60 SER C C 60 176.200 177.288 -1.088 1
1 672 . 15 1 1 A 60 60 SER CA C 60 60.800 61.428 -0.628 1
1 673 . 15 1 1 A 60 60 SER CB C 60 61.500 63.078 -1.578 1
1 674 . 15 1 1 A 60 60 SER N N 60 113.200 115.254 -2.054 1
1 675 . 15 1 1 A 61 61 GLN H H 61 7.420 7.895 -0.475 1
1 676 . 15 1 1 A 61 61 GLN HA H 61 4.280 4.016 0.264 1
1 683 . 15 1 1 A 61 61 GLN C C 61 178.600 178.525 0.075 1
1 684 . 15 1 1 A 61 61 GLN CA C 61 57.900 58.827 -0.927 1
1 685 . 15 1 1 A 61 61 GLN CB C 61 28.600 28.117 0.483 1
1 687 . 15 1 1 A 61 61 GLN N N 61 122.200 120.392 1.808 1
1 689 . 15 1 1 A 62 62 LEU H H 62 7.430 7.863 -0.433 1
1 690 . 15 1 1 A 62 62 LEU HA H 62 3.850 4.022 -0.172 1
1 700 . 15 1 1 A 62 62 LEU C C 62 178.800 178.875 -0.075 1
1 701 . 15 1 1 A 62 62 LEU CA C 62 57.900 58.042 -0.142 1
1 702 . 15 1 1 A 62 62 LEU CB C 62 42.100 42.222 -0.122 1
1 706 . 15 1 1 A 62 62 LEU N N 62 120.600 119.990 0.610 1
1 707 . 15 1 1 A 63 63 VAL H H 63 8.200 7.994 0.206 1
1 708 . 15 1 1 A 63 63 VAL HA H 63 3.370 3.318 0.052 1
1 716 . 15 1 1 A 63 63 VAL C C 63 178.000 177.634 0.366 1
1 717 . 15 1 1 A 63 63 VAL CA C 63 66.600 66.801 -0.201 1
1 718 . 15 1 1 A 63 63 VAL CB C 63 31.700 31.159 0.541 1
1 721 . 15 1 1 A 63 63 VAL N N 63 118.200 117.307 0.893 1
1 722 . 15 1 1 A 64 64 ASP H H 64 7.960 8.234 -0.274 1
1 723 . 15 1 1 A 64 64 ASP HA H 64 4.460 4.360 0.100 1
1 726 . 15 1 1 A 64 64 ASP C C 64 178.100 178.439 -0.339 1
1 727 . 15 1 1 A 64 64 ASP CA C 64 57.700 57.317 0.383 1
1 728 . 15 1 1 A 64 64 ASP CB C 64 39.800 41.357 -1.557 1
1 729 . 15 1 1 A 64 64 ASP N N 64 120.200 120.154 0.046 1
1 730 . 15 1 1 A 65 65 THR H H 65 8.380 8.420 -0.040 1
1 731 . 15 1 1 A 65 65 THR HA H 65 3.970 3.958 0.012 1
1 736 . 15 1 1 A 65 65 THR C C 65 176.500 177.099 -0.599 1
1 737 . 15 1 1 A 65 65 THR CA C 65 66.500 66.553 -0.053 1
1 738 . 15 1 1 A 65 65 THR CB C 65 67.800 68.182 -0.382 1
1 740 . 15 1 1 A 65 65 THR N N 65 118.100 115.027 3.073 1
1 741 . 15 1 1 A 66 66 GLY H H 66 8.900 8.308 0.592 1
1 742 . 15 1 1 A 66 66 GLY HA2 H 66 3.630 3.585 0.045 1
1 743 . 15 1 1 A 66 66 GLY HA3 H 66 3.630 3.647 -0.017 1
1 744 . 15 1 1 A 66 66 GLY C C 66 174.200 176.764 -2.564 1
1 745 . 15 1 1 A 66 66 GLY CA C 66 47.500 47.436 0.064 1
1 746 . 15 1 1 A 66 66 GLY N N 66 110.500 107.461 3.039 1
1 747 . 15 1 1 A 67 67 HIS H H 67 8.650 7.598 1.052 1
1 748 . 15 1 1 A 67 67 HIS HA H 67 4.220 4.655 -0.435 1
1 752 . 15 1 1 A 67 67 HIS C C 67 176.900 177.773 -0.873 1
1 753 . 15 1 1 A 67 67 HIS CA C 67 59.000 58.074 0.926 1
1 754 . 15 1 1 A 67 67 HIS CB C 67 27.800 29.669 -1.869 1
1 756 . 15 1 1 A 67 67 HIS N N 67 120.100 120.187 -0.087 1
1 757 . 15 1 1 A 68 68 GLN H H 68 7.860 8.291 -0.431 1
1 758 . 15 1 1 A 68 68 GLN HA H 68 3.990 3.807 0.183 1
1 765 . 15 1 1 A 68 68 GLN C C 68 177.800 177.903 -0.103 1
1 766 . 15 1 1 A 68 68 GLN CA C 68 58.800 58.451 0.349 1
1 767 . 15 1 1 A 68 68 GLN CB C 68 28.200 27.471 0.729 1
1 769 . 15 1 1 A 68 68 GLN N N 68 121.400 117.043 4.357 1
1 771 . 15 1 1 A 69 69 LEU H H 69 8.300 7.710 0.590 1
1 772 . 15 1 1 A 69 69 LEU HA H 69 4.330 4.280 0.050 1
1 782 . 15 1 1 A 69 69 LEU C C 69 179.300 179.472 -0.172 1
1 783 . 15 1 1 A 69 69 LEU CA C 69 58.200 58.045 0.155 1
1 784 . 15 1 1 A 69 69 LEU CB C 69 40.500 41.714 -1.214 1
1 788 . 15 1 1 A 69 69 LEU N N 69 120.300 122.027 -1.727 1
1 789 . 15 1 1 A 70 70 LEU H H 70 8.460 8.090 0.370 1
1 790 . 15 1 1 A 70 70 LEU HA H 70 3.880 3.919 -0.039 1
1 800 . 15 1 1 A 70 70 LEU C C 70 179.100 178.768 0.332 1
1 801 . 15 1 1 A 70 70 LEU CA C 70 58.300 57.906 0.394 1
1 802 . 15 1 1 A 70 70 LEU CB C 70 41.500 41.327 0.173 1
1 806 . 15 1 1 A 70 70 LEU N N 70 121.200 118.564 2.636 1
1 807 . 15 1 1 A 71 71 ASP H H 71 8.140 7.991 0.149 1
1 808 . 15 1 1 A 71 71 ASP HA H 71 4.420 4.287 0.133 1
1 811 . 15 1 1 A 71 71 ASP C C 71 180.000 178.206 1.794 1
1 812 . 15 1 1 A 71 71 ASP CA C 71 57.300 57.250 0.050 1
1 813 . 15 1 1 A 71 71 ASP CB C 71 39.300 41.220 -1.920 1
1 814 . 15 1 1 A 71 71 ASP N N 71 121.100 119.356 1.744 1
1 815 . 15 1 1 A 72 72 TYR H H 72 8.320 8.037 0.283 1
1 816 . 15 1 1 A 72 72 TYR HA H 72 4.550 4.471 0.079 1
1 823 . 15 1 1 A 72 72 TYR C C 72 179.100 178.688 0.412 1
1 824 . 15 1 1 A 72 72 TYR CA C 72 60.500 60.723 -0.223 1
1 825 . 15 1 1 A 72 72 TYR CB C 72 37.600 37.888 -0.288 1
1 828 . 15 1 1 A 72 72 TYR N N 72 120.300 117.951 2.349 1
1 829 . 15 1 1 A 73 73 CYS H H 73 8.850 8.574 0.276 1
1 830 . 15 1 1 A 73 73 CYS HA H 73 4.380 4.656 -0.276 1
1 834 . 15 1 1 A 73 73 CYS C C 73 177.300 177.301 -0.001 1
1 835 . 15 1 1 A 73 73 CYS CA C 73 64.400 63.510 0.890 1
1 836 . 15 1 1 A 73 73 CYS CB C 73 27.600 26.265 1.335 1
1 837 . 15 1 1 A 73 73 CYS N N 73 116.800 118.652 -1.852 1
1 838 . 15 1 1 A 74 74 SER H H 74 8.410 8.382 0.028 1
1 839 . 15 1 1 A 74 74 SER HA H 74 4.290 4.291 -0.001 1
1 842 . 15 1 1 A 74 74 SER C C 74 176.300 176.777 -0.477 1
1 843 . 15 1 1 A 74 74 SER CA C 74 61.400 61.156 0.244 1
1 844 . 15 1 1 A 74 74 SER CB C 74 62.600 63.141 -0.541 1
1 845 . 15 1 1 A 74 74 SER N N 74 115.900 116.075 -0.175 1
1 846 . 15 1 1 A 75 75 GLY H H 75 7.790 8.119 -0.329 1
1 847 . 15 1 1 A 75 75 GLY HA2 H 75 4.320 3.745 0.575 1
1 848 . 15 1 1 A 75 75 GLY HA3 H 75 3.900 3.777 0.123 1
1 849 . 15 1 1 A 75 75 GLY C C 75 174.600 175.298 -0.698 1
1 850 . 15 1 1 A 75 75 GLY CA C 75 45.600 47.041 -1.441 1
1 851 . 15 1 1 A 75 75 GLY N N 75 107.500 107.217 0.283 1
1 852 . 15 1 1 A 76 76 TYR H H 76 8.040 8.677 -0.637 1
1 853 . 15 1 1 A 76 76 TYR HA H 76 4.310 4.032 0.278 1
1 860 . 15 1 1 A 76 76 TYR C C 76 176.200 178.082 -1.882 1
1 861 . 15 1 1 A 76 76 TYR CA C 76 60.000 61.068 -1.068 1
1 862 . 15 1 1 A 76 76 TYR CB C 76 40.700 38.579 2.121 1
1 865 . 15 1 1 A 76 76 TYR N N 76 121.900 123.562 -1.662 1
1 866 . 15 1 1 A 77 77 VAL H H 77 7.540 8.184 -0.644 1
1 867 . 15 1 1 A 77 77 VAL HA H 77 3.450 3.546 -0.096 1
1 875 . 15 1 1 A 77 77 VAL C C 77 175.500 177.208 -1.708 1
1 876 . 15 1 1 A 77 77 VAL CA C 77 65.500 64.203 1.297 1
1 877 . 15 1 1 A 77 77 VAL CB C 77 31.600 31.405 0.195 1
1 880 . 15 1 1 A 77 77 VAL N N 77 116.600 119.463 -2.863 1
1 881 . 15 1 1 A 78 78 ASP H H 78 7.580 8.073 -0.493 1
1 882 . 15 1 1 A 78 78 ASP HA H 78 4.380 4.394 -0.014 1
1 885 . 15 1 1 A 78 78 ASP C C 78 177.000 177.557 -0.557 1
1 886 . 15 1 1 A 78 78 ASP CA C 78 55.800 57.336 -1.536 1
1 887 . 15 1 1 A 78 78 ASP CB C 78 39.900 41.474 -1.574 1
1 888 . 15 1 1 A 78 78 ASP N N 78 116.400 120.889 -4.489 1
1 889 . 15 1 1 A 79 79 CYS H H 79 8.040 7.665 0.375 1
1 890 . 15 1 1 A 79 79 CYS HA H 79 4.110 4.476 -0.366 1
1 893 . 15 1 1 A 79 79 CYS C C 79 174.200 173.962 0.238 1
1 894 . 15 1 1 A 79 79 CYS CA C 79 58.600 58.210 0.390 1
1 895 . 15 1 1 A 79 79 CYS CB C 79 27.200 27.114 0.086 1
1 896 . 15 1 1 A 79 79 CYS N N 79 117.000 114.643 2.357 1
1 897 . 15 1 1 A 80 80 ILE H H 80 6.960 7.178 -0.218 1
1 898 . 15 1 1 A 80 80 ILE HA H 80 4.120 4.123 -0.003 1
1 908 . 15 1 1 A 80 80 ILE CA C 80 58.700 57.828 0.872 1
1 909 . 15 1 1 A 80 80 ILE CB C 80 38.500 37.520 0.980 1
1 913 . 15 1 1 A 80 80 ILE N N 80 123.200 122.580 0.620 1
1 914 . 15 1 1 A 81 81 PRO HA H 81 4.340 4.464 -0.124 1
1 921 . 15 1 1 A 81 81 PRO C C 81 178.000 176.438 1.562 1
1 922 . 15 1 1 A 81 81 PRO CA C 81 64.700 64.379 0.321 1
1 923 . 15 1 1 A 81 81 PRO CB C 81 32.600 31.947 0.653 1
1 926 . 15 1 1 A 82 82 GLN H H 82 7.560 8.100 -0.540 1
1 927 . 15 1 1 A 82 82 GLN HA H 82 4.600 4.506 0.094 1
1 934 . 15 1 1 A 82 82 GLN C C 82 177.400 175.565 1.835 1
1 935 . 15 1 1 A 82 82 GLN CA C 82 55.600 55.309 0.291 1
1 936 . 15 1 1 A 82 82 GLN CB C 82 28.800 28.820 -0.020 1
1 938 . 15 1 1 A 82 82 GLN N N 82 115.900 117.880 -1.980 1
1 940 . 15 1 1 A 83 83 THR H H 83 8.880 8.339 0.541 1
1 941 . 15 1 1 A 83 83 THR HA H 83 3.750 3.951 -0.201 1
1 946 . 15 1 1 A 83 83 THR C C 83 176.300 176.274 0.026 1
1 947 . 15 1 1 A 83 83 THR CA C 83 66.500 66.540 -0.040 1
1 948 . 15 1 1 A 83 83 THR CB C 83 68.700 68.797 -0.097 1
1 950 . 15 1 1 A 83 83 THR N N 83 122.700 119.473 3.227 1
1 951 . 15 1 1 A 84 84 ARG H H 84 8.990 8.265 0.725 1
1 952 . 15 1 1 A 84 84 ARG HA H 84 4.250 4.024 0.226 1
1 960 . 15 1 1 A 84 84 ARG C C 84 178.900 178.981 -0.081 1
1 961 . 15 1 1 A 84 84 ARG CA C 84 59.100 59.811 -0.711 1
1 962 . 15 1 1 A 84 84 ARG CB C 84 29.300 30.208 -0.908 1
1 965 . 15 1 1 A 84 84 ARG N N 84 120.100 121.248 -1.148 1
1 967 . 15 1 1 A 85 85 ASN H H 85 7.270 8.402 -1.132 1
1 968 . 15 1 1 A 85 85 ASN HA H 85 4.810 4.640 0.170 1
1 973 . 15 1 1 A 85 85 ASN C C 85 176.800 177.674 -0.874 1
1 974 . 15 1 1 A 85 85 ASN CA C 85 54.800 56.034 -1.234 1
1 975 . 15 1 1 A 85 85 ASN CB C 85 37.600 38.297 -0.697 1
1 976 . 15 1 1 A 85 85 ASN N N 85 117.400 118.262 -0.862 1
1 978 . 15 1 1 A 86 86 LYS H H 86 8.340 8.309 0.031 1
1 979 . 15 1 1 A 86 86 LYS HA H 86 3.890 4.154 -0.264 1
1 988 . 15 1 1 A 86 86 LYS C C 86 178.600 178.706 -0.106 1
1 989 . 15 1 1 A 86 86 LYS CA C 86 60.800 59.100 1.700 1
1 990 . 15 1 1 A 86 86 LYS CB C 86 32.700 32.332 0.368 1
1 994 . 15 1 1 A 86 86 LYS N N 86 124.200 120.798 3.402 1
1 995 . 15 1 1 A 87 87 PHE H H 87 8.120 8.777 -0.657 1
1 996 . 15 1 1 A 87 87 PHE HA H 87 4.260 4.281 -0.021 1
1 1004 . 15 1 1 A 87 87 PHE C C 87 178.100 177.276 0.824 1
1 1005 . 15 1 1 A 87 87 PHE CA C 87 61.300 61.754 -0.454 1
1 1006 . 15 1 1 A 87 87 PHE CB C 87 38.200 39.127 -0.927 1
1 1010 . 15 1 1 A 87 87 PHE N N 87 118.300 121.239 -2.939 1
1 1011 . 15 1 1 A 88 88 ALA H H 88 7.860 8.031 -0.171 1
1 1012 . 15 1 1 A 88 88 ALA HA H 88 4.200 3.936 0.264 1
1 1016 . 15 1 1 A 88 88 ALA C C 88 180.600 179.510 1.090 1
1 1017 . 15 1 1 A 88 88 ALA CA C 88 54.900 55.145 -0.245 1
1 1018 . 15 1 1 A 88 88 ALA CB C 88 18.100 18.049 0.051 1
1 1019 . 15 1 1 A 88 88 ALA N N 88 121.700 120.634 1.066 1
1 1020 . 15 1 1 A 89 89 PHE H H 89 8.690 8.488 0.202 1
1 1021 . 15 1 1 A 89 89 PHE HA H 89 4.080 4.121 -0.041 1
1 1029 . 15 1 1 A 89 89 PHE C C 89 176.300 177.828 -1.528 1
1 1030 . 15 1 1 A 89 89 PHE CA C 89 62.000 61.556 0.444 1
1 1031 . 15 1 1 A 89 89 PHE CB C 89 39.800 39.616 0.184 1
1 1035 . 15 1 1 A 89 89 PHE N N 89 120.100 119.494 0.606 1
1 1036 . 15 1 1 A 90 90 ARG H H 90 8.560 8.326 0.234 1
1 1037 . 15 1 1 A 90 90 ARG HA H 90 3.790 3.837 -0.047 1
1 1045 . 15 1 1 A 90 90 ARG C C 90 179.600 178.536 1.064 1
1 1046 . 15 1 1 A 90 90 ARG CA C 90 60.000 59.628 0.372 1
1 1047 . 15 1 1 A 90 90 ARG CB C 90 30.000 30.063 -0.063 1
1 1050 . 15 1 1 A 90 90 ARG N N 90 118.000 118.231 -0.231 1
1 1052 . 15 1 1 A 91 91 GLU H H 91 8.120 8.180 -0.060 1
1 1053 . 15 1 1 A 91 91 GLU HA H 91 3.980 3.908 0.072 1
1 1058 . 15 1 1 A 91 91 GLU C C 91 178.400 178.853 -0.453 1
1 1059 . 15 1 1 A 91 91 GLU CA C 91 58.900 59.285 -0.385 1
1 1060 . 15 1 1 A 91 91 GLU CB C 91 28.800 28.752 0.048 1
1 1062 . 15 1 1 A 91 91 GLU N N 91 119.300 118.346 0.954 1
1 1063 . 15 1 1 A 92 92 ALA H H 92 7.820 8.118 -0.298 1
1 1064 . 15 1 1 A 92 92 ALA HA H 92 4.050 3.941 0.109 1
1 1068 . 15 1 1 A 92 92 ALA C C 92 179.800 179.909 -0.109 1
1 1069 . 15 1 1 A 92 92 ALA CA C 92 55.000 55.240 -0.240 1
1 1070 . 15 1 1 A 92 92 ALA CB C 92 18.000 17.919 0.081 1
1 1071 . 15 1 1 A 92 92 ALA N N 92 123.400 122.859 0.541 1
1 1072 . 15 1 1 A 93 93 VAL H H 93 8.430 7.896 0.534 1
1 1073 . 15 1 1 A 93 93 VAL HA H 93 3.250 3.327 -0.077 1
1 1081 . 15 1 1 A 93 93 VAL C C 93 177.900 177.964 -0.064 1
1 1082 . 15 1 1 A 93 93 VAL CA C 93 66.800 66.788 0.012 1
1 1083 . 15 1 1 A 93 93 VAL CB C 93 31.300 31.281 0.019 1
1 1086 . 15 1 1 A 93 93 VAL N N 93 119.900 118.662 1.238 1
1 1087 . 15 1 1 A 94 94 SER H H 94 7.990 7.842 0.148 1
1 1088 . 15 1 1 A 94 94 SER HA H 94 4.230 3.966 0.264 1
1 1091 . 15 1 1 A 94 94 SER C C 94 177.200 177.414 -0.214 1
1 1092 . 15 1 1 A 94 94 SER CA C 94 61.600 61.633 -0.033 1
1 1093 . 15 1 1 A 94 94 SER CB C 94 62.700 62.846 -0.146 1
1 1094 . 15 1 1 A 94 94 SER N N 94 116.000 115.954 0.046 1
1 1095 . 15 1 1 A 95 95 LYS H H 95 7.710 7.513 0.197 1
1 1096 . 15 1 1 A 95 95 LYS HA H 95 4.020 3.999 0.021 1
1 1105 . 15 1 1 A 95 95 LYS C C 95 179.400 179.109 0.291 1
1 1106 . 15 1 1 A 95 95 LYS CA C 95 59.600 59.386 0.214 1
1 1107 . 15 1 1 A 95 95 LYS CB C 95 32.300 32.604 -0.304 1
1 1111 . 15 1 1 A 95 95 LYS N N 95 121.400 121.831 -0.431 1
1 1112 . 15 1 1 A 96 96 LEU H H 96 8.270 7.888 0.382 1
1 1113 . 15 1 1 A 96 96 LEU HA H 96 4.040 3.947 0.093 1
1 1123 . 15 1 1 A 96 96 LEU C C 96 177.700 178.248 -0.548 1
1 1124 . 15 1 1 A 96 96 LEU CA C 96 58.600 58.176 0.424 1
1 1125 . 15 1 1 A 96 96 LEU CB C 96 41.000 41.816 -0.816 1
1 1129 . 15 1 1 A 96 96 LEU N N 96 124.800 120.473 4.327 1
1 1130 . 15 1 1 A 97 97 GLU H H 97 8.500 8.322 0.178 1
1 1131 . 15 1 1 A 97 97 GLU HA H 97 3.760 4.052 -0.292 1
1 1136 . 15 1 1 A 97 97 GLU C C 97 179.100 178.834 0.266 1
1 1137 . 15 1 1 A 97 97 GLU CA C 97 59.900 58.941 0.959 1
1 1138 . 15 1 1 A 97 97 GLU CB C 97 28.700 29.016 -0.316 1
1 1140 . 15 1 1 A 97 97 GLU N N 97 119.000 117.362 1.638 1
1 1141 . 15 1 1 A 98 98 LEU H H 98 7.740 8.299 -0.559 1
1 1142 . 15 1 1 A 98 98 LEU HA H 98 4.110 4.042 0.068 1
1 1152 . 15 1 1 A 98 98 LEU C C 98 179.700 179.347 0.353 1
1 1153 . 15 1 1 A 98 98 LEU CA C 98 57.900 57.971 -0.071 1
1 1154 . 15 1 1 A 98 98 LEU CB C 98 41.800 41.833 -0.033 1
1 1158 . 15 1 1 A 98 98 LEU N N 98 119.200 121.849 -2.649 1
1 1159 . 15 1 1 A 99 99 SER H H 99 8.290 7.936 0.354 1
1 1160 . 15 1 1 A 99 99 SER HA H 99 4.220 4.196 0.024 1
1 1163 . 15 1 1 A 99 99 SER C C 99 176.600 176.679 -0.079 1
1 1164 . 15 1 1 A 99 99 SER CA C 99 62.400 62.395 0.005 1
1 1165 . 15 1 1 A 99 99 SER CB C 99 63.200 62.702 0.498 1
1 1166 . 15 1 1 A 99 99 SER N N 99 116.300 113.979 2.321 1
1 1167 . 15 1 1 A 100 100 LEU H H 100 8.490 8.250 0.240 1
1 1168 . 15 1 1 A 100 100 LEU HA H 100 3.960 3.963 -0.003 1
1 1178 . 15 1 1 A 100 100 LEU C C 100 179.300 179.408 -0.108 1
1 1179 . 15 1 1 A 100 100 LEU CA C 100 57.700 57.937 -0.237 1
1 1180 . 15 1 1 A 100 100 LEU CB C 100 41.300 41.167 0.133 1
1 1184 . 15 1 1 A 100 100 LEU N N 100 120.900 122.210 -1.310 1
1 1185 . 15 1 1 A 101 101 GLN H H 101 7.680 8.395 -0.715 1
1 1186 . 15 1 1 A 101 101 GLN HA H 101 4.100 3.979 0.121 1
1 1193 . 15 1 1 A 101 101 GLN C C 101 178.700 177.812 0.888 1
1 1194 . 15 1 1 A 101 101 GLN CA C 101 58.800 58.896 -0.096 1
1 1195 . 15 1 1 A 101 101 GLN CB C 101 27.900 27.972 -0.072 1
1 1197 . 15 1 1 A 101 101 GLN N N 101 119.100 118.036 1.064 1
1 1199 . 15 1 1 A 102 102 GLU H H 102 7.850 7.988 -0.138 1
1 1200 . 15 1 1 A 102 102 GLU HA H 102 4.050 4.107 -0.057 1
1 1205 . 15 1 1 A 102 102 GLU C C 102 179.100 178.915 0.185 1
1 1206 . 15 1 1 A 102 102 GLU CA C 102 58.400 59.208 -0.808 1
1 1207 . 15 1 1 A 102 102 GLU CB C 102 28.600 28.995 -0.395 1
1 1209 . 15 1 1 A 102 102 GLU N N 102 118.400 118.896 -0.496 1
1 1210 . 15 1 1 A 103 103 LEU H H 103 8.080 8.145 -0.065 1
1 1211 . 15 1 1 A 103 103 LEU HA H 103 4.020 3.981 0.039 1
1 1221 . 15 1 1 A 103 103 LEU C C 103 178.200 178.189 0.011 1
1 1222 . 15 1 1 A 103 103 LEU CA C 103 57.000 58.424 -1.424 1
1 1223 . 15 1 1 A 103 103 LEU CB C 103 41.900 41.657 0.243 1
1 1227 . 15 1 1 A 103 103 LEU N N 103 120.600 123.382 -2.782 1
1 1228 . 15 1 1 A 104 104 GLN H H 104 7.900 8.140 -0.240 1
1 1229 . 15 1 1 A 104 104 GLN HA H 104 4.090 4.057 0.033 1
1 1236 . 15 1 1 A 104 104 GLN C C 104 177.300 177.636 -0.336 1
1 1237 . 15 1 1 A 104 104 GLN CA C 104 58.100 58.350 -0.250 1
1 1238 . 15 1 1 A 104 104 GLN CB C 104 29.400 28.586 0.814 1
1 1240 . 15 1 1 A 104 104 GLN N N 104 117.700 116.879 0.821 1
1 1242 . 15 1 1 A 105 105 VAL H H 105 7.620 7.215 0.405 1
1 1243 . 15 1 1 A 105 105 VAL HA H 105 4.190 3.966 0.224 1
1 1251 . 15 1 1 A 105 105 VAL C C 105 176.800 176.463 0.337 1
1 1252 . 15 1 1 A 105 105 VAL CA C 105 62.600 64.491 -1.891 1
1 1253 . 15 1 1 A 105 105 VAL CB C 105 32.000 31.311 0.689 1
1 1256 . 15 1 1 A 105 105 VAL N N 105 114.900 116.575 -1.675 1
1 1257 . 15 1 1 A 106 106 SER H H 106 7.900 7.770 0.130 1
1 1258 . 15 1 1 A 106 106 SER HA H 106 4.460 4.650 -0.190 1
1 1261 . 15 1 1 A 106 106 SER C C 106 175.000 175.671 -0.671 1
1 1262 . 15 1 1 A 106 106 SER CA C 106 58.900 57.239 1.661 1
1 1263 . 15 1 1 A 106 106 SER CB C 106 63.900 63.278 0.622 1
1 1264 . 15 1 1 A 106 106 SER N N 106 116.900 117.539 -0.639 1
1 1265 . 15 1 1 A 107 107 SER H H 107 8.230 7.864 0.366 1
1 1266 . 15 1 1 A 107 107 SER HA H 107 4.390 4.177 0.213 1
1 1269 . 15 1 1 A 107 107 SER C C 107 174.600 175.188 -0.588 1
1 1270 . 15 1 1 A 107 107 SER CA C 107 58.400 60.953 -2.553 1
1 1271 . 15 1 1 A 107 107 SER CB C 107 63.600 63.109 0.491 1
1 1272 . 15 1 1 A 107 107 SER N N 107 117.500 115.917 1.583 1
1 1273 . 15 1 1 A 108 108 ALA H H 108 8.080 7.777 0.303 1
1 1274 . 15 1 1 A 108 108 ALA HA H 108 4.280 3.876 0.404 1
1 1278 . 15 1 1 A 108 108 ALA C C 108 177.500 176.861 0.639 1
1 1279 . 15 1 1 A 108 108 ALA CA C 108 52.700 54.980 -2.280 1
1 1280 . 15 1 1 A 108 108 ALA CB C 108 19.200 17.796 1.404 1
1 1281 . 15 1 1 A 108 108 ALA N N 108 124.900 120.190 4.710 1
1 1282 . 15 1 1 A 109 109 ALA H H 109 8.080 8.193 -0.113 1
1 1283 . 15 1 1 A 109 109 ALA HA H 109 4.280 4.205 0.075 1
1 1287 . 15 1 1 A 109 109 ALA C C 109 177.700 178.217 -0.517 1
1 1288 . 15 1 1 A 109 109 ALA CA C 109 52.400 52.429 -0.029 1
1 1289 . 15 1 1 A 109 109 ALA CB C 109 19.400 19.665 -0.265 1
1 1290 . 15 1 1 A 109 109 ALA N N 109 123.000 121.033 1.967 1
1 1291 . 15 1 1 A 110 110 ALA H H 110 8.300 8.528 -0.228 1
1 1292 . 15 1 1 A 110 110 ALA HA H 110 4.280 4.148 0.132 1
1 1296 . 15 1 1 A 110 110 ALA C C 110 178.200 178.378 -0.178 1
1 1297 . 15 1 1 A 110 110 ALA CA C 110 52.700 54.878 -2.178 1
1 1298 . 15 1 1 A 110 110 ALA CB C 110 19.200 19.634 -0.434 1
1 1299 . 15 1 1 A 110 110 ALA N N 110 123.200 123.282 -0.082 1
1 1300 . 15 1 1 A 111 111 GLY H H 111 8.300 7.426 0.874 1
1 1301 . 15 1 1 A 111 111 GLY HA2 H 111 3.930 4.146 -0.216 1
1 1302 . 15 1 1 A 111 111 GLY HA3 H 111 3.940 4.148 -0.208 1
1 1303 . 15 1 1 A 111 111 GLY C C 111 173.700 172.357 1.343 1
1 1304 . 15 1 1 A 111 111 GLY CA C 111 45.100 45.800 -0.700 1
1 1305 . 15 1 1 A 111 111 GLY N N 111 108.000 101.947 6.053 1
1 1306 . 15 1 1 A 112 112 VAL H H 112 7.930 8.640 -0.710 1
1 1307 . 15 1 1 A 112 112 VAL HA H 112 4.420 4.549 -0.129 1
1 1315 . 15 1 1 A 112 112 VAL CA C 112 60.000 58.683 1.317 1
1 1316 . 15 1 1 A 112 112 VAL CB C 112 32.200 34.555 -2.355 1
1 1319 . 15 1 1 A 112 112 VAL N N 112 120.400 123.178 -2.778 1
1 1320 . 15 1 1 A 113 113 PRO HA H 113 4.370 4.281 0.089 1
1 1327 . 15 1 1 A 113 113 PRO C C 113 177.300 177.566 -0.266 1
1 1328 . 15 1 1 A 113 113 PRO CA C 113 63.900 63.666 0.234 1
1 1329 . 15 1 1 A 113 113 PRO CB C 113 31.800 31.939 -0.139 1
1 1332 . 15 1 1 A 114 114 GLY H H 114 8.570 8.700 -0.130 1
1 1333 . 15 1 1 A 114 114 GLY HA2 H 114 3.880 3.918 -0.038 1
1 1334 . 15 1 1 A 114 114 GLY HA3 H 114 4.120 3.918 0.202 1
1 1335 . 15 1 1 A 114 114 GLY C C 114 174.900 175.170 -0.270 1
1 1336 . 15 1 1 A 114 114 GLY CA C 114 45.200 45.502 -0.302 1
1 1337 . 15 1 1 A 114 114 GLY N N 114 109.000 110.412 -1.412 1
1 1338 . 15 1 1 A 115 115 THR H H 115 7.900 7.861 0.039 1
1 1339 . 15 1 1 A 115 115 THR HA H 115 4.400 3.925 0.475 1
1 1344 . 15 1 1 A 115 115 THR C C 115 174.300 174.169 0.131 1
1 1345 . 15 1 1 A 115 115 THR CA C 115 61.700 65.105 -3.405 1
1 1346 . 15 1 1 A 115 115 THR CB C 115 69.700 69.085 0.615 1
1 1348 . 15 1 1 A 115 115 THR N N 115 111.400 116.469 -5.069 1
1 1349 . 15 1 1 A 116 116 ASN H H 116 8.450 8.053 0.397 1
1 1350 . 15 1 1 A 116 116 ASN HA H 116 4.970 4.980 -0.010 1
1 1355 . 15 1 1 A 116 116 ASN CA C 116 51.500 49.844 1.656 1
1 1356 . 15 1 1 A 116 116 ASN CB C 116 38.900 39.590 -0.690 1
1 1357 . 15 1 1 A 116 116 ASN N N 116 123.100 116.904 6.196 1
1 1359 . 15 1 1 A 117 117 PRO HA H 117 4.370 4.376 -0.006 1
1 1366 . 15 1 1 A 117 117 PRO C C 117 178.400 178.326 0.074 1
1 1367 . 15 1 1 A 117 117 PRO CA C 117 64.800 64.817 -0.017 1
1 1368 . 15 1 1 A 117 117 PRO CB C 117 32.100 32.027 0.073 1
1 1371 . 15 1 1 A 118 118 VAL H H 118 7.750 7.534 0.216 1
1 1372 . 15 1 1 A 118 118 VAL HA H 118 3.810 3.766 0.044 1
1 1380 . 15 1 1 A 118 118 VAL C C 118 178.300 178.179 0.121 1
1 1381 . 15 1 1 A 118 118 VAL CA C 118 65.200 65.483 -0.283 1
1 1382 . 15 1 1 A 118 118 VAL CB C 118 31.500 31.478 0.022 1
1 1385 . 15 1 1 A 118 118 VAL N N 118 118.300 116.300 2.000 1
1 1386 . 15 1 1 A 119 119 LEU H H 119 7.540 8.049 -0.509 1
1 1387 . 15 1 1 A 119 119 LEU HA H 119 4.030 3.851 0.179 1
1 1397 . 15 1 1 A 119 119 LEU C C 119 178.900 179.419 -0.519 1
1 1398 . 15 1 1 A 119 119 LEU CA C 119 57.800 58.030 -0.230 1
1 1399 . 15 1 1 A 119 119 LEU CB C 119 40.700 41.164 -0.464 1
1 1403 . 15 1 1 A 119 119 LEU N N 119 119.700 120.365 -0.665 1
1 1404 . 15 1 1 A 120 120 ASN H H 120 8.080 8.220 -0.140 1
1 1405 . 15 1 1 A 120 120 ASN HA H 120 4.420 4.506 -0.086 1
1 1410 . 15 1 1 A 120 120 ASN C C 120 178.100 178.469 -0.369 1
1 1411 . 15 1 1 A 120 120 ASN CA C 120 56.100 56.395 -0.295 1
1 1412 . 15 1 1 A 120 120 ASN CB C 120 37.800 37.782 0.018 1
1 1413 . 15 1 1 A 120 120 ASN N N 120 117.700 117.782 -0.082 1
1 1415 . 15 1 1 A 121 121 ASN H H 121 8.120 8.036 0.084 1
1 1416 . 15 1 1 A 121 121 ASN HA H 121 4.490 4.505 -0.015 1
1 1421 . 15 1 1 A 121 121 ASN C C 121 178.000 178.234 -0.234 1
1 1422 . 15 1 1 A 121 121 ASN CA C 121 56.100 56.458 -0.358 1
1 1423 . 15 1 1 A 121 121 ASN CB C 121 37.800 38.465 -0.665 1
1 1424 . 15 1 1 A 121 121 ASN N N 121 120.000 118.263 1.737 1
1 1426 . 15 1 1 A 122 122 LEU H H 122 8.180 8.297 -0.117 1
1 1427 . 15 1 1 A 122 122 LEU HA H 122 4.050 3.910 0.140 1
1 1437 . 15 1 1 A 122 122 LEU C C 122 173.800 178.881 -5.081 1
1 1438 . 15 1 1 A 122 122 LEU CA C 122 58.500 58.007 0.493 1
1 1439 . 15 1 1 A 122 122 LEU CB C 122 41.900 41.629 0.271 1
1 1443 . 15 1 1 A 122 122 LEU N N 122 122.600 120.446 2.154 1
1 1444 . 15 1 1 A 123 123 LEU H H 123 8.260 7.932 0.328 1
1 1445 . 15 1 1 A 123 123 LEU HA H 123 3.850 3.967 -0.117 1
1 1455 . 15 1 1 A 123 123 LEU C C 123 178.900 178.540 0.360 1
1 1456 . 15 1 1 A 123 123 LEU CA C 123 58.500 58.139 0.361 1
1 1457 . 15 1 1 A 123 123 LEU CB C 123 41.200 41.315 -0.115 1
1 1461 . 15 1 1 A 123 123 LEU N N 123 119.700 120.807 -1.107 1
1 1462 . 15 1 1 A 124 124 SER H H 124 7.950 8.054 -0.104 1
1 1463 . 15 1 1 A 124 124 SER HA H 124 4.240 4.091 0.149 1
1 1466 . 15 1 1 A 124 124 SER C C 124 177.500 177.218 0.282 1
1 1467 . 15 1 1 A 124 124 SER CA C 124 61.600 61.743 -0.143 1
1 1468 . 15 1 1 A 124 124 SER CB C 124 62.600 62.927 -0.327 1
1 1469 . 15 1 1 A 124 124 SER N N 124 113.400 114.016 -0.616 1
1 1470 . 15 1 1 A 125 125 CYS H H 125 8.040 8.446 -0.406 1
1 1471 . 15 1 1 A 125 125 CYS HA H 125 4.350 4.130 0.220 1
1 1474 . 15 1 1 A 125 125 CYS C C 125 176.800 177.117 -0.317 1
1 1475 . 15 1 1 A 125 125 CYS CA C 125 62.600 63.803 -1.203 1
1 1476 . 15 1 1 A 125 125 CYS CB C 125 27.100 26.522 0.578 1
1 1477 . 15 1 1 A 125 125 CYS N N 125 119.800 119.359 0.441 1
1 1478 . 15 1 1 A 126 126 VAL H H 126 8.290 8.526 -0.236 1
1 1479 . 15 1 1 A 126 126 VAL HA H 126 3.430 3.402 0.028 1
1 1487 . 15 1 1 A 126 126 VAL C C 126 177.800 177.760 0.040 1
1 1488 . 15 1 1 A 126 126 VAL CA C 126 67.100 66.861 0.239 1
1 1489 . 15 1 1 A 126 126 VAL CB C 126 31.400 31.522 -0.122 1
1 1492 . 15 1 1 A 126 126 VAL N N 126 121.900 120.557 1.343 1
1 1493 . 15 1 1 A 127 127 GLN H H 127 8.200 8.038 0.162 1
1 1494 . 15 1 1 A 127 127 GLN HA H 127 3.970 3.943 0.027 1
1 1501 . 15 1 1 A 127 127 GLN C C 127 178.200 178.545 -0.345 1
1 1502 . 15 1 1 A 127 127 GLN CA C 127 58.700 58.825 -0.125 1
1 1503 . 15 1 1 A 127 127 GLN CB C 127 27.800 28.247 -0.447 1
1 1505 . 15 1 1 A 127 127 GLN N N 127 119.700 117.914 1.786 1
1 1507 . 15 1 1 A 128 128 GLU H H 128 7.880 8.102 -0.222 1
1 1508 . 15 1 1 A 128 128 GLU HA H 128 4.200 4.040 0.160 1
1 1513 . 15 1 1 A 128 128 GLU C C 128 178.400 178.701 -0.301 1
1 1514 . 15 1 1 A 128 128 GLU CA C 128 59.000 59.092 -0.092 1
1 1515 . 15 1 1 A 128 128 GLU CB C 128 28.400 29.488 -1.088 1
1 1517 . 15 1 1 A 128 128 GLU N N 128 119.800 119.094 0.706 1
1 1518 . 15 1 1 A 129 129 ILE H H 129 8.000 8.326 -0.326 1
1 1519 . 15 1 1 A 129 129 ILE HA H 129 3.460 3.616 -0.156 1
1 1529 . 15 1 1 A 129 129 ILE C C 129 176.800 178.057 -1.257 1
1 1530 . 15 1 1 A 129 129 ILE CA C 129 66.100 65.495 0.605 1
1 1531 . 15 1 1 A 129 129 ILE CB C 129 38.200 37.475 0.725 1
1 1535 . 15 1 1 A 129 129 ILE N N 129 119.500 120.295 -0.795 1
1 1536 . 15 1 1 A 130 130 SER H H 130 8.040 8.272 -0.232 1
1 1537 . 15 1 1 A 130 130 SER HA H 130 3.780 4.093 -0.313 1
1 1540 . 15 1 1 A 130 130 SER C C 130 176.200 176.979 -0.779 1
1 1541 . 15 1 1 A 130 130 SER CA C 130 62.100 61.595 0.505 1
1 1542 . 15 1 1 A 130 130 SER CB C 130 62.600 62.778 -0.178 1
1 1543 . 15 1 1 A 130 130 SER N N 130 112.800 115.513 -2.713 1
1 1544 . 15 1 1 A 131 131 ASP H H 131 8.270 8.132 0.138 1
1 1545 . 15 1 1 A 131 131 ASP HA H 131 4.310 4.370 -0.060 1
1 1548 . 15 1 1 A 131 131 ASP C C 131 179.200 178.575 0.625 1
1 1549 . 15 1 1 A 131 131 ASP CA C 131 56.800 57.700 -0.900 1
1 1550 . 15 1 1 A 131 131 ASP CB C 131 40.900 41.424 -0.524 1
1 1551 . 15 1 1 A 131 131 ASP N N 131 119.600 121.038 -1.438 1
1 1552 . 15 1 1 A 132 132 VAL H H 132 8.470 8.263 0.207 1
1 1553 . 15 1 1 A 132 132 VAL HA H 132 3.520 3.730 -0.210 1
1 1561 . 15 1 1 A 132 132 VAL C C 132 178.700 178.624 0.076 1
1 1562 . 15 1 1 A 132 132 VAL CA C 132 66.500 66.267 0.233 1
1 1563 . 15 1 1 A 132 132 VAL CB C 132 31.500 31.866 -0.366 1
1 1566 . 15 1 1 A 132 132 VAL N N 132 118.100 119.338 -1.238 1
1 1567 . 15 1 1 A 133 133 VAL H H 133 8.140 8.249 -0.109 1
1 1568 . 15 1 1 A 133 133 VAL HA H 133 3.770 3.724 0.046 1
1 1576 . 15 1 1 A 133 133 VAL C C 133 176.500 177.199 -0.699 1
1 1577 . 15 1 1 A 133 133 VAL CA C 133 65.100 66.728 -1.628 1
1 1578 . 15 1 1 A 133 133 VAL CB C 133 31.600 31.374 0.226 1
1 1581 . 15 1 1 A 133 133 VAL N N 133 117.000 120.568 -3.568 1
1 1582 . 15 1 1 A 134 134 GLN H H 134 7.490 7.725 -0.235 1
1 1583 . 15 1 1 A 134 134 GLN HA H 134 4.350 4.307 0.043 1
1 1590 . 15 1 1 A 134 134 GLN C C 134 175.400 176.671 -1.271 1
1 1591 . 15 1 1 A 134 134 GLN CA C 134 56.700 56.982 -0.282 1
1 1592 . 15 1 1 A 134 134 GLN CB C 134 30.500 28.390 2.110 1
1 1594 . 15 1 1 A 134 134 GLN N N 134 116.300 118.996 -2.696 1
1 1 . 16 1 1 A 2 2 GLY HA2 H 2 3.890 4.007 -0.117 1
1 2 . 16 1 1 A 2 2 GLY HA3 H 2 3.890 4.119 -0.229 1
1 3 . 16 1 1 A 2 2 GLY C C 2 174.200 171.628 2.572 1
1 4 . 16 1 1 A 2 2 GLY CA C 2 44.700 45.886 -1.186 1
1 5 . 16 1 1 A 3 3 HIS H H 3 8.380 8.524 -0.144 1
1 6 . 16 1 1 A 3 3 HIS HA H 3 4.610 4.724 -0.114 1
1 9 . 16 1 1 A 3 3 HIS C C 3 174.500 175.071 -0.571 1
1 10 . 16 1 1 A 3 3 HIS CA C 3 55.200 56.138 -0.938 1
1 11 . 16 1 1 A 3 3 HIS CB C 3 28.800 28.843 -0.043 1
1 12 . 16 1 1 A 3 3 HIS N N 3 117.600 119.241 -1.641 1
1 13 . 16 1 1 A 4 4 HIS H H 4 8.520 8.121 0.399 1
1 14 . 16 1 1 A 4 4 HIS HA H 4 4.640 4.432 0.208 1
1 17 . 16 1 1 A 4 4 HIS C C 4 174.200 175.731 -1.531 1
1 18 . 16 1 1 A 4 4 HIS CA C 4 55.100 55.822 -0.722 1
1 19 . 16 1 1 A 4 4 HIS CB C 4 28.900 29.612 -0.712 1
1 20 . 16 1 1 A 4 4 HIS N N 4 119.000 123.105 -4.105 1
1 21 . 16 1 1 A 5 5 HIS H H 5 8.530 7.874 0.656 1
1 22 . 16 1 1 A 5 5 HIS HA H 5 4.410 5.019 -0.609 1
1 25 . 16 1 1 A 5 5 HIS CA C 5 54.900 55.154 -0.254 1
1 26 . 16 1 1 A 5 5 HIS CB C 5 27.300 31.579 -4.279 1
1 27 . 16 1 1 A 5 5 HIS N N 5 121.600 118.737 2.863 1
1 28 . 16 1 1 A 6 6 HIS HA H 6 4.640 4.421 0.219 1
1 31 . 16 1 1 A 6 6 HIS C C 6 174.100 175.509 -1.409 1
1 32 . 16 1 1 A 6 6 HIS CA C 6 55.100 55.277 -0.177 1
1 33 . 16 1 1 A 6 6 HIS CB C 6 29.100 28.802 0.298 1
1 34 . 16 1 1 A 7 7 HIS H H 7 8.690 8.419 0.271 1
1 35 . 16 1 1 A 7 7 HIS HA H 7 4.650 4.802 -0.152 1
1 38 . 16 1 1 A 7 7 HIS C C 7 174.200 175.006 -0.806 1
1 39 . 16 1 1 A 7 7 HIS CA C 7 55.200 55.175 0.025 1
1 40 . 16 1 1 A 7 7 HIS CB C 7 29.300 30.782 -1.482 1
1 41 . 16 1 1 A 7 7 HIS N N 7 121.400 117.301 4.099 1
1 42 . 16 1 1 A 8 8 HIS H H 8 8.660 8.058 0.602 1
1 43 . 16 1 1 A 8 8 HIS HA H 8 4.700 3.992 0.708 1
1 46 . 16 1 1 A 8 8 HIS C C 8 174.200 173.867 0.333 1
1 47 . 16 1 1 A 8 8 HIS CA C 8 55.000 56.687 -1.687 1
1 48 . 16 1 1 A 8 8 HIS CB C 8 29.300 28.376 0.924 1
1 49 . 16 1 1 A 8 8 HIS N N 8 120.400 118.047 2.353 1
1 50 . 16 1 1 A 9 9 SER H H 9 8.490 7.209 1.281 1
1 51 . 16 1 1 A 9 9 SER HA H 9 4.390 4.729 -0.339 1
1 54 . 16 1 1 A 9 9 SER C C 9 174.100 172.260 1.840 1
1 55 . 16 1 1 A 9 9 SER CA C 9 58.300 57.491 0.809 1
1 56 . 16 1 1 A 9 9 SER CB C 9 63.700 66.108 -2.408 1
1 57 . 16 1 1 A 9 9 SER N N 9 118.100 110.435 7.665 1
1 58 . 16 1 1 A 10 10 HIS H H 10 8.710 8.726 -0.016 1
1 59 . 16 1 1 A 10 10 HIS HA H 10 4.690 5.357 -0.667 1
1 63 . 16 1 1 A 10 10 HIS C C 10 174.200 174.092 0.108 1
1 64 . 16 1 1 A 10 10 HIS CA C 10 55.200 54.693 0.507 1
1 65 . 16 1 1 A 10 10 HIS CB C 10 28.800 33.432 -4.632 1
1 66 . 16 1 1 A 10 10 HIS N N 10 120.700 121.471 -0.771 1
1 67 . 16 1 1 A 11 11 MET H H 11 8.410 8.365 0.045 1
1 68 . 16 1 1 A 11 11 MET HA H 11 4.420 4.557 -0.137 1
1 76 . 16 1 1 A 11 11 MET C C 11 175.800 176.524 -0.724 1
1 77 . 16 1 1 A 11 11 MET CA C 11 55.100 54.685 0.415 1
1 78 . 16 1 1 A 11 11 MET CB C 11 32.800 31.959 0.841 1
1 81 . 16 1 1 A 11 11 MET N N 11 122.300 124.016 -1.716 1
1 82 . 16 1 1 A 12 12 ALA H H 12 8.440 8.665 -0.225 1
1 83 . 16 1 1 A 12 12 ALA HA H 12 4.280 4.807 -0.527 1
1 87 . 16 1 1 A 12 12 ALA C C 12 177.400 176.970 0.430 1
1 88 . 16 1 1 A 12 12 ALA CA C 12 52.400 50.920 1.480 1
1 89 . 16 1 1 A 12 12 ALA CB C 12 18.800 21.450 -2.650 1
1 90 . 16 1 1 A 12 12 ALA N N 12 125.900 127.039 -1.139 1
1 91 . 16 1 1 A 13 13 ASN H H 13 8.440 8.810 -0.370 1
1 92 . 16 1 1 A 13 13 ASN HA H 13 4.660 4.793 -0.133 1
1 97 . 16 1 1 A 13 13 ASN C C 13 175.900 176.244 -0.344 1
1 98 . 16 1 1 A 13 13 ASN CA C 13 53.200 52.954 0.246 1
1 99 . 16 1 1 A 13 13 ASN CB C 13 38.800 37.017 1.783 1
1 100 . 16 1 1 A 13 13 ASN N N 13 118.300 118.288 0.012 1
1 102 . 16 1 1 A 14 14 GLY H H 14 8.370 8.740 -0.370 1
1 103 . 16 1 1 A 14 14 GLY HA2 H 14 3.920 3.983 -0.063 1
1 104 . 16 1 1 A 14 14 GLY HA3 H 14 3.920 3.984 -0.064 1
1 105 . 16 1 1 A 14 14 GLY C C 14 174.000 174.355 -0.355 1
1 106 . 16 1 1 A 14 14 GLY CA C 14 45.200 45.580 -0.380 1
1 107 . 16 1 1 A 14 14 GLY N N 14 109.600 114.661 -5.061 1
1 108 . 16 1 1 A 15 15 ALA H H 15 8.140 7.993 0.147 1
1 109 . 16 1 1 A 15 15 ALA HA H 15 4.280 4.229 0.051 1
1 113 . 16 1 1 A 15 15 ALA C C 15 177.300 177.343 -0.043 1
1 114 . 16 1 1 A 15 15 ALA CA C 15 52.500 52.014 0.486 1
1 115 . 16 1 1 A 15 15 ALA CB C 15 19.100 18.786 0.314 1
1 116 . 16 1 1 A 15 15 ALA N N 15 123.800 124.669 -0.869 1
1 117 . 16 1 1 A 16 16 ALA H H 16 8.030 8.140 -0.110 1
1 118 . 16 1 1 A 16 16 ALA HA H 16 4.280 4.513 -0.233 1
1 122 . 16 1 1 A 16 16 ALA C C 16 178.400 177.816 0.584 1
1 123 . 16 1 1 A 16 16 ALA CA C 16 52.600 51.115 1.485 1
1 124 . 16 1 1 A 16 16 ALA CB C 16 19.100 17.559 1.541 1
1 125 . 16 1 1 A 16 16 ALA N N 16 122.300 127.579 -5.279 1
1 126 . 16 1 1 A 17 17 GLY H H 17 8.320 8.078 0.242 1
1 127 . 16 1 1 A 17 17 GLY HA2 H 17 3.960 3.949 0.011 1
1 128 . 16 1 1 A 17 17 GLY HA3 H 17 3.960 3.952 0.008 1
1 129 . 16 1 1 A 17 17 GLY C C 17 174.500 175.090 -0.590 1
1 130 . 16 1 1 A 17 17 GLY CA C 17 45.200 46.869 -1.669 1
1 131 . 16 1 1 A 17 17 GLY N N 17 107.800 109.216 -1.416 1
1 132 . 16 1 1 A 18 18 THR H H 18 7.970 8.101 -0.131 1
1 133 . 16 1 1 A 18 18 THR HA H 18 4.290 3.924 0.366 1
1 138 . 16 1 1 A 18 18 THR C C 18 174.600 176.791 -2.191 1
1 139 . 16 1 1 A 18 18 THR CA C 18 62.000 66.419 -4.419 1
1 140 . 16 1 1 A 18 18 THR CB C 18 69.700 68.472 1.228 1
1 142 . 16 1 1 A 18 18 THR N N 18 113.800 114.531 -0.731 1
1 143 . 16 1 1 A 19 19 LYS H H 19 8.350 8.493 -0.143 1
1 144 . 16 1 1 A 19 19 LYS HA H 19 4.270 4.127 0.143 1
1 153 . 16 1 1 A 19 19 LYS C C 19 176.600 177.340 -0.740 1
1 154 . 16 1 1 A 19 19 LYS CA C 19 56.500 58.789 -2.289 1
1 155 . 16 1 1 A 19 19 LYS CB C 19 32.800 32.185 0.615 1
1 159 . 16 1 1 A 19 19 LYS N N 19 124.000 119.483 4.517 1
1 160 . 16 1 1 A 20 20 VAL H H 20 8.060 7.757 0.303 1
1 161 . 16 1 1 A 20 20 VAL HA H 20 3.990 4.379 -0.389 1
1 169 . 16 1 1 A 20 20 VAL C C 20 175.900 176.395 -0.495 1
1 170 . 16 1 1 A 20 20 VAL CA C 20 62.400 62.229 0.171 1
1 171 . 16 1 1 A 20 20 VAL CB C 20 32.600 31.882 0.718 1
1 174 . 16 1 1 A 20 20 VAL N N 20 121.700 118.771 2.929 1
1 175 . 16 1 1 A 21 21 ALA H H 21 8.310 7.988 0.322 1
1 176 . 16 1 1 A 21 21 ALA HA H 21 4.290 4.062 0.228 1
1 180 . 16 1 1 A 21 21 ALA C C 21 177.600 178.526 -0.926 1
1 181 . 16 1 1 A 21 21 ALA CA C 21 52.400 55.129 -2.729 1
1 182 . 16 1 1 A 21 21 ALA CB C 21 19.000 18.995 0.005 1
1 183 . 16 1 1 A 21 21 ALA N N 21 127.700 125.846 1.854 1
1 184 . 16 1 1 A 22 22 LEU H H 22 8.150 7.623 0.527 1
1 185 . 16 1 1 A 22 22 LEU HA H 22 4.280 4.409 -0.129 1
1 195 . 16 1 1 A 22 22 LEU C C 22 177.400 176.107 1.293 1
1 196 . 16 1 1 A 22 22 LEU CA C 22 55.200 54.350 0.850 1
1 197 . 16 1 1 A 22 22 LEU CB C 22 42.200 41.854 0.346 1
1 201 . 16 1 1 A 22 22 LEU N N 22 121.800 115.129 6.671 1
1 202 . 16 1 1 A 23 23 ARG H H 23 8.240 8.033 0.207 1
1 203 . 16 1 1 A 23 23 ARG HA H 23 4.290 3.991 0.299 1
1 211 . 16 1 1 A 23 23 ARG C C 23 176.300 176.008 0.292 1
1 212 . 16 1 1 A 23 23 ARG CA C 23 56.000 57.237 -1.237 1
1 213 . 16 1 1 A 23 23 ARG CB C 23 30.600 27.141 3.459 1
1 216 . 16 1 1 A 23 23 ARG N N 23 122.000 115.719 6.281 1
1 218 . 16 1 1 A 24 24 LYS H H 24 8.370 8.079 0.291 1
1 219 . 16 1 1 A 24 24 LYS HA H 24 4.330 4.332 -0.002 1
1 228 . 16 1 1 A 24 24 LYS C C 24 176.800 176.643 0.157 1
1 229 . 16 1 1 A 24 24 LYS CA C 24 56.400 57.362 -0.962 1
1 230 . 16 1 1 A 24 24 LYS CB C 24 32.700 33.005 -0.305 1
1 234 . 16 1 1 A 24 24 LYS N N 24 122.900 117.216 5.684 1
1 235 . 16 1 1 A 25 25 THR H H 25 8.100 7.354 0.746 1
1 236 . 16 1 1 A 25 25 THR HA H 25 4.290 4.773 -0.483 1
1 241 . 16 1 1 A 25 25 THR C C 25 174.600 173.910 0.690 1
1 242 . 16 1 1 A 25 25 THR CA C 25 61.500 60.627 0.873 1
1 243 . 16 1 1 A 25 25 THR CB C 25 69.800 70.526 -0.726 1
1 245 . 16 1 1 A 25 25 THR N N 25 115.500 109.640 5.860 1
1 246 . 16 1 1 A 26 26 LYS H H 26 8.370 8.958 -0.588 1
1 247 . 16 1 1 A 26 26 LYS HA H 26 4.270 4.566 -0.296 1
1 256 . 16 1 1 A 26 26 LYS C C 26 176.600 176.655 -0.055 1
1 257 . 16 1 1 A 26 26 LYS CA C 26 56.600 55.036 1.564 1
1 258 . 16 1 1 A 26 26 LYS CB C 26 32.700 34.260 -1.560 1
1 262 . 16 1 1 A 26 26 LYS N N 26 123.700 125.600 -1.900 1
1 263 . 16 1 1 A 27 27 GLN H H 27 8.390 8.739 -0.349 1
1 264 . 16 1 1 A 27 27 GLN HA H 27 4.240 4.635 -0.395 1
1 271 . 16 1 1 A 27 27 GLN C C 27 175.900 176.010 -0.110 1
1 272 . 16 1 1 A 27 27 GLN CA C 27 56.100 56.065 0.035 1
1 273 . 16 1 1 A 27 27 GLN CB C 27 29.300 30.762 -1.462 1
1 275 . 16 1 1 A 27 27 GLN N N 27 121.700 118.162 3.538 1
1 277 . 16 1 1 A 28 28 ALA H H 28 8.330 7.769 0.561 1
1 278 . 16 1 1 A 28 28 ALA HA H 28 4.240 4.522 -0.282 1
1 282 . 16 1 1 A 28 28 ALA C C 28 177.700 177.313 0.387 1
1 283 . 16 1 1 A 28 28 ALA CA C 28 52.500 51.620 0.880 1
1 284 . 16 1 1 A 28 28 ALA CB C 28 19.100 22.621 -3.521 1
1 285 . 16 1 1 A 28 28 ALA N N 28 125.400 119.800 5.600 1
1 286 . 16 1 1 A 29 29 ALA H H 29 8.250 8.991 -0.741 1
1 287 . 16 1 1 A 29 29 ALA HA H 29 4.230 3.945 0.285 1
1 291 . 16 1 1 A 29 29 ALA C C 29 178.000 179.544 -1.544 1
1 292 . 16 1 1 A 29 29 ALA CA C 29 52.500 55.251 -2.751 1
1 293 . 16 1 1 A 29 29 ALA CB C 29 19.100 18.381 0.719 1
1 294 . 16 1 1 A 29 29 ALA N N 29 123.000 125.024 -2.024 1
1 295 . 16 1 1 A 30 30 GLU H H 30 8.260 8.213 0.047 1
1 296 . 16 1 1 A 30 30 GLU HA H 30 4.220 4.129 0.091 1
1 301 . 16 1 1 A 30 30 GLU C C 30 176.500 177.082 -0.582 1
1 302 . 16 1 1 A 30 30 GLU CA C 30 56.400 58.965 -2.565 1
1 303 . 16 1 1 A 30 30 GLU CB C 30 29.500 29.359 0.141 1
1 305 . 16 1 1 A 30 30 GLU N N 30 119.700 118.001 1.699 1
1 306 . 16 1 1 A 31 31 LYS H H 31 8.230 8.182 0.048 1
1 307 . 16 1 1 A 31 31 LYS HA H 31 4.280 4.552 -0.272 1
1 316 . 16 1 1 A 31 31 LYS C C 31 176.500 176.557 -0.057 1
1 317 . 16 1 1 A 31 31 LYS CA C 31 56.400 56.200 0.200 1
1 318 . 16 1 1 A 31 31 LYS CB C 31 32.800 34.761 -1.961 1
1 322 . 16 1 1 A 31 31 LYS N N 31 122.700 118.795 3.905 1
1 323 . 16 1 1 A 32 32 ILE H H 32 8.140 7.498 0.642 1
1 324 . 16 1 1 A 32 32 ILE HA H 32 4.110 4.256 -0.146 1
1 334 . 16 1 1 A 32 32 ILE C C 32 176.400 176.496 -0.096 1
1 335 . 16 1 1 A 32 32 ILE CA C 32 61.200 61.621 -0.421 1
1 336 . 16 1 1 A 32 32 ILE CB C 32 38.600 36.861 1.739 1
1 340 . 16 1 1 A 32 32 ILE N N 32 122.300 121.815 0.485 1
1 341 . 16 1 1 A 33 33 SER H H 33 8.230 8.485 -0.255 1
1 342 . 16 1 1 A 33 33 SER HA H 33 4.400 4.143 0.257 1
1 345 . 16 1 1 A 33 33 SER C C 33 174.800 176.704 -1.904 1
1 346 . 16 1 1 A 33 33 SER CA C 33 58.300 61.132 -2.832 1
1 347 . 16 1 1 A 33 33 SER CB C 33 63.700 62.845 0.855 1
1 348 . 16 1 1 A 33 33 SER N N 33 119.600 123.595 -3.995 1
1 349 . 16 1 1 A 34 34 ALA H H 34 8.430 8.349 0.081 1
1 350 . 16 1 1 A 34 34 ALA HA H 34 4.220 4.003 0.217 1
1 354 . 16 1 1 A 34 34 ALA C C 34 179.500 178.994 0.506 1
1 355 . 16 1 1 A 34 34 ALA CA C 34 53.500 55.304 -1.804 1
1 356 . 16 1 1 A 34 34 ALA CB C 34 18.800 18.474 0.326 1
1 357 . 16 1 1 A 34 34 ALA N N 34 126.000 123.036 2.964 1
1 358 . 16 1 1 A 35 35 ASP H H 35 8.380 8.331 0.049 1
1 359 . 16 1 1 A 35 35 ASP HA H 35 4.520 4.400 0.120 1
1 362 . 16 1 1 A 35 35 ASP C C 35 176.500 178.554 -2.054 1
1 363 . 16 1 1 A 35 35 ASP CA C 35 54.800 57.094 -2.294 1
1 364 . 16 1 1 A 35 35 ASP CB C 35 40.200 41.608 -1.408 1
1 365 . 16 1 1 A 35 35 ASP N N 35 118.200 118.450 -0.250 1
1 366 . 16 1 1 A 36 36 LYS H H 36 8.000 8.162 -0.162 1
1 367 . 16 1 1 A 36 36 LYS HA H 36 4.270 4.042 0.228 1
1 376 . 16 1 1 A 36 36 LYS C C 36 177.000 177.446 -0.446 1
1 377 . 16 1 1 A 36 36 LYS CA C 36 56.800 58.499 -1.699 1
1 378 . 16 1 1 A 36 36 LYS CB C 36 32.900 31.972 0.928 1
1 382 . 16 1 1 A 36 36 LYS N N 36 120.900 118.336 2.564 1
1 383 . 16 1 1 A 37 37 ILE H H 37 7.970 7.261 0.709 1
1 384 . 16 1 1 A 37 37 ILE HA H 37 4.020 3.935 0.085 1
1 394 . 16 1 1 A 37 37 ILE C C 37 176.100 175.319 0.781 1
1 395 . 16 1 1 A 37 37 ILE CA C 37 61.300 62.284 -0.984 1
1 396 . 16 1 1 A 37 37 ILE CB C 37 38.100 37.942 0.158 1
1 400 . 16 1 1 A 37 37 ILE N N 37 121.800 121.320 0.480 1
1 401 . 16 1 1 A 38 38 SER H H 38 7.980 8.836 -0.856 1
1 402 . 16 1 1 A 38 38 SER HA H 38 4.540 4.660 -0.120 1
1 405 . 16 1 1 A 38 38 SER C C 38 174.700 175.506 -0.806 1
1 406 . 16 1 1 A 38 38 SER CA C 38 58.200 57.697 0.503 1
1 407 . 16 1 1 A 38 38 SER CB C 38 64.400 64.538 -0.138 1
1 408 . 16 1 1 A 38 38 SER N N 38 119.000 123.832 -4.832 1
1 409 . 16 1 1 A 39 39 LYS H H 39 8.690 9.058 -0.368 1
1 410 . 16 1 1 A 39 39 LYS HA H 39 3.400 3.450 -0.050 1
1 419 . 16 1 1 A 39 39 LYS C C 39 177.400 178.015 -0.615 1
1 420 . 16 1 1 A 39 39 LYS CA C 39 59.800 60.300 -0.500 1
1 421 . 16 1 1 A 39 39 LYS CB C 39 32.400 32.424 -0.024 1
1 425 . 16 1 1 A 39 39 LYS N N 39 124.200 124.619 -0.419 1
1 426 . 16 1 1 A 40 40 GLU H H 40 8.280 8.403 -0.123 1
1 427 . 16 1 1 A 40 40 GLU HA H 40 3.840 4.013 -0.173 1
1 432 . 16 1 1 A 40 40 GLU C C 40 178.400 178.722 -0.322 1
1 433 . 16 1 1 A 40 40 GLU CA C 40 59.400 59.275 0.125 1
1 434 . 16 1 1 A 40 40 GLU CB C 40 28.300 28.598 -0.298 1
1 436 . 16 1 1 A 40 40 GLU N N 40 116.300 117.396 -1.096 1
1 437 . 16 1 1 A 41 41 ALA H H 41 7.890 8.130 -0.240 1
1 438 . 16 1 1 A 41 41 ALA HA H 41 3.910 4.139 -0.229 1
1 442 . 16 1 1 A 41 41 ALA C C 41 179.900 180.030 -0.130 1
1 443 . 16 1 1 A 41 41 ALA CA C 41 54.700 55.245 -0.545 1
1 444 . 16 1 1 A 41 41 ALA CB C 41 17.900 18.166 -0.266 1
1 445 . 16 1 1 A 41 41 ALA N N 41 122.300 123.184 -0.884 1
1 446 . 16 1 1 A 42 42 LEU H H 42 7.490 7.746 -0.256 1
1 447 . 16 1 1 A 42 42 LEU HA H 42 3.480 3.920 -0.440 1
1 457 . 16 1 1 A 42 42 LEU C C 42 178.900 178.626 0.274 1
1 458 . 16 1 1 A 42 42 LEU CA C 42 59.800 57.736 2.064 1
1 459 . 16 1 1 A 42 42 LEU CB C 42 42.300 41.397 0.903 1
1 463 . 16 1 1 A 42 42 LEU N N 42 121.000 119.263 1.737 1
1 464 . 16 1 1 A 43 43 LEU H H 43 8.290 7.970 0.320 1
1 465 . 16 1 1 A 43 43 LEU HA H 43 3.780 3.792 -0.012 1
1 475 . 16 1 1 A 43 43 LEU C C 43 179.400 179.438 -0.038 1
1 476 . 16 1 1 A 43 43 LEU CA C 43 57.600 58.148 -0.548 1
1 477 . 16 1 1 A 43 43 LEU CB C 43 40.900 41.591 -0.691 1
1 481 . 16 1 1 A 43 43 LEU N N 43 119.200 118.446 0.754 1
1 482 . 16 1 1 A 44 44 GLU H H 44 8.330 8.111 0.219 1
1 483 . 16 1 1 A 44 44 GLU HA H 44 4.050 3.944 0.106 1
1 488 . 16 1 1 A 44 44 GLU C C 44 178.600 179.291 -0.691 1
1 489 . 16 1 1 A 44 44 GLU CA C 44 58.900 59.472 -0.572 1
1 490 . 16 1 1 A 44 44 GLU CB C 44 28.300 29.306 -1.006 1
1 492 . 16 1 1 A 44 44 GLU N N 44 119.600 117.093 2.507 1
1 493 . 16 1 1 A 45 45 CYS H H 45 7.690 7.887 -0.197 1
1 494 . 16 1 1 A 45 45 CYS HA H 45 4.120 4.003 0.117 1
1 497 . 16 1 1 A 45 45 CYS C C 45 176.100 176.917 -0.817 1
1 498 . 16 1 1 A 45 45 CYS CA C 45 62.500 62.837 -0.337 1
1 499 . 16 1 1 A 45 45 CYS CB C 45 26.200 26.067 0.133 1
1 500 . 16 1 1 A 45 45 CYS N N 45 120.900 118.846 2.054 1
1 501 . 16 1 1 A 46 46 ALA H H 46 8.540 7.668 0.872 1
1 502 . 16 1 1 A 46 46 ALA HA H 46 3.900 4.020 -0.120 1
1 506 . 16 1 1 A 46 46 ALA C C 46 179.200 179.391 -0.191 1
1 507 . 16 1 1 A 46 46 ALA CA C 46 55.500 55.167 0.333 1
1 508 . 16 1 1 A 46 46 ALA CB C 46 16.800 18.529 -1.729 1
1 509 . 16 1 1 A 46 46 ALA N N 46 121.500 121.958 -0.458 1
1 510 . 16 1 1 A 47 47 ASP H H 47 8.460 8.315 0.145 1
1 511 . 16 1 1 A 47 47 ASP HA H 47 4.340 4.315 0.025 1
1 514 . 16 1 1 A 47 47 ASP C C 47 178.800 178.638 0.162 1
1 515 . 16 1 1 A 47 47 ASP CA C 47 56.600 57.541 -0.941 1
1 516 . 16 1 1 A 47 47 ASP CB C 47 39.800 42.147 -2.347 1
1 517 . 16 1 1 A 47 47 ASP N N 47 119.000 118.262 0.738 1
1 518 . 16 1 1 A 48 48 LEU H H 48 8.040 8.024 0.016 1
1 519 . 16 1 1 A 48 48 LEU HA H 48 4.110 3.900 0.210 1
1 529 . 16 1 1 A 48 48 LEU C C 48 180.000 178.889 1.111 1
1 530 . 16 1 1 A 48 48 LEU CA C 48 58.000 57.920 0.080 1
1 531 . 16 1 1 A 48 48 LEU CB C 48 41.700 41.747 -0.047 1
1 535 . 16 1 1 A 48 48 LEU N N 48 123.000 120.158 2.842 1
1 536 . 16 1 1 A 49 49 LEU H H 49 8.300 8.111 0.189 1
1 537 . 16 1 1 A 49 49 LEU HA H 49 4.110 3.885 0.225 1
1 547 . 16 1 1 A 49 49 LEU C C 49 177.200 179.030 -1.830 1
1 548 . 16 1 1 A 49 49 LEU CA C 49 57.600 57.836 -0.236 1
1 549 . 16 1 1 A 49 49 LEU CB C 49 41.200 41.444 -0.244 1
1 553 . 16 1 1 A 49 49 LEU N N 49 120.900 118.453 2.447 1
1 554 . 16 1 1 A 50 50 SER H H 50 8.660 8.010 0.650 1
1 555 . 16 1 1 A 50 50 SER HA H 50 4.000 4.058 -0.058 1
1 558 . 16 1 1 A 50 50 SER C C 50 176.800 177.198 -0.398 1
1 559 . 16 1 1 A 50 50 SER CA C 50 62.500 61.624 0.876 1
1 560 . 16 1 1 A 50 50 SER CB C 50 62.600 62.980 -0.380 1
1 561 . 16 1 1 A 50 50 SER N N 50 113.300 114.636 -1.336 1
1 562 . 16 1 1 A 51 51 SER H H 51 7.980 7.826 0.154 1
1 563 . 16 1 1 A 51 51 SER HA H 51 4.220 4.172 0.048 1
1 566 . 16 1 1 A 51 51 SER C C 51 176.300 176.919 -0.619 1
1 567 . 16 1 1 A 51 51 SER CA C 51 61.200 61.529 -0.329 1
1 568 . 16 1 1 A 51 51 SER CB C 51 62.700 62.621 0.079 1
1 569 . 16 1 1 A 51 51 SER N N 51 115.900 115.508 0.392 1
1 570 . 16 1 1 A 52 52 ALA H H 52 8.030 8.285 -0.255 1
1 571 . 16 1 1 A 52 52 ALA HA H 52 4.130 4.191 -0.061 1
1 575 . 16 1 1 A 52 52 ALA C C 52 178.500 180.360 -1.860 1
1 576 . 16 1 1 A 52 52 ALA CA C 52 54.500 54.992 -0.492 1
1 577 . 16 1 1 A 52 52 ALA CB C 52 18.000 18.307 -0.307 1
1 578 . 16 1 1 A 52 52 ALA N N 52 125.400 123.056 2.344 1
1 579 . 16 1 1 A 53 53 LEU H H 53 7.710 8.325 -0.615 1
1 580 . 16 1 1 A 53 53 LEU HA H 53 4.180 4.074 0.106 1
1 590 . 16 1 1 A 53 53 LEU C C 53 177.700 178.393 -0.693 1
1 591 . 16 1 1 A 53 53 LEU CA C 53 56.500 57.481 -0.981 1
1 592 . 16 1 1 A 53 53 LEU CB C 53 42.400 41.708 0.692 1
1 596 . 16 1 1 A 53 53 LEU N N 53 113.800 119.638 -5.838 1
1 597 . 16 1 1 A 54 54 THR H H 54 7.550 7.375 0.175 1
1 598 . 16 1 1 A 54 54 THR HA H 54 4.420 4.310 0.110 1
1 603 . 16 1 1 A 54 54 THR C C 54 174.100 174.827 -0.727 1
1 604 . 16 1 1 A 54 54 THR CA C 54 61.600 63.570 -1.970 1
1 605 . 16 1 1 A 54 54 THR CB C 54 69.300 69.168 0.132 1
1 607 . 16 1 1 A 54 54 THR N N 54 107.700 108.088 -0.388 1
1 608 . 16 1 1 A 55 55 GLU H H 55 7.750 7.234 0.516 1
1 609 . 16 1 1 A 55 55 GLU HA H 55 4.760 4.682 0.078 1
1 614 . 16 1 1 A 55 55 GLU CA C 55 53.400 54.184 -0.784 1
1 615 . 16 1 1 A 55 55 GLU CB C 55 30.100 30.753 -0.653 1
1 617 . 16 1 1 A 55 55 GLU N N 55 122.800 120.491 2.309 1
1 618 . 16 1 1 A 56 56 PRO HA H 56 4.670 4.703 -0.033 1
1 625 . 16 1 1 A 56 56 PRO C C 56 176.200 176.446 -0.246 1
1 626 . 16 1 1 A 56 56 PRO CA C 56 62.900 62.986 -0.086 1
1 627 . 16 1 1 A 56 56 PRO CB C 56 29.200 31.707 -2.507 1
1 630 . 16 1 1 A 57 57 VAL H H 57 8.010 8.369 -0.359 1
1 631 . 16 1 1 A 57 57 VAL HA H 57 4.590 4.948 -0.358 1
1 639 . 16 1 1 A 57 57 VAL CA C 57 58.600 58.304 0.296 1
1 640 . 16 1 1 A 57 57 VAL CB C 57 32.800 34.967 -2.167 1
1 643 . 16 1 1 A 57 57 VAL N N 57 121.400 117.393 4.007 1
1 644 . 16 1 1 A 58 58 PRO HA H 58 4.450 4.948 -0.498 1
1 651 . 16 1 1 A 58 58 PRO C C 58 177.500 177.835 -0.335 1
1 652 . 16 1 1 A 58 58 PRO CA C 58 62.600 62.778 -0.178 1
1 653 . 16 1 1 A 58 58 PRO CB C 58 32.200 32.096 0.104 1
1 656 . 16 1 1 A 59 59 ASN H H 59 8.890 8.882 0.008 1
1 657 . 16 1 1 A 59 59 ASN HA H 59 4.330 4.400 -0.070 1
1 662 . 16 1 1 A 59 59 ASN C C 59 177.600 177.520 0.080 1
1 663 . 16 1 1 A 59 59 ASN CA C 59 56.300 56.520 -0.220 1
1 664 . 16 1 1 A 59 59 ASN CB C 59 38.400 38.373 0.027 1
1 665 . 16 1 1 A 59 59 ASN N N 59 122.200 121.833 0.367 1
1 667 . 16 1 1 A 60 60 SER H H 60 8.660 8.121 0.539 1
1 668 . 16 1 1 A 60 60 SER HA H 60 4.010 4.049 -0.039 1
1 671 . 16 1 1 A 60 60 SER C C 60 176.200 177.480 -1.280 1
1 672 . 16 1 1 A 60 60 SER CA C 60 60.800 61.527 -0.727 1
1 673 . 16 1 1 A 60 60 SER CB C 60 61.500 62.949 -1.449 1
1 674 . 16 1 1 A 60 60 SER N N 60 113.200 115.185 -1.985 1
1 675 . 16 1 1 A 61 61 GLN H H 61 7.420 7.709 -0.289 1
1 676 . 16 1 1 A 61 61 GLN HA H 61 4.280 4.030 0.250 1
1 683 . 16 1 1 A 61 61 GLN C C 61 178.600 178.439 0.161 1
1 684 . 16 1 1 A 61 61 GLN CA C 61 57.900 58.795 -0.895 1
1 685 . 16 1 1 A 61 61 GLN CB C 61 28.600 28.223 0.377 1
1 687 . 16 1 1 A 61 61 GLN N N 61 122.200 120.507 1.693 1
1 689 . 16 1 1 A 62 62 LEU H H 62 7.430 7.807 -0.377 1
1 690 . 16 1 1 A 62 62 LEU HA H 62 3.850 4.073 -0.223 1
1 700 . 16 1 1 A 62 62 LEU C C 62 178.800 179.181 -0.381 1
1 701 . 16 1 1 A 62 62 LEU CA C 62 57.900 58.082 -0.182 1
1 702 . 16 1 1 A 62 62 LEU CB C 62 42.100 42.143 -0.043 1
1 706 . 16 1 1 A 62 62 LEU N N 62 120.600 119.722 0.878 1
1 707 . 16 1 1 A 63 63 VAL H H 63 8.200 8.318 -0.118 1
1 708 . 16 1 1 A 63 63 VAL HA H 63 3.370 3.509 -0.139 1
1 716 . 16 1 1 A 63 63 VAL C C 63 178.000 177.821 0.179 1
1 717 . 16 1 1 A 63 63 VAL CA C 63 66.600 66.991 -0.391 1
1 718 . 16 1 1 A 63 63 VAL CB C 63 31.700 31.360 0.340 1
1 721 . 16 1 1 A 63 63 VAL N N 63 118.200 117.936 0.264 1
1 722 . 16 1 1 A 64 64 ASP H H 64 7.960 8.455 -0.495 1
1 723 . 16 1 1 A 64 64 ASP HA H 64 4.460 4.328 0.132 1
1 726 . 16 1 1 A 64 64 ASP C C 64 178.100 178.600 -0.500 1
1 727 . 16 1 1 A 64 64 ASP CA C 64 57.700 57.522 0.178 1
1 728 . 16 1 1 A 64 64 ASP CB C 64 39.800 41.304 -1.504 1
1 729 . 16 1 1 A 64 64 ASP N N 64 120.200 120.263 -0.063 1
1 730 . 16 1 1 A 65 65 THR H H 65 8.380 8.512 -0.132 1
1 731 . 16 1 1 A 65 65 THR HA H 65 3.970 4.010 -0.040 1
1 736 . 16 1 1 A 65 65 THR C C 65 176.500 177.327 -0.827 1
1 737 . 16 1 1 A 65 65 THR CA C 65 66.500 66.801 -0.301 1
1 738 . 16 1 1 A 65 65 THR CB C 65 67.800 67.843 -0.043 1
1 740 . 16 1 1 A 65 65 THR N N 65 118.100 115.530 2.570 1
1 741 . 16 1 1 A 66 66 GLY H H 66 8.900 8.511 0.389 1
1 742 . 16 1 1 A 66 66 GLY HA2 H 66 3.630 3.751 -0.121 1
1 743 . 16 1 1 A 66 66 GLY HA3 H 66 3.630 3.771 -0.141 1
1 744 . 16 1 1 A 66 66 GLY C C 66 174.200 175.730 -1.530 1
1 745 . 16 1 1 A 66 66 GLY CA C 66 47.500 46.924 0.576 1
1 746 . 16 1 1 A 66 66 GLY N N 66 110.500 107.900 2.600 1
1 747 . 16 1 1 A 67 67 HIS H H 67 8.650 8.318 0.332 1
1 748 . 16 1 1 A 67 67 HIS HA H 67 4.220 4.140 0.080 1
1 752 . 16 1 1 A 67 67 HIS C C 67 176.900 177.505 -0.605 1
1 753 . 16 1 1 A 67 67 HIS CA C 67 59.000 59.268 -0.268 1
1 754 . 16 1 1 A 67 67 HIS CB C 67 27.800 29.494 -1.694 1
1 756 . 16 1 1 A 67 67 HIS N N 67 120.100 122.174 -2.074 1
1 757 . 16 1 1 A 68 68 GLN H H 68 7.860 8.337 -0.477 1
1 758 . 16 1 1 A 68 68 GLN HA H 68 3.990 3.999 -0.009 1
1 765 . 16 1 1 A 68 68 GLN C C 68 177.800 178.284 -0.484 1
1 766 . 16 1 1 A 68 68 GLN CA C 68 58.800 58.579 0.221 1
1 767 . 16 1 1 A 68 68 GLN CB C 68 28.200 27.695 0.505 1
1 769 . 16 1 1 A 68 68 GLN N N 68 121.400 116.812 4.588 1
1 771 . 16 1 1 A 69 69 LEU H H 69 8.300 7.674 0.626 1
1 772 . 16 1 1 A 69 69 LEU HA H 69 4.330 3.903 0.427 1
1 782 . 16 1 1 A 69 69 LEU C C 69 179.300 179.384 -0.084 1
1 783 . 16 1 1 A 69 69 LEU CA C 69 58.200 58.084 0.116 1
1 784 . 16 1 1 A 69 69 LEU CB C 69 40.500 41.406 -0.906 1
1 788 . 16 1 1 A 69 69 LEU N N 69 120.300 121.728 -1.428 1
1 789 . 16 1 1 A 70 70 LEU H H 70 8.460 7.790 0.670 1
1 790 . 16 1 1 A 70 70 LEU HA H 70 3.880 3.936 -0.056 1
1 800 . 16 1 1 A 70 70 LEU C C 70 179.100 179.206 -0.106 1
1 801 . 16 1 1 A 70 70 LEU CA C 70 58.300 58.026 0.274 1
1 802 . 16 1 1 A 70 70 LEU CB C 70 41.500 40.455 1.045 1
1 806 . 16 1 1 A 70 70 LEU N N 70 121.200 119.601 1.599 1
1 807 . 16 1 1 A 71 71 ASP H H 71 8.140 8.164 -0.024 1
1 808 . 16 1 1 A 71 71 ASP HA H 71 4.420 4.312 0.108 1
1 811 . 16 1 1 A 71 71 ASP C C 71 180.000 178.255 1.745 1
1 812 . 16 1 1 A 71 71 ASP CA C 71 57.300 57.364 -0.064 1
1 813 . 16 1 1 A 71 71 ASP CB C 71 39.300 41.420 -2.120 1
1 814 . 16 1 1 A 71 71 ASP N N 71 121.100 119.607 1.493 1
1 815 . 16 1 1 A 72 72 TYR H H 72 8.320 8.220 0.100 1
1 816 . 16 1 1 A 72 72 TYR HA H 72 4.550 4.470 0.080 1
1 823 . 16 1 1 A 72 72 TYR C C 72 179.100 178.627 0.473 1
1 824 . 16 1 1 A 72 72 TYR CA C 72 60.500 60.855 -0.355 1
1 825 . 16 1 1 A 72 72 TYR CB C 72 37.600 38.194 -0.594 1
1 828 . 16 1 1 A 72 72 TYR N N 72 120.300 117.945 2.355 1
1 829 . 16 1 1 A 73 73 CYS H H 73 8.850 8.675 0.175 1
1 830 . 16 1 1 A 73 73 CYS HA H 73 4.380 4.601 -0.221 1
1 834 . 16 1 1 A 73 73 CYS C C 73 177.300 177.035 0.265 1
1 835 . 16 1 1 A 73 73 CYS CA C 73 64.400 63.403 0.997 1
1 836 . 16 1 1 A 73 73 CYS CB C 73 27.600 26.618 0.982 1
1 837 . 16 1 1 A 73 73 CYS N N 73 116.800 118.637 -1.837 1
1 838 . 16 1 1 A 74 74 SER H H 74 8.410 8.486 -0.076 1
1 839 . 16 1 1 A 74 74 SER HA H 74 4.290 4.255 0.035 1
1 842 . 16 1 1 A 74 74 SER C C 74 176.300 177.095 -0.795 1
1 843 . 16 1 1 A 74 74 SER CA C 74 61.400 61.269 0.131 1
1 844 . 16 1 1 A 74 74 SER CB C 74 62.600 62.453 0.147 1
1 845 . 16 1 1 A 74 74 SER N N 74 115.900 116.898 -0.998 1
1 846 . 16 1 1 A 75 75 GLY H H 75 7.790 8.074 -0.284 1
1 847 . 16 1 1 A 75 75 GLY HA2 H 75 4.320 3.703 0.617 1
1 848 . 16 1 1 A 75 75 GLY HA3 H 75 3.900 3.711 0.189 1
1 849 . 16 1 1 A 75 75 GLY C C 75 174.600 175.448 -0.848 1
1 850 . 16 1 1 A 75 75 GLY CA C 75 45.600 47.184 -1.584 1
1 851 . 16 1 1 A 75 75 GLY N N 75 107.500 109.533 -2.033 1
1 852 . 16 1 1 A 76 76 TYR H H 76 8.040 8.394 -0.354 1
1 853 . 16 1 1 A 76 76 TYR HA H 76 4.310 4.015 0.295 1
1 860 . 16 1 1 A 76 76 TYR C C 76 176.200 177.462 -1.262 1
1 861 . 16 1 1 A 76 76 TYR CA C 76 60.000 61.066 -1.066 1
1 862 . 16 1 1 A 76 76 TYR CB C 76 40.700 38.545 2.155 1
1 865 . 16 1 1 A 76 76 TYR N N 76 121.900 123.334 -1.434 1
1 866 . 16 1 1 A 77 77 VAL H H 77 7.540 8.375 -0.835 1
1 867 . 16 1 1 A 77 77 VAL HA H 77 3.450 3.257 0.193 1
1 875 . 16 1 1 A 77 77 VAL C C 77 175.500 177.335 -1.835 1
1 876 . 16 1 1 A 77 77 VAL CA C 77 65.500 64.882 0.618 1
1 877 . 16 1 1 A 77 77 VAL CB C 77 31.600 31.133 0.467 1
1 880 . 16 1 1 A 77 77 VAL N N 77 116.600 119.264 -2.664 1
1 881 . 16 1 1 A 78 78 ASP H H 78 7.580 7.974 -0.394 1
1 882 . 16 1 1 A 78 78 ASP HA H 78 4.380 4.345 0.035 1
1 885 . 16 1 1 A 78 78 ASP C C 78 177.000 177.469 -0.469 1
1 886 . 16 1 1 A 78 78 ASP CA C 78 55.800 56.595 -0.795 1
1 887 . 16 1 1 A 78 78 ASP CB C 78 39.900 40.795 -0.895 1
1 888 . 16 1 1 A 78 78 ASP N N 78 116.400 120.537 -4.137 1
1 889 . 16 1 1 A 79 79 CYS H H 79 8.040 7.584 0.456 1
1 890 . 16 1 1 A 79 79 CYS HA H 79 4.110 4.386 -0.276 1
1 893 . 16 1 1 A 79 79 CYS C C 79 174.200 174.884 -0.684 1
1 894 . 16 1 1 A 79 79 CYS CA C 79 58.600 59.818 -1.218 1
1 895 . 16 1 1 A 79 79 CYS CB C 79 27.200 28.065 -0.865 1
1 896 . 16 1 1 A 79 79 CYS N N 79 117.000 114.995 2.005 1
1 897 . 16 1 1 A 80 80 ILE H H 80 6.960 6.884 0.076 1
1 898 . 16 1 1 A 80 80 ILE HA H 80 4.120 4.045 0.075 1
1 908 . 16 1 1 A 80 80 ILE CA C 80 58.700 59.523 -0.823 1
1 909 . 16 1 1 A 80 80 ILE CB C 80 38.500 37.987 0.513 1
1 913 . 16 1 1 A 80 80 ILE N N 80 123.200 122.763 0.437 1
1 914 . 16 1 1 A 81 81 PRO HA H 81 4.340 4.244 0.096 1
1 921 . 16 1 1 A 81 81 PRO C C 81 178.000 176.404 1.596 1
1 922 . 16 1 1 A 81 81 PRO CA C 81 64.700 65.531 -0.831 1
1 923 . 16 1 1 A 81 81 PRO CB C 81 32.600 31.753 0.847 1
1 926 . 16 1 1 A 82 82 GLN H H 82 7.560 8.511 -0.951 1
1 927 . 16 1 1 A 82 82 GLN HA H 82 4.600 4.441 0.159 1
1 934 . 16 1 1 A 82 82 GLN C C 82 177.400 175.960 1.440 1
1 935 . 16 1 1 A 82 82 GLN CA C 82 55.600 55.782 -0.182 1
1 936 . 16 1 1 A 82 82 GLN CB C 82 28.800 29.014 -0.214 1
1 938 . 16 1 1 A 82 82 GLN N N 82 115.900 117.696 -1.796 1
1 940 . 16 1 1 A 83 83 THR H H 83 8.880 8.415 0.465 1
1 941 . 16 1 1 A 83 83 THR HA H 83 3.750 3.931 -0.181 1
1 946 . 16 1 1 A 83 83 THR C C 83 176.300 176.518 -0.218 1
1 947 . 16 1 1 A 83 83 THR CA C 83 66.500 66.599 -0.099 1
1 948 . 16 1 1 A 83 83 THR CB C 83 68.700 68.810 -0.110 1
1 950 . 16 1 1 A 83 83 THR N N 83 122.700 119.482 3.218 1
1 951 . 16 1 1 A 84 84 ARG H H 84 8.990 8.139 0.851 1
1 952 . 16 1 1 A 84 84 ARG HA H 84 4.250 4.007 0.243 1
1 960 . 16 1 1 A 84 84 ARG C C 84 178.900 178.833 0.067 1
1 961 . 16 1 1 A 84 84 ARG CA C 84 59.100 59.596 -0.496 1
1 962 . 16 1 1 A 84 84 ARG CB C 84 29.300 30.022 -0.722 1
1 965 . 16 1 1 A 84 84 ARG N N 84 120.100 122.029 -1.929 1
1 967 . 16 1 1 A 85 85 ASN H H 85 7.270 8.221 -0.951 1
1 968 . 16 1 1 A 85 85 ASN HA H 85 4.810 4.620 0.190 1
1 973 . 16 1 1 A 85 85 ASN C C 85 176.800 177.926 -1.126 1
1 974 . 16 1 1 A 85 85 ASN CA C 85 54.800 56.452 -1.652 1
1 975 . 16 1 1 A 85 85 ASN CB C 85 37.600 38.313 -0.713 1
1 976 . 16 1 1 A 85 85 ASN N N 85 117.400 118.347 -0.947 1
1 978 . 16 1 1 A 86 86 LYS H H 86 8.340 8.119 0.221 1
1 979 . 16 1 1 A 86 86 LYS HA H 86 3.890 4.043 -0.153 1
1 988 . 16 1 1 A 86 86 LYS C C 86 178.600 178.917 -0.317 1
1 989 . 16 1 1 A 86 86 LYS CA C 86 60.800 59.132 1.668 1
1 990 . 16 1 1 A 86 86 LYS CB C 86 32.700 32.130 0.570 1
1 994 . 16 1 1 A 86 86 LYS N N 86 124.200 120.761 3.439 1
1 995 . 16 1 1 A 87 87 PHE H H 87 8.120 8.497 -0.377 1
1 996 . 16 1 1 A 87 87 PHE HA H 87 4.260 4.217 0.043 1
1 1004 . 16 1 1 A 87 87 PHE C C 87 178.100 177.127 0.973 1
1 1005 . 16 1 1 A 87 87 PHE CA C 87 61.300 61.663 -0.363 1
1 1006 . 16 1 1 A 87 87 PHE CB C 87 38.200 39.168 -0.968 1
1 1010 . 16 1 1 A 87 87 PHE N N 87 118.300 120.907 -2.607 1
1 1011 . 16 1 1 A 88 88 ALA H H 88 7.860 7.939 -0.079 1
1 1012 . 16 1 1 A 88 88 ALA HA H 88 4.200 4.119 0.081 1
1 1016 . 16 1 1 A 88 88 ALA C C 88 180.600 179.715 0.885 1
1 1017 . 16 1 1 A 88 88 ALA CA C 88 54.900 55.083 -0.183 1
1 1018 . 16 1 1 A 88 88 ALA CB C 88 18.100 18.074 0.026 1
1 1019 . 16 1 1 A 88 88 ALA N N 88 121.700 120.837 0.863 1
1 1020 . 16 1 1 A 89 89 PHE H H 89 8.690 8.592 0.098 1
1 1021 . 16 1 1 A 89 89 PHE HA H 89 4.080 4.155 -0.075 1
1 1029 . 16 1 1 A 89 89 PHE C C 89 176.300 177.771 -1.471 1
1 1030 . 16 1 1 A 89 89 PHE CA C 89 62.000 61.392 0.608 1
1 1031 . 16 1 1 A 89 89 PHE CB C 89 39.800 39.549 0.251 1
1 1035 . 16 1 1 A 89 89 PHE N N 89 120.100 120.288 -0.188 1
1 1036 . 16 1 1 A 90 90 ARG H H 90 8.560 8.408 0.152 1
1 1037 . 16 1 1 A 90 90 ARG HA H 90 3.790 3.913 -0.123 1
1 1045 . 16 1 1 A 90 90 ARG C C 90 179.600 178.511 1.089 1
1 1046 . 16 1 1 A 90 90 ARG CA C 90 60.000 59.619 0.381 1
1 1047 . 16 1 1 A 90 90 ARG CB C 90 30.000 30.137 -0.137 1
1 1050 . 16 1 1 A 90 90 ARG N N 90 118.000 118.443 -0.443 1
1 1052 . 16 1 1 A 91 91 GLU H H 91 8.120 8.102 0.018 1
1 1053 . 16 1 1 A 91 91 GLU HA H 91 3.980 3.963 0.017 1
1 1058 . 16 1 1 A 91 91 GLU C C 91 178.400 179.080 -0.680 1
1 1059 . 16 1 1 A 91 91 GLU CA C 91 58.900 59.370 -0.470 1
1 1060 . 16 1 1 A 91 91 GLU CB C 91 28.800 29.046 -0.246 1
1 1062 . 16 1 1 A 91 91 GLU N N 91 119.300 118.253 1.047 1
1 1063 . 16 1 1 A 92 92 ALA H H 92 7.820 8.107 -0.287 1
1 1064 . 16 1 1 A 92 92 ALA HA H 92 4.050 3.987 0.063 1
1 1068 . 16 1 1 A 92 92 ALA C C 92 179.800 179.659 0.141 1
1 1069 . 16 1 1 A 92 92 ALA CA C 92 55.000 55.100 -0.100 1
1 1070 . 16 1 1 A 92 92 ALA CB C 92 18.000 18.524 -0.524 1
1 1071 . 16 1 1 A 92 92 ALA N N 92 123.400 122.025 1.375 1
1 1072 . 16 1 1 A 93 93 VAL H H 93 8.430 7.963 0.467 1
1 1073 . 16 1 1 A 93 93 VAL HA H 93 3.250 3.297 -0.047 1
1 1081 . 16 1 1 A 93 93 VAL C C 93 177.900 177.963 -0.063 1
1 1082 . 16 1 1 A 93 93 VAL CA C 93 66.800 66.702 0.098 1
1 1083 . 16 1 1 A 93 93 VAL CB C 93 31.300 31.082 0.218 1
1 1086 . 16 1 1 A 93 93 VAL N N 93 119.900 118.382 1.518 1
1 1087 . 16 1 1 A 94 94 SER H H 94 7.990 7.959 0.031 1
1 1088 . 16 1 1 A 94 94 SER HA H 94 4.230 3.951 0.279 1
1 1091 . 16 1 1 A 94 94 SER C C 94 177.200 176.848 0.352 1
1 1092 . 16 1 1 A 94 94 SER CA C 94 61.600 61.347 0.253 1
1 1093 . 16 1 1 A 94 94 SER CB C 94 62.700 63.084 -0.384 1
1 1094 . 16 1 1 A 94 94 SER N N 94 116.000 116.642 -0.642 1
1 1095 . 16 1 1 A 95 95 LYS H H 95 7.710 7.851 -0.141 1
1 1096 . 16 1 1 A 95 95 LYS HA H 95 4.020 3.981 0.039 1
1 1105 . 16 1 1 A 95 95 LYS C C 95 179.400 179.019 0.381 1
1 1106 . 16 1 1 A 95 95 LYS CA C 95 59.600 59.321 0.279 1
1 1107 . 16 1 1 A 95 95 LYS CB C 95 32.300 32.627 -0.327 1
1 1111 . 16 1 1 A 95 95 LYS N N 95 121.400 122.101 -0.701 1
1 1112 . 16 1 1 A 96 96 LEU H H 96 8.270 8.051 0.219 1
1 1113 . 16 1 1 A 96 96 LEU HA H 96 4.040 3.937 0.103 1
1 1123 . 16 1 1 A 96 96 LEU C C 96 177.700 178.292 -0.592 1
1 1124 . 16 1 1 A 96 96 LEU CA C 96 58.600 58.255 0.345 1
1 1125 . 16 1 1 A 96 96 LEU CB C 96 41.000 41.767 -0.767 1
1 1129 . 16 1 1 A 96 96 LEU N N 96 124.800 120.722 4.078 1
1 1130 . 16 1 1 A 97 97 GLU H H 97 8.500 8.413 0.087 1
1 1131 . 16 1 1 A 97 97 GLU HA H 97 3.760 4.047 -0.287 1
1 1136 . 16 1 1 A 97 97 GLU C C 97 179.100 178.950 0.150 1
1 1137 . 16 1 1 A 97 97 GLU CA C 97 59.900 59.155 0.745 1
1 1138 . 16 1 1 A 97 97 GLU CB C 97 28.700 29.043 -0.343 1
1 1140 . 16 1 1 A 97 97 GLU N N 97 119.000 117.497 1.503 1
1 1141 . 16 1 1 A 98 98 LEU H H 98 7.740 8.284 -0.544 1
1 1142 . 16 1 1 A 98 98 LEU HA H 98 4.110 4.073 0.037 1
1 1152 . 16 1 1 A 98 98 LEU C C 98 179.700 179.484 0.216 1
1 1153 . 16 1 1 A 98 98 LEU CA C 98 57.900 57.940 -0.040 1
1 1154 . 16 1 1 A 98 98 LEU CB C 98 41.800 41.631 0.169 1
1 1158 . 16 1 1 A 98 98 LEU N N 98 119.200 121.707 -2.507 1
1 1159 . 16 1 1 A 99 99 SER H H 99 8.290 8.142 0.148 1
1 1160 . 16 1 1 A 99 99 SER HA H 99 4.220 4.250 -0.030 1
1 1163 . 16 1 1 A 99 99 SER C C 99 176.600 177.258 -0.658 1
1 1164 . 16 1 1 A 99 99 SER CA C 99 62.400 61.078 1.322 1
1 1165 . 16 1 1 A 99 99 SER CB C 99 63.200 63.132 0.068 1
1 1166 . 16 1 1 A 99 99 SER N N 99 116.300 114.303 1.997 1
1 1167 . 16 1 1 A 100 100 LEU H H 100 8.490 8.154 0.336 1
1 1168 . 16 1 1 A 100 100 LEU HA H 100 3.960 3.996 -0.036 1
1 1178 . 16 1 1 A 100 100 LEU C C 100 179.300 179.506 -0.206 1
1 1179 . 16 1 1 A 100 100 LEU CA C 100 57.700 57.924 -0.224 1
1 1180 . 16 1 1 A 100 100 LEU CB C 100 41.300 41.151 0.149 1
1 1184 . 16 1 1 A 100 100 LEU N N 100 120.900 122.770 -1.870 1
1 1185 . 16 1 1 A 101 101 GLN H H 101 7.680 8.450 -0.770 1
1 1186 . 16 1 1 A 101 101 GLN HA H 101 4.100 3.973 0.127 1
1 1193 . 16 1 1 A 101 101 GLN C C 101 178.700 177.854 0.846 1
1 1194 . 16 1 1 A 101 101 GLN CA C 101 58.800 58.896 -0.096 1
1 1195 . 16 1 1 A 101 101 GLN CB C 101 27.900 27.952 -0.052 1
1 1197 . 16 1 1 A 101 101 GLN N N 101 119.100 118.038 1.062 1
1 1199 . 16 1 1 A 102 102 GLU H H 102 7.850 8.016 -0.166 1
1 1200 . 16 1 1 A 102 102 GLU HA H 102 4.050 4.098 -0.048 1
1 1205 . 16 1 1 A 102 102 GLU C C 102 179.100 178.982 0.118 1
1 1206 . 16 1 1 A 102 102 GLU CA C 102 58.400 59.200 -0.800 1
1 1207 . 16 1 1 A 102 102 GLU CB C 102 28.600 28.930 -0.330 1
1 1209 . 16 1 1 A 102 102 GLU N N 102 118.400 118.834 -0.434 1
1 1210 . 16 1 1 A 103 103 LEU H H 103 8.080 8.003 0.077 1
1 1211 . 16 1 1 A 103 103 LEU HA H 103 4.020 3.986 0.034 1
1 1221 . 16 1 1 A 103 103 LEU C C 103 178.200 178.237 -0.037 1
1 1222 . 16 1 1 A 103 103 LEU CA C 103 57.000 58.259 -1.259 1
1 1223 . 16 1 1 A 103 103 LEU CB C 103 41.900 41.912 -0.012 1
1 1227 . 16 1 1 A 103 103 LEU N N 103 120.600 123.374 -2.774 1
1 1228 . 16 1 1 A 104 104 GLN H H 104 7.900 8.302 -0.402 1
1 1229 . 16 1 1 A 104 104 GLN HA H 104 4.090 4.058 0.032 1
1 1236 . 16 1 1 A 104 104 GLN C C 104 177.300 177.549 -0.249 1
1 1237 . 16 1 1 A 104 104 GLN CA C 104 58.100 58.290 -0.190 1
1 1238 . 16 1 1 A 104 104 GLN CB C 104 29.400 28.449 0.951 1
1 1240 . 16 1 1 A 104 104 GLN N N 104 117.700 116.933 0.767 1
1 1242 . 16 1 1 A 105 105 VAL H H 105 7.620 7.181 0.439 1
1 1243 . 16 1 1 A 105 105 VAL HA H 105 4.190 3.921 0.269 1
1 1251 . 16 1 1 A 105 105 VAL C C 105 176.800 176.690 0.110 1
1 1252 . 16 1 1 A 105 105 VAL CA C 105 62.600 64.474 -1.874 1
1 1253 . 16 1 1 A 105 105 VAL CB C 105 32.000 31.386 0.614 1
1 1256 . 16 1 1 A 105 105 VAL N N 105 114.900 116.808 -1.908 1
1 1257 . 16 1 1 A 106 106 SER H H 106 7.900 7.428 0.472 1
1 1258 . 16 1 1 A 106 106 SER HA H 106 4.460 4.848 -0.388 1
1 1261 . 16 1 1 A 106 106 SER C C 106 175.000 174.912 0.088 1
1 1262 . 16 1 1 A 106 106 SER CA C 106 58.900 57.925 0.975 1
1 1263 . 16 1 1 A 106 106 SER CB C 106 63.900 63.787 0.113 1
1 1264 . 16 1 1 A 106 106 SER N N 106 116.900 117.272 -0.372 1
1 1265 . 16 1 1 A 107 107 SER H H 107 8.230 7.723 0.507 1
1 1266 . 16 1 1 A 107 107 SER HA H 107 4.390 4.165 0.225 1
1 1269 . 16 1 1 A 107 107 SER C C 107 174.600 175.202 -0.602 1
1 1270 . 16 1 1 A 107 107 SER CA C 107 58.400 61.066 -2.666 1
1 1271 . 16 1 1 A 107 107 SER CB C 107 63.600 63.056 0.544 1
1 1272 . 16 1 1 A 107 107 SER N N 107 117.500 116.610 0.890 1
1 1273 . 16 1 1 A 108 108 ALA H H 108 8.080 7.781 0.299 1
1 1274 . 16 1 1 A 108 108 ALA HA H 108 4.280 3.889 0.391 1
1 1278 . 16 1 1 A 108 108 ALA C C 108 177.500 178.381 -0.881 1
1 1279 . 16 1 1 A 108 108 ALA CA C 108 52.700 55.216 -2.516 1
1 1280 . 16 1 1 A 108 108 ALA CB C 108 19.200 17.445 1.755 1
1 1281 . 16 1 1 A 108 108 ALA N N 108 124.900 119.798 5.102 1
1 1282 . 16 1 1 A 109 109 ALA H H 109 8.080 8.594 -0.514 1
1 1283 . 16 1 1 A 109 109 ALA HA H 109 4.280 4.103 0.177 1
1 1287 . 16 1 1 A 109 109 ALA C C 109 177.700 178.106 -0.406 1
1 1288 . 16 1 1 A 109 109 ALA CA C 109 52.400 53.770 -1.370 1
1 1289 . 16 1 1 A 109 109 ALA CB C 109 19.400 19.333 0.067 1
1 1290 . 16 1 1 A 109 109 ALA N N 109 123.000 120.832 2.168 1
1 1291 . 16 1 1 A 110 110 ALA H H 110 8.300 8.049 0.251 1
1 1292 . 16 1 1 A 110 110 ALA HA H 110 4.280 3.911 0.369 1
1 1296 . 16 1 1 A 110 110 ALA C C 110 178.200 177.553 0.647 1
1 1297 . 16 1 1 A 110 110 ALA CA C 110 52.700 55.058 -2.358 1
1 1298 . 16 1 1 A 110 110 ALA CB C 110 19.200 17.721 1.479 1
1 1299 . 16 1 1 A 110 110 ALA N N 110 123.200 118.884 4.316 1
1 1300 . 16 1 1 A 111 111 GLY H H 111 8.300 8.530 -0.230 1
1 1301 . 16 1 1 A 111 111 GLY HA2 H 111 3.930 4.042 -0.112 1
1 1302 . 16 1 1 A 111 111 GLY HA3 H 111 3.940 4.042 -0.102 1
1 1303 . 16 1 1 A 111 111 GLY C C 111 173.700 173.265 0.435 1
1 1304 . 16 1 1 A 111 111 GLY CA C 111 45.100 45.832 -0.732 1
1 1305 . 16 1 1 A 111 111 GLY N N 111 108.000 103.238 4.762 1
1 1306 . 16 1 1 A 112 112 VAL H H 112 7.930 7.882 0.048 1
1 1307 . 16 1 1 A 112 112 VAL HA H 112 4.420 4.495 -0.075 1
1 1315 . 16 1 1 A 112 112 VAL CA C 112 60.000 58.744 1.256 1
1 1316 . 16 1 1 A 112 112 VAL CB C 112 32.200 34.647 -2.447 1
1 1319 . 16 1 1 A 112 112 VAL N N 112 120.400 120.997 -0.597 1
1 1320 . 16 1 1 A 113 113 PRO HA H 113 4.370 4.311 0.059 1
1 1327 . 16 1 1 A 113 113 PRO C C 113 177.300 177.669 -0.369 1
1 1328 . 16 1 1 A 113 113 PRO CA C 113 63.900 63.683 0.217 1
1 1329 . 16 1 1 A 113 113 PRO CB C 113 31.800 31.737 0.063 1
1 1332 . 16 1 1 A 114 114 GLY H H 114 8.570 8.884 -0.314 1
1 1333 . 16 1 1 A 114 114 GLY HA2 H 114 3.880 3.962 -0.082 1
1 1334 . 16 1 1 A 114 114 GLY HA3 H 114 4.120 3.962 0.158 1
1 1335 . 16 1 1 A 114 114 GLY C C 114 174.900 175.266 -0.366 1
1 1336 . 16 1 1 A 114 114 GLY CA C 114 45.200 45.702 -0.502 1
1 1337 . 16 1 1 A 114 114 GLY N N 114 109.000 112.298 -3.298 1
1 1338 . 16 1 1 A 115 115 THR H H 115 7.900 7.759 0.141 1
1 1339 . 16 1 1 A 115 115 THR HA H 115 4.400 3.971 0.429 1
1 1344 . 16 1 1 A 115 115 THR C C 115 174.300 174.000 0.300 1
1 1345 . 16 1 1 A 115 115 THR CA C 115 61.700 64.879 -3.179 1
1 1346 . 16 1 1 A 115 115 THR CB C 115 69.700 69.711 -0.011 1
1 1348 . 16 1 1 A 115 115 THR N N 115 111.400 115.698 -4.298 1
1 1349 . 16 1 1 A 116 116 ASN H H 116 8.450 8.220 0.230 1
1 1350 . 16 1 1 A 116 116 ASN HA H 116 4.970 5.078 -0.108 1
1 1355 . 16 1 1 A 116 116 ASN CA C 116 51.500 49.377 2.123 1
1 1356 . 16 1 1 A 116 116 ASN CB C 116 38.900 40.022 -1.122 1
1 1357 . 16 1 1 A 116 116 ASN N N 116 123.100 116.293 6.807 1
1 1359 . 16 1 1 A 117 117 PRO HA H 117 4.370 4.327 0.043 1
1 1366 . 16 1 1 A 117 117 PRO C C 117 178.400 177.924 0.476 1
1 1367 . 16 1 1 A 117 117 PRO CA C 117 64.800 64.761 0.039 1
1 1368 . 16 1 1 A 117 117 PRO CB C 117 32.100 31.815 0.285 1
1 1371 . 16 1 1 A 118 118 VAL H H 118 7.750 7.594 0.156 1
1 1372 . 16 1 1 A 118 118 VAL HA H 118 3.810 3.745 0.065 1
1 1380 . 16 1 1 A 118 118 VAL C C 118 178.300 178.188 0.112 1
1 1381 . 16 1 1 A 118 118 VAL CA C 118 65.200 65.419 -0.219 1
1 1382 . 16 1 1 A 118 118 VAL CB C 118 31.500 31.526 -0.026 1
1 1385 . 16 1 1 A 118 118 VAL N N 118 118.300 116.256 2.044 1
1 1386 . 16 1 1 A 119 119 LEU H H 119 7.540 8.225 -0.685 1
1 1387 . 16 1 1 A 119 119 LEU HA H 119 4.030 3.900 0.130 1
1 1397 . 16 1 1 A 119 119 LEU C C 119 178.900 178.888 0.012 1
1 1398 . 16 1 1 A 119 119 LEU CA C 119 57.800 58.294 -0.494 1
1 1399 . 16 1 1 A 119 119 LEU CB C 119 40.700 41.480 -0.780 1
1 1403 . 16 1 1 A 119 119 LEU N N 119 119.700 120.422 -0.722 1
1 1404 . 16 1 1 A 120 120 ASN H H 120 8.080 8.070 0.010 1
1 1405 . 16 1 1 A 120 120 ASN HA H 120 4.420 4.514 -0.094 1
1 1410 . 16 1 1 A 120 120 ASN C C 120 178.100 178.647 -0.547 1
1 1411 . 16 1 1 A 120 120 ASN CA C 120 56.100 56.148 -0.048 1
1 1412 . 16 1 1 A 120 120 ASN CB C 120 37.800 37.901 -0.101 1
1 1413 . 16 1 1 A 120 120 ASN N N 120 117.700 117.011 0.689 1
1 1415 . 16 1 1 A 121 121 ASN H H 121 8.120 8.237 -0.117 1
1 1416 . 16 1 1 A 121 121 ASN HA H 121 4.490 4.490 0.000 1
1 1421 . 16 1 1 A 121 121 ASN C C 121 178.000 178.145 -0.145 1
1 1422 . 16 1 1 A 121 121 ASN CA C 121 56.100 56.447 -0.347 1
1 1423 . 16 1 1 A 121 121 ASN CB C 121 37.800 38.464 -0.664 1
1 1424 . 16 1 1 A 121 121 ASN N N 121 120.000 119.122 0.878 1
1 1426 . 16 1 1 A 122 122 LEU H H 122 8.180 8.243 -0.063 1
1 1427 . 16 1 1 A 122 122 LEU HA H 122 4.050 3.945 0.105 1
1 1437 . 16 1 1 A 122 122 LEU C C 122 173.800 178.975 -5.175 1
1 1438 . 16 1 1 A 122 122 LEU CA C 122 58.500 57.888 0.612 1
1 1439 . 16 1 1 A 122 122 LEU CB C 122 41.900 42.053 -0.153 1
1 1443 . 16 1 1 A 122 122 LEU N N 122 122.600 120.835 1.765 1
1 1444 . 16 1 1 A 123 123 LEU H H 123 8.260 8.024 0.236 1
1 1445 . 16 1 1 A 123 123 LEU HA H 123 3.850 4.001 -0.151 1
1 1455 . 16 1 1 A 123 123 LEU C C 123 178.900 178.525 0.375 1
1 1456 . 16 1 1 A 123 123 LEU CA C 123 58.500 58.243 0.257 1
1 1457 . 16 1 1 A 123 123 LEU CB C 123 41.200 41.398 -0.198 1
1 1461 . 16 1 1 A 123 123 LEU N N 123 119.700 120.296 -0.596 1
1 1462 . 16 1 1 A 124 124 SER H H 124 7.950 8.306 -0.356 1
1 1463 . 16 1 1 A 124 124 SER HA H 124 4.240 4.052 0.188 1
1 1466 . 16 1 1 A 124 124 SER C C 124 177.500 177.127 0.373 1
1 1467 . 16 1 1 A 124 124 SER CA C 124 61.600 61.788 -0.188 1
1 1468 . 16 1 1 A 124 124 SER CB C 124 62.600 62.918 -0.318 1
1 1469 . 16 1 1 A 124 124 SER N N 124 113.400 114.075 -0.675 1
1 1470 . 16 1 1 A 125 125 CYS H H 125 8.040 8.159 -0.119 1
1 1471 . 16 1 1 A 125 125 CYS HA H 125 4.350 4.115 0.235 1
1 1474 . 16 1 1 A 125 125 CYS C C 125 176.800 176.986 -0.186 1
1 1475 . 16 1 1 A 125 125 CYS CA C 125 62.600 63.550 -0.950 1
1 1476 . 16 1 1 A 125 125 CYS CB C 125 27.100 26.513 0.587 1
1 1477 . 16 1 1 A 125 125 CYS N N 125 119.800 119.411 0.389 1
1 1478 . 16 1 1 A 126 126 VAL H H 126 8.290 8.576 -0.286 1
1 1479 . 16 1 1 A 126 126 VAL HA H 126 3.430 3.463 -0.033 1
1 1487 . 16 1 1 A 126 126 VAL C C 126 177.800 177.839 -0.039 1
1 1488 . 16 1 1 A 126 126 VAL CA C 126 67.100 66.681 0.419 1
1 1489 . 16 1 1 A 126 126 VAL CB C 126 31.400 31.612 -0.212 1
1 1492 . 16 1 1 A 126 126 VAL N N 126 121.900 120.451 1.449 1
1 1493 . 16 1 1 A 127 127 GLN H H 127 8.200 8.127 0.073 1
1 1494 . 16 1 1 A 127 127 GLN HA H 127 3.970 3.959 0.011 1
1 1501 . 16 1 1 A 127 127 GLN C C 127 178.200 178.364 -0.164 1
1 1502 . 16 1 1 A 127 127 GLN CA C 127 58.700 58.823 -0.123 1
1 1503 . 16 1 1 A 127 127 GLN CB C 127 27.800 28.372 -0.572 1
1 1505 . 16 1 1 A 127 127 GLN N N 127 119.700 117.513 2.187 1
1 1507 . 16 1 1 A 128 128 GLU H H 128 7.880 8.104 -0.224 1
1 1508 . 16 1 1 A 128 128 GLU HA H 128 4.200 4.032 0.168 1
1 1513 . 16 1 1 A 128 128 GLU C C 128 178.400 178.723 -0.323 1
1 1514 . 16 1 1 A 128 128 GLU CA C 128 59.000 59.112 -0.112 1
1 1515 . 16 1 1 A 128 128 GLU CB C 128 28.400 29.414 -1.014 1
1 1517 . 16 1 1 A 128 128 GLU N N 128 119.800 119.544 0.256 1
1 1518 . 16 1 1 A 129 129 ILE H H 129 8.000 8.361 -0.361 1
1 1519 . 16 1 1 A 129 129 ILE HA H 129 3.460 3.636 -0.176 1
1 1529 . 16 1 1 A 129 129 ILE C C 129 176.800 177.891 -1.091 1
1 1530 . 16 1 1 A 129 129 ILE CA C 129 66.100 65.577 0.523 1
1 1531 . 16 1 1 A 129 129 ILE CB C 129 38.200 37.388 0.812 1
1 1535 . 16 1 1 A 129 129 ILE N N 129 119.500 120.281 -0.781 1
1 1536 . 16 1 1 A 130 130 SER H H 130 8.040 8.082 -0.042 1
1 1537 . 16 1 1 A 130 130 SER HA H 130 3.780 4.113 -0.333 1
1 1540 . 16 1 1 A 130 130 SER C C 130 176.200 176.973 -0.773 1
1 1541 . 16 1 1 A 130 130 SER CA C 130 62.100 61.413 0.687 1
1 1542 . 16 1 1 A 130 130 SER CB C 130 62.600 63.168 -0.568 1
1 1543 . 16 1 1 A 130 130 SER N N 130 112.800 115.564 -2.764 1
1 1544 . 16 1 1 A 131 131 ASP H H 131 8.270 8.090 0.180 1
1 1545 . 16 1 1 A 131 131 ASP HA H 131 4.310 4.425 -0.115 1
1 1548 . 16 1 1 A 131 131 ASP C C 131 179.200 178.590 0.610 1
1 1549 . 16 1 1 A 131 131 ASP CA C 131 56.800 57.384 -0.584 1
1 1550 . 16 1 1 A 131 131 ASP CB C 131 40.900 41.209 -0.309 1
1 1551 . 16 1 1 A 131 131 ASP N N 131 119.600 121.502 -1.902 1
1 1552 . 16 1 1 A 132 132 VAL H H 132 8.470 8.310 0.160 1
1 1553 . 16 1 1 A 132 132 VAL HA H 132 3.520 3.737 -0.217 1
1 1561 . 16 1 1 A 132 132 VAL C C 132 178.700 178.476 0.224 1
1 1562 . 16 1 1 A 132 132 VAL CA C 132 66.500 66.580 -0.080 1
1 1563 . 16 1 1 A 132 132 VAL CB C 132 31.500 31.712 -0.212 1
1 1566 . 16 1 1 A 132 132 VAL N N 132 118.100 119.333 -1.233 1
1 1567 . 16 1 1 A 133 133 VAL H H 133 8.140 8.194 -0.054 1
1 1568 . 16 1 1 A 133 133 VAL HA H 133 3.770 3.704 0.066 1
1 1576 . 16 1 1 A 133 133 VAL C C 133 176.500 177.577 -1.077 1
1 1577 . 16 1 1 A 133 133 VAL CA C 133 65.100 66.777 -1.677 1
1 1578 . 16 1 1 A 133 133 VAL CB C 133 31.600 31.513 0.087 1
1 1581 . 16 1 1 A 133 133 VAL N N 133 117.000 120.542 -3.542 1
1 1582 . 16 1 1 A 134 134 GLN H H 134 7.490 7.884 -0.394 1
1 1583 . 16 1 1 A 134 134 GLN HA H 134 4.350 4.307 0.043 1
1 1590 . 16 1 1 A 134 134 GLN C C 134 175.400 176.764 -1.364 1
1 1591 . 16 1 1 A 134 134 GLN CA C 134 56.700 56.914 -0.214 1
1 1592 . 16 1 1 A 134 134 GLN CB C 134 30.500 28.979 1.521 1
1 1594 . 16 1 1 A 134 134 GLN N N 134 116.300 119.326 -3.026 1
1 1 . 17 1 1 A 2 2 GLY HA2 H 2 3.890 3.627 0.263 1
1 2 . 17 1 1 A 2 2 GLY HA3 H 2 3.890 3.694 0.196 1
1 3 . 17 1 1 A 2 2 GLY C C 2 174.200 174.092 0.108 1
1 4 . 17 1 1 A 2 2 GLY CA C 2 44.700 43.970 0.730 1
1 5 . 17 1 1 A 3 3 HIS H H 3 8.380 7.837 0.543 1
1 6 . 17 1 1 A 3 3 HIS HA H 3 4.610 4.704 -0.094 1
1 9 . 17 1 1 A 3 3 HIS C C 3 174.500 175.651 -1.151 1
1 10 . 17 1 1 A 3 3 HIS CA C 3 55.200 55.169 0.031 1
1 11 . 17 1 1 A 3 3 HIS CB C 3 28.800 29.722 -0.922 1
1 12 . 17 1 1 A 3 3 HIS N N 3 117.600 119.497 -1.897 1
1 13 . 17 1 1 A 4 4 HIS H H 4 8.520 7.581 0.939 1
1 14 . 17 1 1 A 4 4 HIS HA H 4 4.640 4.281 0.359 1
1 17 . 17 1 1 A 4 4 HIS C C 4 174.200 175.717 -1.517 1
1 18 . 17 1 1 A 4 4 HIS CA C 4 55.100 59.709 -4.609 1
1 19 . 17 1 1 A 4 4 HIS CB C 4 28.900 30.331 -1.431 1
1 20 . 17 1 1 A 4 4 HIS N N 4 119.000 118.662 0.338 1
1 21 . 17 1 1 A 5 5 HIS H H 5 8.530 8.162 0.368 1
1 22 . 17 1 1 A 5 5 HIS HA H 5 4.410 4.312 0.098 1
1 25 . 17 1 1 A 5 5 HIS CA C 5 54.900 59.729 -4.829 1
1 26 . 17 1 1 A 5 5 HIS CB C 5 27.300 27.956 -0.656 1
1 27 . 17 1 1 A 5 5 HIS N N 5 121.600 114.679 6.921 1
1 28 . 17 1 1 A 6 6 HIS HA H 6 4.640 4.191 0.449 1
1 31 . 17 1 1 A 6 6 HIS C C 6 174.100 175.738 -1.638 1
1 32 . 17 1 1 A 6 6 HIS CA C 6 55.100 57.973 -2.873 1
1 33 . 17 1 1 A 6 6 HIS CB C 6 29.100 29.999 -0.899 1
1 34 . 17 1 1 A 7 7 HIS H H 7 8.690 7.720 0.970 1
1 35 . 17 1 1 A 7 7 HIS HA H 7 4.650 3.852 0.798 1
1 38 . 17 1 1 A 7 7 HIS C C 7 174.200 174.130 0.070 1
1 39 . 17 1 1 A 7 7 HIS CA C 7 55.200 58.145 -2.945 1
1 40 . 17 1 1 A 7 7 HIS CB C 7 29.300 27.628 1.672 1
1 41 . 17 1 1 A 7 7 HIS N N 7 121.400 117.321 4.079 1
1 42 . 17 1 1 A 8 8 HIS H H 8 8.660 7.644 1.016 1
1 43 . 17 1 1 A 8 8 HIS HA H 8 4.700 4.644 0.056 1
1 46 . 17 1 1 A 8 8 HIS C C 8 174.200 175.011 -0.811 1
1 47 . 17 1 1 A 8 8 HIS CA C 8 55.000 56.281 -1.281 1
1 48 . 17 1 1 A 8 8 HIS CB C 8 29.300 31.671 -2.371 1
1 49 . 17 1 1 A 8 8 HIS N N 8 120.400 119.460 0.940 1
1 50 . 17 1 1 A 9 9 SER H H 9 8.490 8.960 -0.470 1
1 51 . 17 1 1 A 9 9 SER HA H 9 4.390 5.203 -0.813 1
1 54 . 17 1 1 A 9 9 SER C C 9 174.100 173.629 0.471 1
1 55 . 17 1 1 A 9 9 SER CA C 9 58.300 55.737 2.563 1
1 56 . 17 1 1 A 9 9 SER CB C 9 63.700 66.385 -2.685 1
1 57 . 17 1 1 A 9 9 SER N N 9 118.100 113.261 4.839 1
1 58 . 17 1 1 A 10 10 HIS H H 10 8.710 8.568 0.142 1
1 59 . 17 1 1 A 10 10 HIS HA H 10 4.690 5.264 -0.574 1
1 63 . 17 1 1 A 10 10 HIS C C 10 174.200 172.766 1.434 1
1 64 . 17 1 1 A 10 10 HIS CA C 10 55.200 54.176 1.024 1
1 65 . 17 1 1 A 10 10 HIS CB C 10 28.800 32.429 -3.629 1
1 66 . 17 1 1 A 10 10 HIS N N 10 120.700 116.851 3.849 1
1 67 . 17 1 1 A 11 11 MET H H 11 8.410 8.587 -0.177 1
1 68 . 17 1 1 A 11 11 MET HA H 11 4.420 4.651 -0.231 1
1 76 . 17 1 1 A 11 11 MET C C 11 175.800 176.507 -0.707 1
1 77 . 17 1 1 A 11 11 MET CA C 11 55.100 54.383 0.717 1
1 78 . 17 1 1 A 11 11 MET CB C 11 32.800 33.958 -1.158 1
1 81 . 17 1 1 A 11 11 MET N N 11 122.300 124.684 -2.384 1
1 82 . 17 1 1 A 12 12 ALA H H 12 8.440 8.525 -0.085 1
1 83 . 17 1 1 A 12 12 ALA HA H 12 4.280 4.335 -0.055 1
1 87 . 17 1 1 A 12 12 ALA C C 12 177.400 177.289 0.111 1
1 88 . 17 1 1 A 12 12 ALA CA C 12 52.400 51.943 0.457 1
1 89 . 17 1 1 A 12 12 ALA CB C 12 18.800 19.011 -0.211 1
1 90 . 17 1 1 A 12 12 ALA N N 12 125.900 124.007 1.893 1
1 91 . 17 1 1 A 13 13 ASN H H 13 8.440 8.622 -0.182 1
1 92 . 17 1 1 A 13 13 ASN HA H 13 4.660 4.870 -0.210 1
1 97 . 17 1 1 A 13 13 ASN C C 13 175.900 174.523 1.377 1
1 98 . 17 1 1 A 13 13 ASN CA C 13 53.200 53.350 -0.150 1
1 99 . 17 1 1 A 13 13 ASN CB C 13 38.800 37.328 1.472 1
1 100 . 17 1 1 A 13 13 ASN N N 13 118.300 118.512 -0.212 1
1 102 . 17 1 1 A 14 14 GLY H H 14 8.370 8.196 0.174 1
1 103 . 17 1 1 A 14 14 GLY HA2 H 14 3.920 4.417 -0.497 1
1 104 . 17 1 1 A 14 14 GLY HA3 H 14 3.920 4.419 -0.499 1
1 105 . 17 1 1 A 14 14 GLY C C 14 174.000 172.739 1.261 1
1 106 . 17 1 1 A 14 14 GLY CA C 14 45.200 45.398 -0.198 1
1 107 . 17 1 1 A 14 14 GLY N N 14 109.600 110.978 -1.378 1
1 108 . 17 1 1 A 15 15 ALA H H 15 8.140 8.462 -0.322 1
1 109 . 17 1 1 A 15 15 ALA HA H 15 4.280 4.877 -0.597 1
1 113 . 17 1 1 A 15 15 ALA C C 15 177.300 175.682 1.618 1
1 114 . 17 1 1 A 15 15 ALA CA C 15 52.500 51.295 1.205 1
1 115 . 17 1 1 A 15 15 ALA CB C 15 19.100 23.023 -3.923 1
1 116 . 17 1 1 A 15 15 ALA N N 15 123.800 121.942 1.858 1
1 117 . 17 1 1 A 16 16 ALA H H 16 8.030 8.513 -0.483 1
1 118 . 17 1 1 A 16 16 ALA HA H 16 4.280 4.416 -0.136 1
1 122 . 17 1 1 A 16 16 ALA C C 16 178.400 178.543 -0.143 1
1 123 . 17 1 1 A 16 16 ALA CA C 16 52.600 51.582 1.018 1
1 124 . 17 1 1 A 16 16 ALA CB C 16 19.100 18.553 0.547 1
1 125 . 17 1 1 A 16 16 ALA N N 16 122.300 122.403 -0.103 1
1 126 . 17 1 1 A 17 17 GLY H H 17 8.320 8.761 -0.441 1
1 127 . 17 1 1 A 17 17 GLY HA2 H 17 3.960 3.877 0.083 1
1 128 . 17 1 1 A 17 17 GLY HA3 H 17 3.960 3.877 0.083 1
1 129 . 17 1 1 A 17 17 GLY C C 17 174.500 175.629 -1.129 1
1 130 . 17 1 1 A 17 17 GLY CA C 17 45.200 45.669 -0.469 1
1 131 . 17 1 1 A 17 17 GLY N N 17 107.800 111.835 -4.035 1
1 132 . 17 1 1 A 18 18 THR H H 18 7.970 7.684 0.286 1
1 133 . 17 1 1 A 18 18 THR HA H 18 4.290 3.960 0.330 1
1 138 . 17 1 1 A 18 18 THR C C 18 174.600 177.058 -2.458 1
1 139 . 17 1 1 A 18 18 THR CA C 18 62.000 66.579 -4.579 1
1 140 . 17 1 1 A 18 18 THR CB C 18 69.700 68.567 1.133 1
1 142 . 17 1 1 A 18 18 THR N N 18 113.800 115.333 -1.533 1
1 143 . 17 1 1 A 19 19 LYS H H 19 8.350 8.125 0.225 1
1 144 . 17 1 1 A 19 19 LYS HA H 19 4.270 4.060 0.210 1
1 153 . 17 1 1 A 19 19 LYS C C 19 176.600 178.098 -1.498 1
1 154 . 17 1 1 A 19 19 LYS CA C 19 56.500 59.197 -2.697 1
1 155 . 17 1 1 A 19 19 LYS CB C 19 32.800 31.980 0.820 1
1 159 . 17 1 1 A 19 19 LYS N N 19 124.000 119.873 4.127 1
1 160 . 17 1 1 A 20 20 VAL H H 20 8.060 7.916 0.144 1
1 161 . 17 1 1 A 20 20 VAL HA H 20 3.990 3.720 0.270 1
1 169 . 17 1 1 A 20 20 VAL C C 20 175.900 178.226 -2.326 1
1 170 . 17 1 1 A 20 20 VAL CA C 20 62.400 65.211 -2.811 1
1 171 . 17 1 1 A 20 20 VAL CB C 20 32.600 31.144 1.456 1
1 174 . 17 1 1 A 20 20 VAL N N 20 121.700 120.393 1.307 1
1 175 . 17 1 1 A 21 21 ALA H H 21 8.310 7.809 0.501 1
1 176 . 17 1 1 A 21 21 ALA HA H 21 4.290 4.141 0.149 1
1 180 . 17 1 1 A 21 21 ALA C C 21 177.600 179.403 -1.803 1
1 181 . 17 1 1 A 21 21 ALA CA C 21 52.400 54.342 -1.942 1
1 182 . 17 1 1 A 21 21 ALA CB C 21 19.000 18.530 0.470 1
1 183 . 17 1 1 A 21 21 ALA N N 21 127.700 123.067 4.633 1
1 184 . 17 1 1 A 22 22 LEU H H 22 8.150 7.187 0.963 1
1 185 . 17 1 1 A 22 22 LEU HA H 22 4.280 4.189 0.091 1
1 195 . 17 1 1 A 22 22 LEU C C 22 177.400 176.399 1.001 1
1 196 . 17 1 1 A 22 22 LEU CA C 22 55.200 55.791 -0.591 1
1 197 . 17 1 1 A 22 22 LEU CB C 22 42.200 42.130 0.070 1
1 201 . 17 1 1 A 22 22 LEU N N 22 121.800 117.267 4.533 1
1 202 . 17 1 1 A 23 23 ARG H H 23 8.240 7.855 0.385 1
1 203 . 17 1 1 A 23 23 ARG HA H 23 4.290 3.985 0.305 1
1 211 . 17 1 1 A 23 23 ARG C C 23 176.300 175.703 0.597 1
1 212 . 17 1 1 A 23 23 ARG CA C 23 56.000 57.697 -1.697 1
1 213 . 17 1 1 A 23 23 ARG CB C 23 30.600 28.169 2.431 1
1 216 . 17 1 1 A 23 23 ARG N N 23 122.000 115.583 6.417 1
1 218 . 17 1 1 A 24 24 LYS H H 24 8.370 7.975 0.395 1
1 219 . 17 1 1 A 24 24 LYS HA H 24 4.330 4.147 0.183 1
1 228 . 17 1 1 A 24 24 LYS C C 24 176.800 177.127 -0.327 1
1 229 . 17 1 1 A 24 24 LYS CA C 24 56.400 59.135 -2.735 1
1 230 . 17 1 1 A 24 24 LYS CB C 24 32.700 32.395 0.305 1
1 234 . 17 1 1 A 24 24 LYS N N 24 122.900 119.043 3.857 1
1 235 . 17 1 1 A 25 25 THR H H 25 8.100 7.618 0.482 1
1 236 . 17 1 1 A 25 25 THR HA H 25 4.290 4.487 -0.197 1
1 241 . 17 1 1 A 25 25 THR C C 25 174.600 174.303 0.297 1
1 242 . 17 1 1 A 25 25 THR CA C 25 61.500 61.114 0.386 1
1 243 . 17 1 1 A 25 25 THR CB C 25 69.800 69.200 0.600 1
1 245 . 17 1 1 A 25 25 THR N N 25 115.500 110.231 5.269 1
1 246 . 17 1 1 A 26 26 LYS H H 26 8.370 8.707 -0.337 1
1 247 . 17 1 1 A 26 26 LYS HA H 26 4.270 4.299 -0.029 1
1 256 . 17 1 1 A 26 26 LYS C C 26 176.600 177.408 -0.808 1
1 257 . 17 1 1 A 26 26 LYS CA C 26 56.600 56.432 0.168 1
1 258 . 17 1 1 A 26 26 LYS CB C 26 32.700 32.731 -0.031 1
1 262 . 17 1 1 A 26 26 LYS N N 26 123.700 126.300 -2.600 1
1 263 . 17 1 1 A 27 27 GLN H H 27 8.390 8.976 -0.586 1
1 264 . 17 1 1 A 27 27 GLN HA H 27 4.240 4.395 -0.155 1
1 271 . 17 1 1 A 27 27 GLN C C 27 175.900 175.848 0.052 1
1 272 . 17 1 1 A 27 27 GLN CA C 27 56.100 57.877 -1.777 1
1 273 . 17 1 1 A 27 27 GLN CB C 27 29.300 28.817 0.483 1
1 275 . 17 1 1 A 27 27 GLN N N 27 121.700 120.897 0.803 1
1 277 . 17 1 1 A 28 28 ALA H H 28 8.330 7.826 0.504 1
1 278 . 17 1 1 A 28 28 ALA HA H 28 4.240 4.504 -0.264 1
1 282 . 17 1 1 A 28 28 ALA C C 28 177.700 177.404 0.296 1
1 283 . 17 1 1 A 28 28 ALA CA C 28 52.500 51.373 1.127 1
1 284 . 17 1 1 A 28 28 ALA CB C 28 19.100 22.280 -3.180 1
1 285 . 17 1 1 A 28 28 ALA N N 28 125.400 119.069 6.331 1
1 286 . 17 1 1 A 29 29 ALA H H 29 8.250 8.878 -0.628 1
1 287 . 17 1 1 A 29 29 ALA HA H 29 4.230 4.012 0.218 1
1 291 . 17 1 1 A 29 29 ALA C C 29 178.000 179.618 -1.618 1
1 292 . 17 1 1 A 29 29 ALA CA C 29 52.500 54.976 -2.476 1
1 293 . 17 1 1 A 29 29 ALA CB C 29 19.100 18.443 0.657 1
1 294 . 17 1 1 A 29 29 ALA N N 29 123.000 123.587 -0.587 1
1 295 . 17 1 1 A 30 30 GLU H H 30 8.260 8.328 -0.068 1
1 296 . 17 1 1 A 30 30 GLU HA H 30 4.220 4.053 0.167 1
1 301 . 17 1 1 A 30 30 GLU C C 30 176.500 177.443 -0.943 1
1 302 . 17 1 1 A 30 30 GLU CA C 30 56.400 59.622 -3.222 1
1 303 . 17 1 1 A 30 30 GLU CB C 30 29.500 29.670 -0.170 1
1 305 . 17 1 1 A 30 30 GLU N N 30 119.700 118.091 1.609 1
1 306 . 17 1 1 A 31 31 LYS H H 31 8.230 8.006 0.224 1
1 307 . 17 1 1 A 31 31 LYS HA H 31 4.280 4.544 -0.264 1
1 316 . 17 1 1 A 31 31 LYS C C 31 176.500 176.554 -0.054 1
1 317 . 17 1 1 A 31 31 LYS CA C 31 56.400 56.321 0.079 1
1 318 . 17 1 1 A 31 31 LYS CB C 31 32.800 34.730 -1.930 1
1 322 . 17 1 1 A 31 31 LYS N N 31 122.700 118.407 4.293 1
1 323 . 17 1 1 A 32 32 ILE H H 32 8.140 7.578 0.562 1
1 324 . 17 1 1 A 32 32 ILE HA H 32 4.110 4.265 -0.155 1
1 334 . 17 1 1 A 32 32 ILE C C 32 176.400 175.780 0.620 1
1 335 . 17 1 1 A 32 32 ILE CA C 32 61.200 61.654 -0.454 1
1 336 . 17 1 1 A 32 32 ILE CB C 32 38.600 36.694 1.906 1
1 340 . 17 1 1 A 32 32 ILE N N 32 122.300 120.852 1.448 1
1 341 . 17 1 1 A 33 33 SER H H 33 8.230 8.511 -0.281 1
1 342 . 17 1 1 A 33 33 SER HA H 33 4.400 3.956 0.444 1
1 345 . 17 1 1 A 33 33 SER C C 33 174.800 176.424 -1.624 1
1 346 . 17 1 1 A 33 33 SER CA C 33 58.300 62.062 -3.762 1
1 347 . 17 1 1 A 33 33 SER CB C 33 63.700 62.698 1.002 1
1 348 . 17 1 1 A 33 33 SER N N 33 119.600 122.944 -3.344 1
1 349 . 17 1 1 A 34 34 ALA H H 34 8.430 8.218 0.212 1
1 350 . 17 1 1 A 34 34 ALA HA H 34 4.220 4.018 0.202 1
1 354 . 17 1 1 A 34 34 ALA C C 34 179.500 179.263 0.237 1
1 355 . 17 1 1 A 34 34 ALA CA C 34 53.500 55.174 -1.674 1
1 356 . 17 1 1 A 34 34 ALA CB C 34 18.800 18.526 0.274 1
1 357 . 17 1 1 A 34 34 ALA N N 34 126.000 123.334 2.666 1
1 358 . 17 1 1 A 35 35 ASP H H 35 8.380 7.374 1.006 1
1 359 . 17 1 1 A 35 35 ASP HA H 35 4.520 4.466 0.054 1
1 362 . 17 1 1 A 35 35 ASP C C 35 176.500 178.680 -2.180 1
1 363 . 17 1 1 A 35 35 ASP CA C 35 54.800 56.157 -1.357 1
1 364 . 17 1 1 A 35 35 ASP CB C 35 40.200 40.942 -0.742 1
1 365 . 17 1 1 A 35 35 ASP N N 35 118.200 118.322 -0.122 1
1 366 . 17 1 1 A 36 36 LYS H H 36 8.000 7.772 0.228 1
1 367 . 17 1 1 A 36 36 LYS HA H 36 4.270 4.084 0.186 1
1 376 . 17 1 1 A 36 36 LYS C C 36 177.000 177.055 -0.055 1
1 377 . 17 1 1 A 36 36 LYS CA C 36 56.800 58.609 -1.809 1
1 378 . 17 1 1 A 36 36 LYS CB C 36 32.900 31.716 1.184 1
1 382 . 17 1 1 A 36 36 LYS N N 36 120.900 118.420 2.480 1
1 383 . 17 1 1 A 37 37 ILE H H 37 7.970 7.374 0.596 1
1 384 . 17 1 1 A 37 37 ILE HA H 37 4.020 3.944 0.076 1
1 394 . 17 1 1 A 37 37 ILE C C 37 176.100 175.321 0.779 1
1 395 . 17 1 1 A 37 37 ILE CA C 37 61.300 61.526 -0.226 1
1 396 . 17 1 1 A 37 37 ILE CB C 37 38.100 36.702 1.398 1
1 400 . 17 1 1 A 37 37 ILE N N 37 121.800 121.007 0.793 1
1 401 . 17 1 1 A 38 38 SER H H 38 7.980 8.703 -0.723 1
1 402 . 17 1 1 A 38 38 SER HA H 38 4.540 4.416 0.124 1
1 405 . 17 1 1 A 38 38 SER C C 38 174.700 175.189 -0.489 1
1 406 . 17 1 1 A 38 38 SER CA C 38 58.200 59.620 -1.420 1
1 407 . 17 1 1 A 38 38 SER CB C 38 64.400 63.343 1.057 1
1 408 . 17 1 1 A 38 38 SER N N 38 119.000 124.066 -5.066 1
1 409 . 17 1 1 A 39 39 LYS H H 39 8.690 8.868 -0.178 1
1 410 . 17 1 1 A 39 39 LYS HA H 39 3.400 3.570 -0.170 1
1 419 . 17 1 1 A 39 39 LYS C C 39 177.400 178.097 -0.697 1
1 420 . 17 1 1 A 39 39 LYS CA C 39 59.800 60.433 -0.633 1
1 421 . 17 1 1 A 39 39 LYS CB C 39 32.400 32.135 0.265 1
1 425 . 17 1 1 A 39 39 LYS N N 39 124.200 126.190 -1.990 1
1 426 . 17 1 1 A 40 40 GLU H H 40 8.280 8.340 -0.060 1
1 427 . 17 1 1 A 40 40 GLU HA H 40 3.840 4.079 -0.239 1
1 432 . 17 1 1 A 40 40 GLU C C 40 178.400 178.785 -0.385 1
1 433 . 17 1 1 A 40 40 GLU CA C 40 59.400 59.153 0.247 1
1 434 . 17 1 1 A 40 40 GLU CB C 40 28.300 29.453 -1.153 1
1 436 . 17 1 1 A 40 40 GLU N N 40 116.300 117.283 -0.983 1
1 437 . 17 1 1 A 41 41 ALA H H 41 7.890 7.905 -0.015 1
1 438 . 17 1 1 A 41 41 ALA HA H 41 3.910 4.131 -0.221 1
1 442 . 17 1 1 A 41 41 ALA C C 41 179.900 180.077 -0.177 1
1 443 . 17 1 1 A 41 41 ALA CA C 41 54.700 55.092 -0.392 1
1 444 . 17 1 1 A 41 41 ALA CB C 41 17.900 18.428 -0.528 1
1 445 . 17 1 1 A 41 41 ALA N N 41 122.300 122.552 -0.252 1
1 446 . 17 1 1 A 42 42 LEU H H 42 7.490 8.130 -0.640 1
1 447 . 17 1 1 A 42 42 LEU HA H 42 3.480 4.052 -0.572 1
1 457 . 17 1 1 A 42 42 LEU C C 42 178.900 178.607 0.293 1
1 458 . 17 1 1 A 42 42 LEU CA C 42 59.800 57.815 1.985 1
1 459 . 17 1 1 A 42 42 LEU CB C 42 42.300 41.488 0.812 1
1 463 . 17 1 1 A 42 42 LEU N N 42 121.000 119.687 1.313 1
1 464 . 17 1 1 A 43 43 LEU H H 43 8.290 8.135 0.155 1
1 465 . 17 1 1 A 43 43 LEU HA H 43 3.780 3.870 -0.090 1
1 475 . 17 1 1 A 43 43 LEU C C 43 179.400 179.015 0.385 1
1 476 . 17 1 1 A 43 43 LEU CA C 43 57.600 58.018 -0.418 1
1 477 . 17 1 1 A 43 43 LEU CB C 43 40.900 41.326 -0.426 1
1 481 . 17 1 1 A 43 43 LEU N N 43 119.200 118.167 1.033 1
1 482 . 17 1 1 A 44 44 GLU H H 44 8.330 8.397 -0.067 1
1 483 . 17 1 1 A 44 44 GLU HA H 44 4.050 3.881 0.169 1
1 488 . 17 1 1 A 44 44 GLU C C 44 178.600 179.274 -0.674 1
1 489 . 17 1 1 A 44 44 GLU CA C 44 58.900 59.314 -0.414 1
1 490 . 17 1 1 A 44 44 GLU CB C 44 28.300 29.273 -0.973 1
1 492 . 17 1 1 A 44 44 GLU N N 44 119.600 117.510 2.090 1
1 493 . 17 1 1 A 45 45 CYS H H 45 7.690 8.060 -0.370 1
1 494 . 17 1 1 A 45 45 CYS HA H 45 4.120 4.006 0.114 1
1 497 . 17 1 1 A 45 45 CYS C C 45 176.100 176.448 -0.348 1
1 498 . 17 1 1 A 45 45 CYS CA C 45 62.500 62.611 -0.111 1
1 499 . 17 1 1 A 45 45 CYS CB C 45 26.200 25.973 0.227 1
1 500 . 17 1 1 A 45 45 CYS N N 45 120.900 118.759 2.141 1
1 501 . 17 1 1 A 46 46 ALA H H 46 8.540 8.144 0.396 1
1 502 . 17 1 1 A 46 46 ALA HA H 46 3.900 3.888 0.012 1
1 506 . 17 1 1 A 46 46 ALA C C 46 179.200 178.309 0.891 1
1 507 . 17 1 1 A 46 46 ALA CA C 46 55.500 55.483 0.017 1
1 508 . 17 1 1 A 46 46 ALA CB C 46 16.800 18.301 -1.501 1
1 509 . 17 1 1 A 46 46 ALA N N 46 121.500 122.279 -0.779 1
1 510 . 17 1 1 A 47 47 ASP H H 47 8.460 8.334 0.126 1
1 511 . 17 1 1 A 47 47 ASP HA H 47 4.340 4.338 0.002 1
1 514 . 17 1 1 A 47 47 ASP C C 47 178.800 178.559 0.241 1
1 515 . 17 1 1 A 47 47 ASP CA C 47 56.600 57.293 -0.693 1
1 516 . 17 1 1 A 47 47 ASP CB C 47 39.800 42.298 -2.498 1
1 517 . 17 1 1 A 47 47 ASP N N 47 119.000 118.403 0.597 1
1 518 . 17 1 1 A 48 48 LEU H H 48 8.040 7.727 0.313 1
1 519 . 17 1 1 A 48 48 LEU HA H 48 4.110 3.893 0.217 1
1 529 . 17 1 1 A 48 48 LEU C C 48 180.000 179.597 0.403 1
1 530 . 17 1 1 A 48 48 LEU CA C 48 58.000 58.332 -0.332 1
1 531 . 17 1 1 A 48 48 LEU CB C 48 41.700 41.345 0.355 1
1 535 . 17 1 1 A 48 48 LEU N N 48 123.000 119.809 3.191 1
1 536 . 17 1 1 A 49 49 LEU H H 49 8.300 7.736 0.564 1
1 537 . 17 1 1 A 49 49 LEU HA H 49 4.110 3.926 0.184 1
1 547 . 17 1 1 A 49 49 LEU C C 49 177.200 178.864 -1.664 1
1 548 . 17 1 1 A 49 49 LEU CA C 49 57.600 57.908 -0.308 1
1 549 . 17 1 1 A 49 49 LEU CB C 49 41.200 41.594 -0.394 1
1 553 . 17 1 1 A 49 49 LEU N N 49 120.900 119.441 1.459 1
1 554 . 17 1 1 A 50 50 SER H H 50 8.660 7.674 0.986 1
1 555 . 17 1 1 A 50 50 SER HA H 50 4.000 4.086 -0.086 1
1 558 . 17 1 1 A 50 50 SER C C 50 176.800 177.214 -0.414 1
1 559 . 17 1 1 A 50 50 SER CA C 50 62.500 61.709 0.791 1
1 560 . 17 1 1 A 50 50 SER CB C 50 62.600 62.821 -0.221 1
1 561 . 17 1 1 A 50 50 SER N N 50 113.300 114.744 -1.444 1
1 562 . 17 1 1 A 51 51 SER H H 51 7.980 8.129 -0.149 1
1 563 . 17 1 1 A 51 51 SER HA H 51 4.220 4.073 0.147 1
1 566 . 17 1 1 A 51 51 SER C C 51 176.300 177.239 -0.939 1
1 567 . 17 1 1 A 51 51 SER CA C 51 61.200 61.591 -0.391 1
1 568 . 17 1 1 A 51 51 SER CB C 51 62.700 62.825 -0.125 1
1 569 . 17 1 1 A 51 51 SER N N 51 115.900 115.470 0.430 1
1 570 . 17 1 1 A 52 52 ALA H H 52 8.030 8.242 -0.212 1
1 571 . 17 1 1 A 52 52 ALA HA H 52 4.130 4.169 -0.039 1
1 575 . 17 1 1 A 52 52 ALA C C 52 178.500 180.189 -1.689 1
1 576 . 17 1 1 A 52 52 ALA CA C 52 54.500 54.877 -0.377 1
1 577 . 17 1 1 A 52 52 ALA CB C 52 18.000 18.226 -0.226 1
1 578 . 17 1 1 A 52 52 ALA N N 52 125.400 123.404 1.996 1
1 579 . 17 1 1 A 53 53 LEU H H 53 7.710 8.209 -0.499 1
1 580 . 17 1 1 A 53 53 LEU HA H 53 4.180 4.145 0.035 1
1 590 . 17 1 1 A 53 53 LEU C C 53 177.700 177.942 -0.242 1
1 591 . 17 1 1 A 53 53 LEU CA C 53 56.500 57.046 -0.546 1
1 592 . 17 1 1 A 53 53 LEU CB C 53 42.400 41.712 0.688 1
1 596 . 17 1 1 A 53 53 LEU N N 53 113.800 118.291 -4.491 1
1 597 . 17 1 1 A 54 54 THR H H 54 7.550 7.228 0.322 1
1 598 . 17 1 1 A 54 54 THR HA H 54 4.420 4.487 -0.067 1
1 603 . 17 1 1 A 54 54 THR C C 54 174.100 173.290 0.810 1
1 604 . 17 1 1 A 54 54 THR CA C 54 61.600 61.958 -0.358 1
1 605 . 17 1 1 A 54 54 THR CB C 54 69.300 69.771 -0.471 1
1 607 . 17 1 1 A 54 54 THR N N 54 107.700 105.698 2.002 1
1 608 . 17 1 1 A 55 55 GLU H H 55 7.750 7.591 0.159 1
1 609 . 17 1 1 A 55 55 GLU HA H 55 4.760 5.004 -0.244 1
1 614 . 17 1 1 A 55 55 GLU CA C 55 53.400 53.604 -0.204 1
1 615 . 17 1 1 A 55 55 GLU CB C 55 30.100 32.390 -2.290 1
1 617 . 17 1 1 A 55 55 GLU N N 55 122.800 118.843 3.957 1
1 618 . 17 1 1 A 56 56 PRO HA H 56 4.670 4.797 -0.127 1
1 625 . 17 1 1 A 56 56 PRO C C 56 176.200 176.452 -0.252 1
1 626 . 17 1 1 A 56 56 PRO CA C 56 62.900 62.755 0.145 1
1 627 . 17 1 1 A 56 56 PRO CB C 56 29.200 31.628 -2.428 1
1 630 . 17 1 1 A 57 57 VAL H H 57 8.010 8.371 -0.361 1
1 631 . 17 1 1 A 57 57 VAL HA H 57 4.590 4.966 -0.376 1
1 639 . 17 1 1 A 57 57 VAL CA C 57 58.600 58.279 0.321 1
1 640 . 17 1 1 A 57 57 VAL CB C 57 32.800 34.825 -2.025 1
1 643 . 17 1 1 A 57 57 VAL N N 57 121.400 117.367 4.033 1
1 644 . 17 1 1 A 58 58 PRO HA H 58 4.450 4.662 -0.212 1
1 651 . 17 1 1 A 58 58 PRO C C 58 177.500 177.889 -0.389 1
1 652 . 17 1 1 A 58 58 PRO CA C 58 62.600 62.739 -0.139 1
1 653 . 17 1 1 A 58 58 PRO CB C 58 32.200 32.594 -0.394 1
1 656 . 17 1 1 A 59 59 ASN H H 59 8.890 9.122 -0.232 1
1 657 . 17 1 1 A 59 59 ASN HA H 59 4.330 4.445 -0.115 1
1 662 . 17 1 1 A 59 59 ASN C C 59 177.600 177.019 0.581 1
1 663 . 17 1 1 A 59 59 ASN CA C 59 56.300 56.011 0.289 1
1 664 . 17 1 1 A 59 59 ASN CB C 59 38.400 38.523 -0.123 1
1 665 . 17 1 1 A 59 59 ASN N N 59 122.200 123.304 -1.104 1
1 667 . 17 1 1 A 60 60 SER H H 60 8.660 8.307 0.353 1
1 668 . 17 1 1 A 60 60 SER HA H 60 4.010 4.188 -0.178 1
1 671 . 17 1 1 A 60 60 SER C C 60 176.200 176.059 0.141 1
1 672 . 17 1 1 A 60 60 SER CA C 60 60.800 61.386 -0.586 1
1 673 . 17 1 1 A 60 60 SER CB C 60 61.500 62.275 -0.775 1
1 674 . 17 1 1 A 60 60 SER N N 60 113.200 115.403 -2.203 1
1 675 . 17 1 1 A 61 61 GLN H H 61 7.420 8.176 -0.756 1
1 676 . 17 1 1 A 61 61 GLN HA H 61 4.280 4.009 0.271 1
1 683 . 17 1 1 A 61 61 GLN C C 61 178.600 178.568 0.032 1
1 684 . 17 1 1 A 61 61 GLN CA C 61 57.900 58.829 -0.929 1
1 685 . 17 1 1 A 61 61 GLN CB C 61 28.600 28.036 0.564 1
1 687 . 17 1 1 A 61 61 GLN N N 61 122.200 121.034 1.166 1
1 689 . 17 1 1 A 62 62 LEU H H 62 7.430 7.816 -0.386 1
1 690 . 17 1 1 A 62 62 LEU HA H 62 3.850 3.920 -0.070 1
1 700 . 17 1 1 A 62 62 LEU C C 62 178.800 179.151 -0.351 1
1 701 . 17 1 1 A 62 62 LEU CA C 62 57.900 58.117 -0.217 1
1 702 . 17 1 1 A 62 62 LEU CB C 62 42.100 42.255 -0.155 1
1 706 . 17 1 1 A 62 62 LEU N N 62 120.600 120.022 0.578 1
1 707 . 17 1 1 A 63 63 VAL H H 63 8.200 8.183 0.017 1
1 708 . 17 1 1 A 63 63 VAL HA H 63 3.370 3.251 0.119 1
1 716 . 17 1 1 A 63 63 VAL C C 63 178.000 177.391 0.609 1
1 717 . 17 1 1 A 63 63 VAL CA C 63 66.600 66.988 -0.388 1
1 718 . 17 1 1 A 63 63 VAL CB C 63 31.700 31.170 0.530 1
1 721 . 17 1 1 A 63 63 VAL N N 63 118.200 117.453 0.747 1
1 722 . 17 1 1 A 64 64 ASP H H 64 7.960 8.423 -0.463 1
1 723 . 17 1 1 A 64 64 ASP HA H 64 4.460 4.295 0.165 1
1 726 . 17 1 1 A 64 64 ASP C C 64 178.100 178.627 -0.527 1
1 727 . 17 1 1 A 64 64 ASP CA C 64 57.700 57.402 0.298 1
1 728 . 17 1 1 A 64 64 ASP CB C 64 39.800 41.417 -1.617 1
1 729 . 17 1 1 A 64 64 ASP N N 64 120.200 120.197 0.003 1
1 730 . 17 1 1 A 65 65 THR H H 65 8.380 8.255 0.125 1
1 731 . 17 1 1 A 65 65 THR HA H 65 3.970 3.939 0.031 1
1 736 . 17 1 1 A 65 65 THR C C 65 176.500 177.028 -0.528 1
1 737 . 17 1 1 A 65 65 THR CA C 65 66.500 66.630 -0.130 1
1 738 . 17 1 1 A 65 65 THR CB C 65 67.800 68.080 -0.280 1
1 740 . 17 1 1 A 65 65 THR N N 65 118.100 115.050 3.050 1
1 741 . 17 1 1 A 66 66 GLY H H 66 8.900 8.257 0.643 1
1 742 . 17 1 1 A 66 66 GLY HA2 H 66 3.630 3.617 0.013 1
1 743 . 17 1 1 A 66 66 GLY HA3 H 66 3.630 3.667 -0.037 1
1 744 . 17 1 1 A 66 66 GLY C C 66 174.200 176.869 -2.669 1
1 745 . 17 1 1 A 66 66 GLY CA C 66 47.500 47.385 0.115 1
1 746 . 17 1 1 A 66 66 GLY N N 66 110.500 107.660 2.840 1
1 747 . 17 1 1 A 67 67 HIS H H 67 8.650 7.629 1.021 1
1 748 . 17 1 1 A 67 67 HIS HA H 67 4.220 4.757 -0.537 1
1 752 . 17 1 1 A 67 67 HIS C C 67 176.900 177.975 -1.075 1
1 753 . 17 1 1 A 67 67 HIS CA C 67 59.000 58.337 0.663 1
1 754 . 17 1 1 A 67 67 HIS CB C 67 27.800 29.754 -1.954 1
1 756 . 17 1 1 A 67 67 HIS N N 67 120.100 120.279 -0.179 1
1 757 . 17 1 1 A 68 68 GLN H H 68 7.860 7.993 -0.133 1
1 758 . 17 1 1 A 68 68 GLN HA H 68 3.990 4.078 -0.088 1
1 765 . 17 1 1 A 68 68 GLN C C 68 177.800 178.005 -0.205 1
1 766 . 17 1 1 A 68 68 GLN CA C 68 58.800 58.594 0.206 1
1 767 . 17 1 1 A 68 68 GLN CB C 68 28.200 27.750 0.450 1
1 769 . 17 1 1 A 68 68 GLN N N 68 121.400 117.511 3.889 1
1 771 . 17 1 1 A 69 69 LEU H H 69 8.300 7.816 0.484 1
1 772 . 17 1 1 A 69 69 LEU HA H 69 4.330 4.019 0.311 1
1 782 . 17 1 1 A 69 69 LEU C C 69 179.300 179.388 -0.088 1
1 783 . 17 1 1 A 69 69 LEU CA C 69 58.200 58.106 0.094 1
1 784 . 17 1 1 A 69 69 LEU CB C 69 40.500 41.421 -0.921 1
1 788 . 17 1 1 A 69 69 LEU N N 69 120.300 121.952 -1.652 1
1 789 . 17 1 1 A 70 70 LEU H H 70 8.460 8.207 0.253 1
1 790 . 17 1 1 A 70 70 LEU HA H 70 3.880 4.010 -0.130 1
1 800 . 17 1 1 A 70 70 LEU C C 70 179.100 178.651 0.449 1
1 801 . 17 1 1 A 70 70 LEU CA C 70 58.300 58.133 0.167 1
1 802 . 17 1 1 A 70 70 LEU CB C 70 41.500 41.023 0.477 1
1 806 . 17 1 1 A 70 70 LEU N N 70 121.200 119.404 1.796 1
1 807 . 17 1 1 A 71 71 ASP H H 71 8.140 8.391 -0.251 1
1 808 . 17 1 1 A 71 71 ASP HA H 71 4.420 4.353 0.067 1
1 811 . 17 1 1 A 71 71 ASP C C 71 180.000 178.303 1.697 1
1 812 . 17 1 1 A 71 71 ASP CA C 71 57.300 57.426 -0.126 1
1 813 . 17 1 1 A 71 71 ASP CB C 71 39.300 41.789 -2.489 1
1 814 . 17 1 1 A 71 71 ASP N N 71 121.100 119.489 1.611 1
1 815 . 17 1 1 A 72 72 TYR H H 72 8.320 8.657 -0.337 1
1 816 . 17 1 1 A 72 72 TYR HA H 72 4.550 4.478 0.072 1
1 823 . 17 1 1 A 72 72 TYR C C 72 179.100 178.654 0.446 1
1 824 . 17 1 1 A 72 72 TYR CA C 72 60.500 60.746 -0.246 1
1 825 . 17 1 1 A 72 72 TYR CB C 72 37.600 38.145 -0.545 1
1 828 . 17 1 1 A 72 72 TYR N N 72 120.300 117.656 2.644 1
1 829 . 17 1 1 A 73 73 CYS H H 73 8.850 8.831 0.019 1
1 830 . 17 1 1 A 73 73 CYS HA H 73 4.380 4.650 -0.270 1
1 834 . 17 1 1 A 73 73 CYS C C 73 177.300 177.456 -0.156 1
1 835 . 17 1 1 A 73 73 CYS CA C 73 64.400 63.837 0.563 1
1 836 . 17 1 1 A 73 73 CYS CB C 73 27.600 27.003 0.597 1
1 837 . 17 1 1 A 73 73 CYS N N 73 116.800 118.670 -1.870 1
1 838 . 17 1 1 A 74 74 SER H H 74 8.410 8.443 -0.033 1
1 839 . 17 1 1 A 74 74 SER HA H 74 4.290 4.308 -0.018 1
1 842 . 17 1 1 A 74 74 SER C C 74 176.300 176.714 -0.414 1
1 843 . 17 1 1 A 74 74 SER CA C 74 61.400 61.134 0.266 1
1 844 . 17 1 1 A 74 74 SER CB C 74 62.600 63.239 -0.639 1
1 845 . 17 1 1 A 74 74 SER N N 74 115.900 115.919 -0.019 1
1 846 . 17 1 1 A 75 75 GLY H H 75 7.790 8.133 -0.343 1
1 847 . 17 1 1 A 75 75 GLY HA2 H 75 4.320 3.728 0.592 1
1 848 . 17 1 1 A 75 75 GLY HA3 H 75 3.900 3.731 0.169 1
1 849 . 17 1 1 A 75 75 GLY C C 75 174.600 175.366 -0.766 1
1 850 . 17 1 1 A 75 75 GLY CA C 75 45.600 47.014 -1.414 1
1 851 . 17 1 1 A 75 75 GLY N N 75 107.500 107.114 0.386 1
1 852 . 17 1 1 A 76 76 TYR H H 76 8.040 8.511 -0.471 1
1 853 . 17 1 1 A 76 76 TYR HA H 76 4.310 4.006 0.304 1
1 860 . 17 1 1 A 76 76 TYR C C 76 176.200 177.745 -1.545 1
1 861 . 17 1 1 A 76 76 TYR CA C 76 60.000 60.953 -0.953 1
1 862 . 17 1 1 A 76 76 TYR CB C 76 40.700 38.649 2.051 1
1 865 . 17 1 1 A 76 76 TYR N N 76 121.900 123.408 -1.508 1
1 866 . 17 1 1 A 77 77 VAL H H 77 7.540 8.224 -0.684 1
1 867 . 17 1 1 A 77 77 VAL HA H 77 3.450 3.572 -0.122 1
1 875 . 17 1 1 A 77 77 VAL C C 77 175.500 177.133 -1.633 1
1 876 . 17 1 1 A 77 77 VAL CA C 77 65.500 64.650 0.850 1
1 877 . 17 1 1 A 77 77 VAL CB C 77 31.600 31.193 0.407 1
1 880 . 17 1 1 A 77 77 VAL N N 77 116.600 118.886 -2.286 1
1 881 . 17 1 1 A 78 78 ASP H H 78 7.580 7.899 -0.319 1
1 882 . 17 1 1 A 78 78 ASP HA H 78 4.380 4.386 -0.006 1
1 885 . 17 1 1 A 78 78 ASP C C 78 177.000 177.657 -0.657 1
1 886 . 17 1 1 A 78 78 ASP CA C 78 55.800 56.604 -0.804 1
1 887 . 17 1 1 A 78 78 ASP CB C 78 39.900 40.754 -0.854 1
1 888 . 17 1 1 A 78 78 ASP N N 78 116.400 120.761 -4.361 1
1 889 . 17 1 1 A 79 79 CYS H H 79 8.040 7.523 0.517 1
1 890 . 17 1 1 A 79 79 CYS HA H 79 4.110 4.417 -0.307 1
1 893 . 17 1 1 A 79 79 CYS C C 79 174.200 174.506 -0.306 1
1 894 . 17 1 1 A 79 79 CYS CA C 79 58.600 58.678 -0.078 1
1 895 . 17 1 1 A 79 79 CYS CB C 79 27.200 28.196 -0.996 1
1 896 . 17 1 1 A 79 79 CYS N N 79 117.000 116.482 0.518 1
1 897 . 17 1 1 A 80 80 ILE H H 80 6.960 6.807 0.153 1
1 898 . 17 1 1 A 80 80 ILE HA H 80 4.120 3.954 0.166 1
1 908 . 17 1 1 A 80 80 ILE CA C 80 58.700 59.731 -1.031 1
1 909 . 17 1 1 A 80 80 ILE CB C 80 38.500 37.974 0.526 1
1 913 . 17 1 1 A 80 80 ILE N N 80 123.200 122.663 0.537 1
1 914 . 17 1 1 A 81 81 PRO HA H 81 4.340 4.526 -0.186 1
1 921 . 17 1 1 A 81 81 PRO C C 81 178.000 176.383 1.617 1
1 922 . 17 1 1 A 81 81 PRO CA C 81 64.700 64.281 0.419 1
1 923 . 17 1 1 A 81 81 PRO CB C 81 32.600 31.940 0.660 1
1 926 . 17 1 1 A 82 82 GLN H H 82 7.560 8.092 -0.532 1
1 927 . 17 1 1 A 82 82 GLN HA H 82 4.600 4.571 0.029 1
1 934 . 17 1 1 A 82 82 GLN C C 82 177.400 176.088 1.312 1
1 935 . 17 1 1 A 82 82 GLN CA C 82 55.600 55.396 0.204 1
1 936 . 17 1 1 A 82 82 GLN CB C 82 28.800 29.945 -1.145 1
1 938 . 17 1 1 A 82 82 GLN N N 82 115.900 119.599 -3.699 1
1 940 . 17 1 1 A 83 83 THR H H 83 8.880 8.681 0.199 1
1 941 . 17 1 1 A 83 83 THR HA H 83 3.750 3.906 -0.156 1
1 946 . 17 1 1 A 83 83 THR C C 83 176.300 176.354 -0.054 1
1 947 . 17 1 1 A 83 83 THR CA C 83 66.500 66.560 -0.060 1
1 948 . 17 1 1 A 83 83 THR CB C 83 68.700 68.818 -0.118 1
1 950 . 17 1 1 A 83 83 THR N N 83 122.700 119.181 3.519 1
1 951 . 17 1 1 A 84 84 ARG H H 84 8.990 8.306 0.684 1
1 952 . 17 1 1 A 84 84 ARG HA H 84 4.250 4.032 0.218 1
1 960 . 17 1 1 A 84 84 ARG C C 84 178.900 179.198 -0.298 1
1 961 . 17 1 1 A 84 84 ARG CA C 84 59.100 59.815 -0.715 1
1 962 . 17 1 1 A 84 84 ARG CB C 84 29.300 30.227 -0.927 1
1 965 . 17 1 1 A 84 84 ARG N N 84 120.100 121.218 -1.118 1
1 967 . 17 1 1 A 85 85 ASN H H 85 7.270 8.287 -1.017 1
1 968 . 17 1 1 A 85 85 ASN HA H 85 4.810 4.645 0.165 1
1 973 . 17 1 1 A 85 85 ASN C C 85 176.800 177.850 -1.050 1
1 974 . 17 1 1 A 85 85 ASN CA C 85 54.800 56.333 -1.533 1
1 975 . 17 1 1 A 85 85 ASN CB C 85 37.600 37.843 -0.243 1
1 976 . 17 1 1 A 85 85 ASN N N 85 117.400 118.336 -0.936 1
1 978 . 17 1 1 A 86 86 LYS H H 86 8.340 8.189 0.151 1
1 979 . 17 1 1 A 86 86 LYS HA H 86 3.890 4.123 -0.233 1
1 988 . 17 1 1 A 86 86 LYS C C 86 178.600 178.847 -0.247 1
1 989 . 17 1 1 A 86 86 LYS CA C 86 60.800 59.123 1.677 1
1 990 . 17 1 1 A 86 86 LYS CB C 86 32.700 32.348 0.352 1
1 994 . 17 1 1 A 86 86 LYS N N 86 124.200 120.806 3.394 1
1 995 . 17 1 1 A 87 87 PHE H H 87 8.120 8.827 -0.707 1
1 996 . 17 1 1 A 87 87 PHE HA H 87 4.260 4.214 0.046 1
1 1004 . 17 1 1 A 87 87 PHE C C 87 178.100 177.855 0.245 1
1 1005 . 17 1 1 A 87 87 PHE CA C 87 61.300 61.711 -0.411 1
1 1006 . 17 1 1 A 87 87 PHE CB C 87 38.200 39.108 -0.908 1
1 1010 . 17 1 1 A 87 87 PHE N N 87 118.300 121.171 -2.871 1
1 1011 . 17 1 1 A 88 88 ALA H H 88 7.860 8.309 -0.449 1
1 1012 . 17 1 1 A 88 88 ALA HA H 88 4.200 4.190 0.010 1
1 1016 . 17 1 1 A 88 88 ALA C C 88 180.600 179.971 0.629 1
1 1017 . 17 1 1 A 88 88 ALA CA C 88 54.900 54.926 -0.026 1
1 1018 . 17 1 1 A 88 88 ALA CB C 88 18.100 18.264 -0.164 1
1 1019 . 17 1 1 A 88 88 ALA N N 88 121.700 120.979 0.721 1
1 1020 . 17 1 1 A 89 89 PHE H H 89 8.690 8.403 0.287 1
1 1021 . 17 1 1 A 89 89 PHE HA H 89 4.080 4.093 -0.013 1
1 1029 . 17 1 1 A 89 89 PHE C C 89 176.300 177.690 -1.390 1
1 1030 . 17 1 1 A 89 89 PHE CA C 89 62.000 61.584 0.416 1
1 1031 . 17 1 1 A 89 89 PHE CB C 89 39.800 39.165 0.635 1
1 1035 . 17 1 1 A 89 89 PHE N N 89 120.100 119.616 0.484 1
1 1036 . 17 1 1 A 90 90 ARG H H 90 8.560 8.437 0.123 1
1 1037 . 17 1 1 A 90 90 ARG HA H 90 3.790 3.808 -0.018 1
1 1045 . 17 1 1 A 90 90 ARG C C 90 179.600 178.911 0.689 1
1 1046 . 17 1 1 A 90 90 ARG CA C 90 60.000 59.475 0.525 1
1 1047 . 17 1 1 A 90 90 ARG CB C 90 30.000 29.889 0.111 1
1 1050 . 17 1 1 A 90 90 ARG N N 90 118.000 118.115 -0.115 1
1 1052 . 17 1 1 A 91 91 GLU H H 91 8.120 8.219 -0.099 1
1 1053 . 17 1 1 A 91 91 GLU HA H 91 3.980 3.885 0.095 1
1 1058 . 17 1 1 A 91 91 GLU C C 91 178.400 178.571 -0.171 1
1 1059 . 17 1 1 A 91 91 GLU CA C 91 58.900 59.208 -0.308 1
1 1060 . 17 1 1 A 91 91 GLU CB C 91 28.800 29.128 -0.328 1
1 1062 . 17 1 1 A 91 91 GLU N N 91 119.300 117.975 1.325 1
1 1063 . 17 1 1 A 92 92 ALA H H 92 7.820 7.606 0.214 1
1 1064 . 17 1 1 A 92 92 ALA HA H 92 4.050 4.017 0.033 1
1 1068 . 17 1 1 A 92 92 ALA C C 92 179.800 179.831 -0.031 1
1 1069 . 17 1 1 A 92 92 ALA CA C 92 55.000 54.939 0.061 1
1 1070 . 17 1 1 A 92 92 ALA CB C 92 18.000 18.302 -0.302 1
1 1071 . 17 1 1 A 92 92 ALA N N 92 123.400 122.238 1.162 1
1 1072 . 17 1 1 A 93 93 VAL H H 93 8.430 7.792 0.638 1
1 1073 . 17 1 1 A 93 93 VAL HA H 93 3.250 3.239 0.011 1
1 1081 . 17 1 1 A 93 93 VAL C C 93 177.900 177.718 0.182 1
1 1082 . 17 1 1 A 93 93 VAL CA C 93 66.800 66.681 0.119 1
1 1083 . 17 1 1 A 93 93 VAL CB C 93 31.300 31.187 0.113 1
1 1086 . 17 1 1 A 93 93 VAL N N 93 119.900 118.695 1.205 1
1 1087 . 17 1 1 A 94 94 SER H H 94 7.990 8.459 -0.469 1
1 1088 . 17 1 1 A 94 94 SER HA H 94 4.230 3.973 0.257 1
1 1091 . 17 1 1 A 94 94 SER C C 94 177.200 176.782 0.418 1
1 1092 . 17 1 1 A 94 94 SER CA C 94 61.600 61.529 0.071 1
1 1093 . 17 1 1 A 94 94 SER CB C 94 62.700 63.022 -0.322 1
1 1094 . 17 1 1 A 94 94 SER N N 94 116.000 117.814 -1.814 1
1 1095 . 17 1 1 A 95 95 LYS H H 95 7.710 7.580 0.130 1
1 1096 . 17 1 1 A 95 95 LYS HA H 95 4.020 3.965 0.055 1
1 1105 . 17 1 1 A 95 95 LYS C C 95 179.400 178.941 0.459 1
1 1106 . 17 1 1 A 95 95 LYS CA C 95 59.600 59.435 0.165 1
1 1107 . 17 1 1 A 95 95 LYS CB C 95 32.300 32.520 -0.220 1
1 1111 . 17 1 1 A 95 95 LYS N N 95 121.400 122.141 -0.741 1
1 1112 . 17 1 1 A 96 96 LEU H H 96 8.270 7.964 0.306 1
1 1113 . 17 1 1 A 96 96 LEU HA H 96 4.040 3.934 0.106 1
1 1123 . 17 1 1 A 96 96 LEU C C 96 177.700 178.259 -0.559 1
1 1124 . 17 1 1 A 96 96 LEU CA C 96 58.600 58.230 0.370 1
1 1125 . 17 1 1 A 96 96 LEU CB C 96 41.000 41.737 -0.737 1
1 1129 . 17 1 1 A 96 96 LEU N N 96 124.800 121.044 3.756 1
1 1130 . 17 1 1 A 97 97 GLU H H 97 8.500 8.672 -0.172 1
1 1131 . 17 1 1 A 97 97 GLU HA H 97 3.760 4.044 -0.284 1
1 1136 . 17 1 1 A 97 97 GLU C C 97 179.100 178.882 0.218 1
1 1137 . 17 1 1 A 97 97 GLU CA C 97 59.900 59.007 0.893 1
1 1138 . 17 1 1 A 97 97 GLU CB C 97 28.700 29.069 -0.369 1
1 1140 . 17 1 1 A 97 97 GLU N N 97 119.000 117.396 1.604 1
1 1141 . 17 1 1 A 98 98 LEU H H 98 7.740 8.422 -0.682 1
1 1142 . 17 1 1 A 98 98 LEU HA H 98 4.110 4.069 0.041 1
1 1152 . 17 1 1 A 98 98 LEU C C 98 179.700 179.557 0.143 1
1 1153 . 17 1 1 A 98 98 LEU CA C 98 57.900 57.894 0.006 1
1 1154 . 17 1 1 A 98 98 LEU CB C 98 41.800 41.566 0.234 1
1 1158 . 17 1 1 A 98 98 LEU N N 98 119.200 121.733 -2.533 1
1 1159 . 17 1 1 A 99 99 SER H H 99 8.290 8.183 0.107 1
1 1160 . 17 1 1 A 99 99 SER HA H 99 4.220 4.469 -0.249 1
1 1163 . 17 1 1 A 99 99 SER C C 99 176.600 176.739 -0.139 1
1 1164 . 17 1 1 A 99 99 SER CA C 99 62.400 62.092 0.308 1
1 1165 . 17 1 1 A 99 99 SER CB C 99 63.200 62.908 0.292 1
1 1166 . 17 1 1 A 99 99 SER N N 99 116.300 114.320 1.980 1
1 1167 . 17 1 1 A 100 100 LEU H H 100 8.490 8.279 0.211 1
1 1168 . 17 1 1 A 100 100 LEU HA H 100 3.960 3.953 0.007 1
1 1178 . 17 1 1 A 100 100 LEU C C 100 179.300 179.643 -0.343 1
1 1179 . 17 1 1 A 100 100 LEU CA C 100 57.700 57.970 -0.270 1
1 1180 . 17 1 1 A 100 100 LEU CB C 100 41.300 41.223 0.077 1
1 1184 . 17 1 1 A 100 100 LEU N N 100 120.900 122.226 -1.326 1
1 1185 . 17 1 1 A 101 101 GLN H H 101 7.680 8.304 -0.624 1
1 1186 . 17 1 1 A 101 101 GLN HA H 101 4.100 4.009 0.091 1
1 1193 . 17 1 1 A 101 101 GLN C C 101 178.700 177.810 0.890 1
1 1194 . 17 1 1 A 101 101 GLN CA C 101 58.800 58.938 -0.138 1
1 1195 . 17 1 1 A 101 101 GLN CB C 101 27.900 27.858 0.042 1
1 1197 . 17 1 1 A 101 101 GLN N N 101 119.100 118.260 0.840 1
1 1199 . 17 1 1 A 102 102 GLU H H 102 7.850 8.223 -0.373 1
1 1200 . 17 1 1 A 102 102 GLU HA H 102 4.050 4.106 -0.056 1
1 1205 . 17 1 1 A 102 102 GLU C C 102 179.100 178.983 0.117 1
1 1206 . 17 1 1 A 102 102 GLU CA C 102 58.400 59.220 -0.820 1
1 1207 . 17 1 1 A 102 102 GLU CB C 102 28.600 28.828 -0.228 1
1 1209 . 17 1 1 A 102 102 GLU N N 102 118.400 118.870 -0.470 1
1 1210 . 17 1 1 A 103 103 LEU H H 103 8.080 8.008 0.072 1
1 1211 . 17 1 1 A 103 103 LEU HA H 103 4.020 3.989 0.031 1
1 1221 . 17 1 1 A 103 103 LEU C C 103 178.200 178.222 -0.022 1
1 1222 . 17 1 1 A 103 103 LEU CA C 103 57.000 58.144 -1.144 1
1 1223 . 17 1 1 A 103 103 LEU CB C 103 41.900 41.901 -0.001 1
1 1227 . 17 1 1 A 103 103 LEU N N 103 120.600 123.424 -2.824 1
1 1228 . 17 1 1 A 104 104 GLN H H 104 7.900 8.467 -0.567 1
1 1229 . 17 1 1 A 104 104 GLN HA H 104 4.090 4.101 -0.011 1
1 1236 . 17 1 1 A 104 104 GLN C C 104 177.300 177.154 0.146 1
1 1237 . 17 1 1 A 104 104 GLN CA C 104 58.100 58.114 -0.014 1
1 1238 . 17 1 1 A 104 104 GLN CB C 104 29.400 28.181 1.219 1
1 1240 . 17 1 1 A 104 104 GLN N N 104 117.700 116.770 0.930 1
1 1242 . 17 1 1 A 105 105 VAL H H 105 7.620 7.019 0.601 1
1 1243 . 17 1 1 A 105 105 VAL HA H 105 4.190 4.200 -0.010 1
1 1251 . 17 1 1 A 105 105 VAL C C 105 176.800 176.619 0.181 1
1 1252 . 17 1 1 A 105 105 VAL CA C 105 62.600 63.221 -0.621 1
1 1253 . 17 1 1 A 105 105 VAL CB C 105 32.000 32.069 -0.069 1
1 1256 . 17 1 1 A 105 105 VAL N N 105 114.900 116.476 -1.576 1
1 1257 . 17 1 1 A 106 106 SER H H 106 7.900 7.890 0.010 1
1 1258 . 17 1 1 A 106 106 SER HA H 106 4.460 4.832 -0.372 1
1 1261 . 17 1 1 A 106 106 SER C C 106 175.000 174.738 0.262 1
1 1262 . 17 1 1 A 106 106 SER CA C 106 58.900 57.792 1.108 1
1 1263 . 17 1 1 A 106 106 SER CB C 106 63.900 64.803 -0.903 1
1 1264 . 17 1 1 A 106 106 SER N N 106 116.900 117.343 -0.443 1
1 1265 . 17 1 1 A 107 107 SER H H 107 8.230 7.890 0.340 1
1 1266 . 17 1 1 A 107 107 SER HA H 107 4.390 4.091 0.299 1
1 1269 . 17 1 1 A 107 107 SER C C 107 174.600 174.747 -0.147 1
1 1270 . 17 1 1 A 107 107 SER CA C 107 58.400 62.137 -3.737 1
1 1271 . 17 1 1 A 107 107 SER CB C 107 63.600 63.109 0.491 1
1 1272 . 17 1 1 A 107 107 SER N N 107 117.500 118.183 -0.683 1
1 1273 . 17 1 1 A 108 108 ALA H H 108 8.080 7.804 0.276 1
1 1274 . 17 1 1 A 108 108 ALA HA H 108 4.280 3.905 0.375 1
1 1278 . 17 1 1 A 108 108 ALA C C 108 177.500 178.288 -0.788 1
1 1279 . 17 1 1 A 108 108 ALA CA C 108 52.700 55.145 -2.445 1
1 1280 . 17 1 1 A 108 108 ALA CB C 108 19.200 17.127 2.073 1
1 1281 . 17 1 1 A 108 108 ALA N N 108 124.900 121.351 3.549 1
1 1282 . 17 1 1 A 109 109 ALA H H 109 8.080 8.514 -0.434 1
1 1283 . 17 1 1 A 109 109 ALA HA H 109 4.280 4.307 -0.027 1
1 1287 . 17 1 1 A 109 109 ALA C C 109 177.700 178.338 -0.638 1
1 1288 . 17 1 1 A 109 109 ALA CA C 109 52.400 51.988 0.412 1
1 1289 . 17 1 1 A 109 109 ALA CB C 109 19.400 18.930 0.470 1
1 1290 . 17 1 1 A 109 109 ALA N N 109 123.000 120.285 2.715 1
1 1291 . 17 1 1 A 110 110 ALA H H 110 8.300 8.157 0.143 1
1 1292 . 17 1 1 A 110 110 ALA HA H 110 4.280 3.908 0.372 1
1 1296 . 17 1 1 A 110 110 ALA C C 110 178.200 177.358 0.842 1
1 1297 . 17 1 1 A 110 110 ALA CA C 110 52.700 55.010 -2.310 1
1 1298 . 17 1 1 A 110 110 ALA CB C 110 19.200 17.868 1.332 1
1 1299 . 17 1 1 A 110 110 ALA N N 110 123.200 118.484 4.716 1
1 1300 . 17 1 1 A 111 111 GLY H H 111 8.300 8.109 0.191 1
1 1301 . 17 1 1 A 111 111 GLY HA2 H 111 3.930 4.105 -0.175 1
1 1302 . 17 1 1 A 111 111 GLY HA3 H 111 3.940 4.107 -0.167 1
1 1303 . 17 1 1 A 111 111 GLY C C 111 173.700 172.712 0.988 1
1 1304 . 17 1 1 A 111 111 GLY CA C 111 45.100 45.839 -0.739 1
1 1305 . 17 1 1 A 111 111 GLY N N 111 108.000 102.875 5.125 1
1 1306 . 17 1 1 A 112 112 VAL H H 112 7.930 8.588 -0.658 1
1 1307 . 17 1 1 A 112 112 VAL HA H 112 4.420 4.544 -0.124 1
1 1315 . 17 1 1 A 112 112 VAL CA C 112 60.000 58.644 1.356 1
1 1316 . 17 1 1 A 112 112 VAL CB C 112 32.200 34.342 -2.142 1
1 1319 . 17 1 1 A 112 112 VAL N N 112 120.400 121.625 -1.225 1
1 1320 . 17 1 1 A 113 113 PRO HA H 113 4.370 4.275 0.095 1
1 1327 . 17 1 1 A 113 113 PRO C C 113 177.300 177.912 -0.612 1
1 1328 . 17 1 1 A 113 113 PRO CA C 113 63.900 63.892 0.008 1
1 1329 . 17 1 1 A 113 113 PRO CB C 113 31.800 31.286 0.514 1
1 1332 . 17 1 1 A 114 114 GLY H H 114 8.570 8.788 -0.218 1
1 1333 . 17 1 1 A 114 114 GLY HA2 H 114 3.880 3.958 -0.078 1
1 1334 . 17 1 1 A 114 114 GLY HA3 H 114 4.120 3.959 0.161 1
1 1335 . 17 1 1 A 114 114 GLY C C 114 174.900 175.259 -0.359 1
1 1336 . 17 1 1 A 114 114 GLY CA C 114 45.200 45.723 -0.523 1
1 1337 . 17 1 1 A 114 114 GLY N N 114 109.000 113.204 -4.204 1
1 1338 . 17 1 1 A 115 115 THR H H 115 7.900 7.520 0.380 1
1 1339 . 17 1 1 A 115 115 THR HA H 115 4.400 4.022 0.378 1
1 1344 . 17 1 1 A 115 115 THR C C 115 174.300 173.607 0.693 1
1 1345 . 17 1 1 A 115 115 THR CA C 115 61.700 64.645 -2.945 1
1 1346 . 17 1 1 A 115 115 THR CB C 115 69.700 69.757 -0.057 1
1 1348 . 17 1 1 A 115 115 THR N N 115 111.400 115.692 -4.292 1
1 1349 . 17 1 1 A 116 116 ASN H H 116 8.450 8.060 0.390 1
1 1350 . 17 1 1 A 116 116 ASN HA H 116 4.970 5.153 -0.183 1
1 1355 . 17 1 1 A 116 116 ASN CA C 116 51.500 49.483 2.017 1
1 1356 . 17 1 1 A 116 116 ASN CB C 116 38.900 39.936 -1.036 1
1 1357 . 17 1 1 A 116 116 ASN N N 116 123.100 116.619 6.481 1
1 1359 . 17 1 1 A 117 117 PRO HA H 117 4.370 4.319 0.051 1
1 1366 . 17 1 1 A 117 117 PRO C C 117 178.400 178.080 0.320 1
1 1367 . 17 1 1 A 117 117 PRO CA C 117 64.800 64.698 0.102 1
1 1368 . 17 1 1 A 117 117 PRO CB C 117 32.100 31.835 0.265 1
1 1371 . 17 1 1 A 118 118 VAL H H 118 7.750 7.570 0.180 1
1 1372 . 17 1 1 A 118 118 VAL HA H 118 3.810 3.741 0.069 1
1 1380 . 17 1 1 A 118 118 VAL C C 118 178.300 178.165 0.135 1
1 1381 . 17 1 1 A 118 118 VAL CA C 118 65.200 65.566 -0.366 1
1 1382 . 17 1 1 A 118 118 VAL CB C 118 31.500 31.542 -0.042 1
1 1385 . 17 1 1 A 118 118 VAL N N 118 118.300 116.283 2.017 1
1 1386 . 17 1 1 A 119 119 LEU H H 119 7.540 8.136 -0.596 1
1 1387 . 17 1 1 A 119 119 LEU HA H 119 4.030 3.851 0.179 1
1 1397 . 17 1 1 A 119 119 LEU C C 119 178.900 179.469 -0.569 1
1 1398 . 17 1 1 A 119 119 LEU CA C 119 57.800 58.258 -0.458 1
1 1399 . 17 1 1 A 119 119 LEU CB C 119 40.700 41.634 -0.934 1
1 1403 . 17 1 1 A 119 119 LEU N N 119 119.700 120.203 -0.503 1
1 1404 . 17 1 1 A 120 120 ASN H H 120 8.080 8.455 -0.375 1
1 1405 . 17 1 1 A 120 120 ASN HA H 120 4.420 4.508 -0.088 1
1 1410 . 17 1 1 A 120 120 ASN C C 120 178.100 178.523 -0.423 1
1 1411 . 17 1 1 A 120 120 ASN CA C 120 56.100 56.672 -0.572 1
1 1412 . 17 1 1 A 120 120 ASN CB C 120 37.800 37.870 -0.070 1
1 1413 . 17 1 1 A 120 120 ASN N N 120 117.700 117.713 -0.013 1
1 1415 . 17 1 1 A 121 121 ASN H H 121 8.120 7.831 0.289 1
1 1416 . 17 1 1 A 121 121 ASN HA H 121 4.490 4.555 -0.065 1
1 1421 . 17 1 1 A 121 121 ASN C C 121 178.000 178.352 -0.352 1
1 1422 . 17 1 1 A 121 121 ASN CA C 121 56.100 56.516 -0.416 1
1 1423 . 17 1 1 A 121 121 ASN CB C 121 37.800 38.047 -0.247 1
1 1424 . 17 1 1 A 121 121 ASN N N 121 120.000 118.354 1.646 1
1 1426 . 17 1 1 A 122 122 LEU H H 122 8.180 8.418 -0.238 1
1 1427 . 17 1 1 A 122 122 LEU HA H 122 4.050 3.954 0.096 1
1 1437 . 17 1 1 A 122 122 LEU C C 122 173.800 179.033 -5.233 1
1 1438 . 17 1 1 A 122 122 LEU CA C 122 58.500 57.992 0.508 1
1 1439 . 17 1 1 A 122 122 LEU CB C 122 41.900 41.655 0.245 1
1 1443 . 17 1 1 A 122 122 LEU N N 122 122.600 121.078 1.522 1
1 1444 . 17 1 1 A 123 123 LEU H H 123 8.260 8.130 0.130 1
1 1445 . 17 1 1 A 123 123 LEU HA H 123 3.850 3.957 -0.107 1
1 1455 . 17 1 1 A 123 123 LEU C C 123 178.900 178.522 0.378 1
1 1456 . 17 1 1 A 123 123 LEU CA C 123 58.500 58.131 0.369 1
1 1457 . 17 1 1 A 123 123 LEU CB C 123 41.200 41.324 -0.124 1
1 1461 . 17 1 1 A 123 123 LEU N N 123 119.700 120.628 -0.928 1
1 1462 . 17 1 1 A 124 124 SER H H 124 7.950 8.058 -0.108 1
1 1463 . 17 1 1 A 124 124 SER HA H 124 4.240 4.053 0.187 1
1 1466 . 17 1 1 A 124 124 SER C C 124 177.500 177.174 0.326 1
1 1467 . 17 1 1 A 124 124 SER CA C 124 61.600 61.733 -0.133 1
1 1468 . 17 1 1 A 124 124 SER CB C 124 62.600 62.801 -0.201 1
1 1469 . 17 1 1 A 124 124 SER N N 124 113.400 114.014 -0.614 1
1 1470 . 17 1 1 A 125 125 CYS H H 125 8.040 8.243 -0.203 1
1 1471 . 17 1 1 A 125 125 CYS HA H 125 4.350 4.115 0.235 1
1 1474 . 17 1 1 A 125 125 CYS C C 125 176.800 177.009 -0.209 1
1 1475 . 17 1 1 A 125 125 CYS CA C 125 62.600 63.951 -1.351 1
1 1476 . 17 1 1 A 125 125 CYS CB C 125 27.100 26.810 0.290 1
1 1477 . 17 1 1 A 125 125 CYS N N 125 119.800 119.443 0.357 1
1 1478 . 17 1 1 A 126 126 VAL H H 126 8.290 8.569 -0.279 1
1 1479 . 17 1 1 A 126 126 VAL HA H 126 3.430 3.408 0.022 1
1 1487 . 17 1 1 A 126 126 VAL C C 126 177.800 177.820 -0.020 1
1 1488 . 17 1 1 A 126 126 VAL CA C 126 67.100 66.864 0.236 1
1 1489 . 17 1 1 A 126 126 VAL CB C 126 31.400 31.469 -0.069 1
1 1492 . 17 1 1 A 126 126 VAL N N 126 121.900 120.718 1.182 1
1 1493 . 17 1 1 A 127 127 GLN H H 127 8.200 8.017 0.183 1
1 1494 . 17 1 1 A 127 127 GLN HA H 127 3.970 3.961 0.009 1
1 1501 . 17 1 1 A 127 127 GLN C C 127 178.200 178.604 -0.404 1
1 1502 . 17 1 1 A 127 127 GLN CA C 127 58.700 58.786 -0.086 1
1 1503 . 17 1 1 A 127 127 GLN CB C 127 27.800 28.379 -0.579 1
1 1505 . 17 1 1 A 127 127 GLN N N 127 119.700 117.851 1.849 1
1 1507 . 17 1 1 A 128 128 GLU H H 128 7.880 7.971 -0.091 1
1 1508 . 17 1 1 A 128 128 GLU HA H 128 4.200 4.053 0.147 1
1 1513 . 17 1 1 A 128 128 GLU C C 128 178.400 178.706 -0.306 1
1 1514 . 17 1 1 A 128 128 GLU CA C 128 59.000 59.002 -0.002 1
1 1515 . 17 1 1 A 128 128 GLU CB C 128 28.400 29.591 -1.191 1
1 1517 . 17 1 1 A 128 128 GLU N N 128 119.800 119.410 0.390 1
1 1518 . 17 1 1 A 129 129 ILE H H 129 8.000 8.469 -0.469 1
1 1519 . 17 1 1 A 129 129 ILE HA H 129 3.460 3.601 -0.141 1
1 1529 . 17 1 1 A 129 129 ILE C C 129 176.800 178.160 -1.360 1
1 1530 . 17 1 1 A 129 129 ILE CA C 129 66.100 65.427 0.673 1
1 1531 . 17 1 1 A 129 129 ILE CB C 129 38.200 37.662 0.538 1
1 1535 . 17 1 1 A 129 129 ILE N N 129 119.500 120.267 -0.767 1
1 1536 . 17 1 1 A 130 130 SER H H 130 8.040 8.198 -0.158 1
1 1537 . 17 1 1 A 130 130 SER HA H 130 3.780 4.219 -0.439 1
1 1540 . 17 1 1 A 130 130 SER C C 130 176.200 176.395 -0.195 1
1 1541 . 17 1 1 A 130 130 SER CA C 130 62.100 61.488 0.612 1
1 1542 . 17 1 1 A 130 130 SER CB C 130 62.600 62.306 0.294 1
1 1543 . 17 1 1 A 130 130 SER N N 130 112.800 114.783 -1.983 1
1 1544 . 17 1 1 A 131 131 ASP H H 131 8.270 7.974 0.296 1
1 1545 . 17 1 1 A 131 131 ASP HA H 131 4.310 4.386 -0.076 1
1 1548 . 17 1 1 A 131 131 ASP C C 131 179.200 178.572 0.628 1
1 1549 . 17 1 1 A 131 131 ASP CA C 131 56.800 57.695 -0.895 1
1 1550 . 17 1 1 A 131 131 ASP CB C 131 40.900 41.373 -0.473 1
1 1551 . 17 1 1 A 131 131 ASP N N 131 119.600 122.018 -2.418 1
1 1552 . 17 1 1 A 132 132 VAL H H 132 8.470 8.343 0.127 1
1 1553 . 17 1 1 A 132 132 VAL HA H 132 3.520 3.731 -0.211 1
1 1561 . 17 1 1 A 132 132 VAL C C 132 178.700 178.557 0.143 1
1 1562 . 17 1 1 A 132 132 VAL CA C 132 66.500 66.470 0.030 1
1 1563 . 17 1 1 A 132 132 VAL CB C 132 31.500 31.719 -0.219 1
1 1566 . 17 1 1 A 132 132 VAL N N 132 118.100 119.173 -1.073 1
1 1567 . 17 1 1 A 133 133 VAL H H 133 8.140 7.941 0.199 1
1 1568 . 17 1 1 A 133 133 VAL HA H 133 3.770 3.709 0.061 1
1 1576 . 17 1 1 A 133 133 VAL C C 133 176.500 177.292 -0.792 1
1 1577 . 17 1 1 A 133 133 VAL CA C 133 65.100 66.838 -1.738 1
1 1578 . 17 1 1 A 133 133 VAL CB C 133 31.600 31.445 0.155 1
1 1581 . 17 1 1 A 133 133 VAL N N 133 117.000 120.988 -3.988 1
1 1582 . 17 1 1 A 134 134 GLN H H 134 7.490 7.734 -0.244 1
1 1583 . 17 1 1 A 134 134 GLN HA H 134 4.350 4.272 0.078 1
1 1590 . 17 1 1 A 134 134 GLN C C 134 175.400 176.587 -1.187 1
1 1591 . 17 1 1 A 134 134 GLN CA C 134 56.700 56.726 -0.026 1
1 1592 . 17 1 1 A 134 134 GLN CB C 134 30.500 28.631 1.869 1
1 1594 . 17 1 1 A 134 134 GLN N N 134 116.300 119.275 -2.975 1
1 1 . 18 1 1 A 2 2 GLY HA2 H 2 3.890 4.103 -0.213 1
1 2 . 18 1 1 A 2 2 GLY HA3 H 2 3.890 4.175 -0.285 1
1 3 . 18 1 1 A 2 2 GLY C C 2 174.200 173.848 0.352 1
1 4 . 18 1 1 A 2 2 GLY CA C 2 44.700 45.085 -0.385 1
1 5 . 18 1 1 A 3 3 HIS H H 3 8.380 8.204 0.176 1
1 6 . 18 1 1 A 3 3 HIS HA H 3 4.610 4.851 -0.241 1
1 9 . 18 1 1 A 3 3 HIS C C 3 174.500 174.771 -0.271 1
1 10 . 18 1 1 A 3 3 HIS CA C 3 55.200 54.004 1.196 1
1 11 . 18 1 1 A 3 3 HIS CB C 3 28.800 29.251 -0.451 1
1 12 . 18 1 1 A 3 3 HIS N N 3 117.600 119.773 -2.173 1
1 13 . 18 1 1 A 4 4 HIS H H 4 8.520 8.145 0.375 1
1 14 . 18 1 1 A 4 4 HIS HA H 4 4.640 4.566 0.074 1
1 17 . 18 1 1 A 4 4 HIS C C 4 174.200 173.815 0.385 1
1 18 . 18 1 1 A 4 4 HIS CA C 4 55.100 54.388 0.712 1
1 19 . 18 1 1 A 4 4 HIS CB C 4 28.900 28.181 0.719 1
1 20 . 18 1 1 A 4 4 HIS N N 4 119.000 120.018 -1.018 1
1 21 . 18 1 1 A 5 5 HIS H H 5 8.530 7.796 0.734 1
1 22 . 18 1 1 A 5 5 HIS HA H 5 4.410 4.817 -0.407 1
1 25 . 18 1 1 A 5 5 HIS CA C 5 54.900 54.879 0.021 1
1 26 . 18 1 1 A 5 5 HIS CB C 5 27.300 31.323 -4.023 1
1 27 . 18 1 1 A 5 5 HIS N N 5 121.600 116.275 5.325 1
1 28 . 18 1 1 A 6 6 HIS HA H 6 4.640 4.961 -0.321 1
1 31 . 18 1 1 A 6 6 HIS C C 6 174.100 172.398 1.702 1
1 32 . 18 1 1 A 6 6 HIS CA C 6 55.100 54.584 0.516 1
1 33 . 18 1 1 A 6 6 HIS CB C 6 29.100 32.006 -2.906 1
1 34 . 18 1 1 A 7 7 HIS H H 7 8.690 8.644 0.046 1
1 35 . 18 1 1 A 7 7 HIS HA H 7 4.650 4.321 0.329 1
1 38 . 18 1 1 A 7 7 HIS C C 7 174.200 175.080 -0.880 1
1 39 . 18 1 1 A 7 7 HIS CA C 7 55.200 57.300 -2.100 1
1 40 . 18 1 1 A 7 7 HIS CB C 7 29.300 30.504 -1.204 1
1 41 . 18 1 1 A 7 7 HIS N N 7 121.400 120.106 1.294 1
1 42 . 18 1 1 A 8 8 HIS H H 8 8.660 8.239 0.421 1
1 43 . 18 1 1 A 8 8 HIS HA H 8 4.700 4.515 0.185 1
1 46 . 18 1 1 A 8 8 HIS C C 8 174.200 174.817 -0.617 1
1 47 . 18 1 1 A 8 8 HIS CA C 8 55.000 54.897 0.103 1
1 48 . 18 1 1 A 8 8 HIS CB C 8 29.300 27.886 1.414 1
1 49 . 18 1 1 A 8 8 HIS N N 8 120.400 124.278 -3.878 1
1 50 . 18 1 1 A 9 9 SER H H 9 8.490 8.548 -0.058 1
1 51 . 18 1 1 A 9 9 SER HA H 9 4.390 5.085 -0.695 1
1 54 . 18 1 1 A 9 9 SER C C 9 174.100 174.452 -0.352 1
1 55 . 18 1 1 A 9 9 SER CA C 9 58.300 57.371 0.929 1
1 56 . 18 1 1 A 9 9 SER CB C 9 63.700 64.330 -0.630 1
1 57 . 18 1 1 A 9 9 SER N N 9 118.100 117.712 0.388 1
1 58 . 18 1 1 A 10 10 HIS H H 10 8.710 8.933 -0.223 1
1 59 . 18 1 1 A 10 10 HIS HA H 10 4.690 5.361 -0.671 1
1 63 . 18 1 1 A 10 10 HIS C C 10 174.200 173.534 0.666 1
1 64 . 18 1 1 A 10 10 HIS CA C 10 55.200 53.519 1.681 1
1 65 . 18 1 1 A 10 10 HIS CB C 10 28.800 32.675 -3.875 1
1 66 . 18 1 1 A 10 10 HIS N N 10 120.700 119.518 1.182 1
1 67 . 18 1 1 A 11 11 MET H H 11 8.410 8.998 -0.588 1
1 68 . 18 1 1 A 11 11 MET HA H 11 4.420 4.968 -0.548 1
1 76 . 18 1 1 A 11 11 MET C C 11 175.800 174.504 1.296 1
1 77 . 18 1 1 A 11 11 MET CA C 11 55.100 53.697 1.403 1
1 78 . 18 1 1 A 11 11 MET CB C 11 32.800 36.648 -3.848 1
1 81 . 18 1 1 A 11 11 MET N N 11 122.300 118.408 3.892 1
1 82 . 18 1 1 A 12 12 ALA H H 12 8.440 8.526 -0.086 1
1 83 . 18 1 1 A 12 12 ALA HA H 12 4.280 5.192 -0.912 1
1 87 . 18 1 1 A 12 12 ALA C C 12 177.400 176.635 0.765 1
1 88 . 18 1 1 A 12 12 ALA CA C 12 52.400 50.448 1.952 1
1 89 . 18 1 1 A 12 12 ALA CB C 12 18.800 21.432 -2.632 1
1 90 . 18 1 1 A 12 12 ALA N N 12 125.900 123.056 2.844 1
1 91 . 18 1 1 A 13 13 ASN H H 13 8.440 9.214 -0.774 1
1 92 . 18 1 1 A 13 13 ASN HA H 13 4.660 5.616 -0.956 1
1 97 . 18 1 1 A 13 13 ASN C C 13 175.900 174.135 1.765 1
1 98 . 18 1 1 A 13 13 ASN CA C 13 53.200 51.226 1.974 1
1 99 . 18 1 1 A 13 13 ASN CB C 13 38.800 41.309 -2.509 1
1 100 . 18 1 1 A 13 13 ASN N N 13 118.300 118.108 0.192 1
1 102 . 18 1 1 A 14 14 GLY H H 14 8.370 8.842 -0.472 1
1 103 . 18 1 1 A 14 14 GLY HA2 H 14 3.920 4.032 -0.112 1
1 104 . 18 1 1 A 14 14 GLY HA3 H 14 3.920 4.035 -0.115 1
1 105 . 18 1 1 A 14 14 GLY C C 14 174.000 173.059 0.941 1
1 106 . 18 1 1 A 14 14 GLY CA C 14 45.200 45.726 -0.526 1
1 107 . 18 1 1 A 14 14 GLY N N 14 109.600 109.027 0.573 1
1 108 . 18 1 1 A 15 15 ALA H H 15 8.140 8.770 -0.630 1
1 109 . 18 1 1 A 15 15 ALA HA H 15 4.280 5.039 -0.759 1
1 113 . 18 1 1 A 15 15 ALA C C 15 177.300 175.667 1.633 1
1 114 . 18 1 1 A 15 15 ALA CA C 15 52.500 51.193 1.307 1
1 115 . 18 1 1 A 15 15 ALA CB C 15 19.100 20.781 -1.681 1
1 116 . 18 1 1 A 15 15 ALA N N 15 123.800 127.216 -3.416 1
1 117 . 18 1 1 A 16 16 ALA H H 16 8.030 8.555 -0.525 1
1 118 . 18 1 1 A 16 16 ALA HA H 16 4.280 4.712 -0.432 1
1 122 . 18 1 1 A 16 16 ALA C C 16 178.400 177.595 0.805 1
1 123 . 18 1 1 A 16 16 ALA CA C 16 52.600 50.831 1.769 1
1 124 . 18 1 1 A 16 16 ALA CB C 16 19.100 20.205 -1.105 1
1 125 . 18 1 1 A 16 16 ALA N N 16 122.300 125.886 -3.586 1
1 126 . 18 1 1 A 17 17 GLY H H 17 8.320 8.873 -0.553 1
1 127 . 18 1 1 A 17 17 GLY HA2 H 17 3.960 3.941 0.019 1
1 128 . 18 1 1 A 17 17 GLY HA3 H 17 3.960 3.942 0.018 1
1 129 . 18 1 1 A 17 17 GLY C C 17 174.500 175.054 -0.554 1
1 130 . 18 1 1 A 17 17 GLY CA C 17 45.200 46.630 -1.430 1
1 131 . 18 1 1 A 17 17 GLY N N 17 107.800 112.047 -4.247 1
1 132 . 18 1 1 A 18 18 THR H H 18 7.970 8.155 -0.185 1
1 133 . 18 1 1 A 18 18 THR HA H 18 4.290 3.995 0.295 1
1 138 . 18 1 1 A 18 18 THR C C 18 174.600 176.903 -2.303 1
1 139 . 18 1 1 A 18 18 THR CA C 18 62.000 66.327 -4.327 1
1 140 . 18 1 1 A 18 18 THR CB C 18 69.700 68.699 1.001 1
1 142 . 18 1 1 A 18 18 THR N N 18 113.800 113.420 0.380 1
1 143 . 18 1 1 A 19 19 LYS H H 19 8.350 8.531 -0.181 1
1 144 . 18 1 1 A 19 19 LYS HA H 19 4.270 4.151 0.119 1
1 153 . 18 1 1 A 19 19 LYS C C 19 176.600 176.742 -0.142 1
1 154 . 18 1 1 A 19 19 LYS CA C 19 56.500 58.221 -1.721 1
1 155 . 18 1 1 A 19 19 LYS CB C 19 32.800 31.434 1.366 1
1 159 . 18 1 1 A 19 19 LYS N N 19 124.000 119.721 4.279 1
1 160 . 18 1 1 A 20 20 VAL H H 20 8.060 7.498 0.562 1
1 161 . 18 1 1 A 20 20 VAL HA H 20 3.990 4.403 -0.413 1
1 169 . 18 1 1 A 20 20 VAL C C 20 175.900 176.572 -0.672 1
1 170 . 18 1 1 A 20 20 VAL CA C 20 62.400 61.089 1.311 1
1 171 . 18 1 1 A 20 20 VAL CB C 20 32.600 33.279 -0.679 1
1 174 . 18 1 1 A 20 20 VAL N N 20 121.700 118.891 2.809 1
1 175 . 18 1 1 A 21 21 ALA H H 21 8.310 7.852 0.458 1
1 176 . 18 1 1 A 21 21 ALA HA H 21 4.290 3.964 0.326 1
1 180 . 18 1 1 A 21 21 ALA C C 21 177.600 179.396 -1.796 1
1 181 . 18 1 1 A 21 21 ALA CA C 21 52.400 55.430 -3.030 1
1 182 . 18 1 1 A 21 21 ALA CB C 21 19.000 18.948 0.052 1
1 183 . 18 1 1 A 21 21 ALA N N 21 127.700 124.844 2.856 1
1 184 . 18 1 1 A 22 22 LEU H H 22 8.150 7.787 0.363 1
1 185 . 18 1 1 A 22 22 LEU HA H 22 4.280 4.302 -0.022 1
1 195 . 18 1 1 A 22 22 LEU C C 22 177.400 176.073 1.327 1
1 196 . 18 1 1 A 22 22 LEU CA C 22 55.200 54.439 0.761 1
1 197 . 18 1 1 A 22 22 LEU CB C 22 42.200 41.813 0.387 1
1 201 . 18 1 1 A 22 22 LEU N N 22 121.800 116.053 5.747 1
1 202 . 18 1 1 A 23 23 ARG H H 23 8.240 7.642 0.598 1
1 203 . 18 1 1 A 23 23 ARG HA H 23 4.290 3.997 0.293 1
1 211 . 18 1 1 A 23 23 ARG C C 23 176.300 175.790 0.510 1
1 212 . 18 1 1 A 23 23 ARG CA C 23 56.000 57.492 -1.492 1
1 213 . 18 1 1 A 23 23 ARG CB C 23 30.600 27.236 3.364 1
1 216 . 18 1 1 A 23 23 ARG N N 23 122.000 115.299 6.701 1
1 218 . 18 1 1 A 24 24 LYS H H 24 8.370 8.070 0.300 1
1 219 . 18 1 1 A 24 24 LYS HA H 24 4.330 4.319 0.011 1
1 228 . 18 1 1 A 24 24 LYS C C 24 176.800 176.548 0.252 1
1 229 . 18 1 1 A 24 24 LYS CA C 24 56.400 56.790 -0.390 1
1 230 . 18 1 1 A 24 24 LYS CB C 24 32.700 33.273 -0.573 1
1 234 . 18 1 1 A 24 24 LYS N N 24 122.900 117.751 5.149 1
1 235 . 18 1 1 A 25 25 THR H H 25 8.100 7.458 0.642 1
1 236 . 18 1 1 A 25 25 THR HA H 25 4.290 4.611 -0.321 1
1 241 . 18 1 1 A 25 25 THR C C 25 174.600 174.668 -0.068 1
1 242 . 18 1 1 A 25 25 THR CA C 25 61.500 60.508 0.992 1
1 243 . 18 1 1 A 25 25 THR CB C 25 69.800 70.271 -0.471 1
1 245 . 18 1 1 A 25 25 THR N N 25 115.500 109.774 5.726 1
1 246 . 18 1 1 A 26 26 LYS H H 26 8.370 8.702 -0.332 1
1 247 . 18 1 1 A 26 26 LYS HA H 26 4.270 4.611 -0.341 1
1 256 . 18 1 1 A 26 26 LYS C C 26 176.600 176.682 -0.082 1
1 257 . 18 1 1 A 26 26 LYS CA C 26 56.600 55.435 1.165 1
1 258 . 18 1 1 A 26 26 LYS CB C 26 32.700 33.679 -0.979 1
1 262 . 18 1 1 A 26 26 LYS N N 26 123.700 123.968 -0.268 1
1 263 . 18 1 1 A 27 27 GLN H H 27 8.390 8.501 -0.111 1
1 264 . 18 1 1 A 27 27 GLN HA H 27 4.240 4.569 -0.329 1
1 271 . 18 1 1 A 27 27 GLN C C 27 175.900 175.584 0.316 1
1 272 . 18 1 1 A 27 27 GLN CA C 27 56.100 56.031 0.069 1
1 273 . 18 1 1 A 27 27 GLN CB C 27 29.300 30.517 -1.217 1
1 275 . 18 1 1 A 27 27 GLN N N 27 121.700 117.309 4.391 1
1 277 . 18 1 1 A 28 28 ALA H H 28 8.330 7.580 0.750 1
1 278 . 18 1 1 A 28 28 ALA HA H 28 4.240 4.485 -0.245 1
1 282 . 18 1 1 A 28 28 ALA C C 28 177.700 177.076 0.624 1
1 283 . 18 1 1 A 28 28 ALA CA C 28 52.500 51.541 0.959 1
1 284 . 18 1 1 A 28 28 ALA CB C 28 19.100 22.262 -3.162 1
1 285 . 18 1 1 A 28 28 ALA N N 28 125.400 119.136 6.264 1
1 286 . 18 1 1 A 29 29 ALA H H 29 8.250 8.887 -0.637 1
1 287 . 18 1 1 A 29 29 ALA HA H 29 4.230 3.994 0.236 1
1 291 . 18 1 1 A 29 29 ALA C C 29 178.000 179.596 -1.596 1
1 292 . 18 1 1 A 29 29 ALA CA C 29 52.500 55.257 -2.757 1
1 293 . 18 1 1 A 29 29 ALA CB C 29 19.100 18.381 0.719 1
1 294 . 18 1 1 A 29 29 ALA N N 29 123.000 123.634 -0.634 1
1 295 . 18 1 1 A 30 30 GLU H H 30 8.260 8.439 -0.179 1
1 296 . 18 1 1 A 30 30 GLU HA H 30 4.220 4.050 0.170 1
1 301 . 18 1 1 A 30 30 GLU C C 30 176.500 178.301 -1.801 1
1 302 . 18 1 1 A 30 30 GLU CA C 30 56.400 59.646 -3.246 1
1 303 . 18 1 1 A 30 30 GLU CB C 30 29.500 29.624 -0.124 1
1 305 . 18 1 1 A 30 30 GLU N N 30 119.700 118.517 1.183 1
1 306 . 18 1 1 A 31 31 LYS H H 31 8.230 7.962 0.268 1
1 307 . 18 1 1 A 31 31 LYS HA H 31 4.280 4.420 -0.140 1
1 316 . 18 1 1 A 31 31 LYS C C 31 176.500 177.099 -0.599 1
1 317 . 18 1 1 A 31 31 LYS CA C 31 56.400 57.549 -1.149 1
1 318 . 18 1 1 A 31 31 LYS CB C 31 32.800 33.841 -1.041 1
1 322 . 18 1 1 A 31 31 LYS N N 31 122.700 118.525 4.175 1
1 323 . 18 1 1 A 32 32 ILE H H 32 8.140 7.688 0.452 1
1 324 . 18 1 1 A 32 32 ILE HA H 32 4.110 4.157 -0.047 1
1 334 . 18 1 1 A 32 32 ILE C C 32 176.400 175.893 0.507 1
1 335 . 18 1 1 A 32 32 ILE CA C 32 61.200 61.542 -0.342 1
1 336 . 18 1 1 A 32 32 ILE CB C 32 38.600 37.012 1.588 1
1 340 . 18 1 1 A 32 32 ILE N N 32 122.300 119.833 2.467 1
1 341 . 18 1 1 A 33 33 SER H H 33 8.230 8.906 -0.676 1
1 342 . 18 1 1 A 33 33 SER HA H 33 4.400 3.946 0.454 1
1 345 . 18 1 1 A 33 33 SER C C 33 174.800 176.506 -1.706 1
1 346 . 18 1 1 A 33 33 SER CA C 33 58.300 62.128 -3.828 1
1 347 . 18 1 1 A 33 33 SER CB C 33 63.700 62.817 0.883 1
1 348 . 18 1 1 A 33 33 SER N N 33 119.600 123.604 -4.004 1
1 349 . 18 1 1 A 34 34 ALA H H 34 8.430 8.328 0.102 1
1 350 . 18 1 1 A 34 34 ALA HA H 34 4.220 4.045 0.175 1
1 354 . 18 1 1 A 34 34 ALA C C 34 179.500 179.531 -0.031 1
1 355 . 18 1 1 A 34 34 ALA CA C 34 53.500 55.175 -1.675 1
1 356 . 18 1 1 A 34 34 ALA CB C 34 18.800 18.808 -0.008 1
1 357 . 18 1 1 A 34 34 ALA N N 34 126.000 123.507 2.493 1
1 358 . 18 1 1 A 35 35 ASP H H 35 8.380 7.954 0.426 1
1 359 . 18 1 1 A 35 35 ASP HA H 35 4.520 4.303 0.217 1
1 362 . 18 1 1 A 35 35 ASP C C 35 176.500 178.461 -1.961 1
1 363 . 18 1 1 A 35 35 ASP CA C 35 54.800 56.911 -2.111 1
1 364 . 18 1 1 A 35 35 ASP CB C 35 40.200 41.255 -1.055 1
1 365 . 18 1 1 A 35 35 ASP N N 35 118.200 118.277 -0.077 1
1 366 . 18 1 1 A 36 36 LYS H H 36 8.000 7.781 0.219 1
1 367 . 18 1 1 A 36 36 LYS HA H 36 4.270 4.063 0.207 1
1 376 . 18 1 1 A 36 36 LYS C C 36 177.000 177.457 -0.457 1
1 377 . 18 1 1 A 36 36 LYS CA C 36 56.800 59.045 -2.245 1
1 378 . 18 1 1 A 36 36 LYS CB C 36 32.900 32.185 0.715 1
1 382 . 18 1 1 A 36 36 LYS N N 36 120.900 118.327 2.573 1
1 383 . 18 1 1 A 37 37 ILE H H 37 7.970 7.512 0.458 1
1 384 . 18 1 1 A 37 37 ILE HA H 37 4.020 4.012 0.008 1
1 394 . 18 1 1 A 37 37 ILE C C 37 176.100 175.308 0.792 1
1 395 . 18 1 1 A 37 37 ILE CA C 37 61.300 62.256 -0.956 1
1 396 . 18 1 1 A 37 37 ILE CB C 37 38.100 37.701 0.399 1
1 400 . 18 1 1 A 37 37 ILE N N 37 121.800 120.648 1.152 1
1 401 . 18 1 1 A 38 38 SER H H 38 7.980 8.865 -0.885 1
1 402 . 18 1 1 A 38 38 SER HA H 38 4.540 4.691 -0.151 1
1 405 . 18 1 1 A 38 38 SER C C 38 174.700 175.583 -0.883 1
1 406 . 18 1 1 A 38 38 SER CA C 38 58.200 57.733 0.467 1
1 407 . 18 1 1 A 38 38 SER CB C 38 64.400 64.468 -0.068 1
1 408 . 18 1 1 A 38 38 SER N N 38 119.000 124.675 -5.675 1
1 409 . 18 1 1 A 39 39 LYS H H 39 8.690 9.069 -0.379 1
1 410 . 18 1 1 A 39 39 LYS HA H 39 3.400 3.710 -0.310 1
1 419 . 18 1 1 A 39 39 LYS C C 39 177.400 178.107 -0.707 1
1 420 . 18 1 1 A 39 39 LYS CA C 39 59.800 60.484 -0.684 1
1 421 . 18 1 1 A 39 39 LYS CB C 39 32.400 32.284 0.116 1
1 425 . 18 1 1 A 39 39 LYS N N 39 124.200 124.930 -0.730 1
1 426 . 18 1 1 A 40 40 GLU H H 40 8.280 8.374 -0.094 1
1 427 . 18 1 1 A 40 40 GLU HA H 40 3.840 4.063 -0.223 1
1 432 . 18 1 1 A 40 40 GLU C C 40 178.400 178.947 -0.547 1
1 433 . 18 1 1 A 40 40 GLU CA C 40 59.400 59.193 0.207 1
1 434 . 18 1 1 A 40 40 GLU CB C 40 28.300 29.349 -1.049 1
1 436 . 18 1 1 A 40 40 GLU N N 40 116.300 117.412 -1.112 1
1 437 . 18 1 1 A 41 41 ALA H H 41 7.890 8.071 -0.181 1
1 438 . 18 1 1 A 41 41 ALA HA H 41 3.910 4.097 -0.187 1
1 442 . 18 1 1 A 41 41 ALA C C 41 179.900 179.301 0.599 1
1 443 . 18 1 1 A 41 41 ALA CA C 41 54.700 55.112 -0.412 1
1 444 . 18 1 1 A 41 41 ALA CB C 41 17.900 18.616 -0.716 1
1 445 . 18 1 1 A 41 41 ALA N N 41 122.300 122.301 -0.001 1
1 446 . 18 1 1 A 42 42 LEU H H 42 7.490 7.834 -0.344 1
1 447 . 18 1 1 A 42 42 LEU HA H 42 3.480 4.123 -0.643 1
1 457 . 18 1 1 A 42 42 LEU C C 42 178.900 178.512 0.388 1
1 458 . 18 1 1 A 42 42 LEU CA C 42 59.800 57.743 2.057 1
1 459 . 18 1 1 A 42 42 LEU CB C 42 42.300 41.738 0.562 1
1 463 . 18 1 1 A 42 42 LEU N N 42 121.000 119.364 1.636 1
1 464 . 18 1 1 A 43 43 LEU H H 43 8.290 8.135 0.155 1
1 465 . 18 1 1 A 43 43 LEU HA H 43 3.780 3.848 -0.068 1
1 475 . 18 1 1 A 43 43 LEU C C 43 179.400 179.519 -0.119 1
1 476 . 18 1 1 A 43 43 LEU CA C 43 57.600 58.097 -0.497 1
1 477 . 18 1 1 A 43 43 LEU CB C 43 40.900 41.467 -0.567 1
1 481 . 18 1 1 A 43 43 LEU N N 43 119.200 118.583 0.617 1
1 482 . 18 1 1 A 44 44 GLU H H 44 8.330 8.355 -0.025 1
1 483 . 18 1 1 A 44 44 GLU HA H 44 4.050 3.932 0.118 1
1 488 . 18 1 1 A 44 44 GLU C C 44 178.600 179.470 -0.870 1
1 489 . 18 1 1 A 44 44 GLU CA C 44 58.900 59.722 -0.822 1
1 490 . 18 1 1 A 44 44 GLU CB C 44 28.300 29.200 -0.900 1
1 492 . 18 1 1 A 44 44 GLU N N 44 119.600 117.559 2.041 1
1 493 . 18 1 1 A 45 45 CYS H H 45 7.690 7.737 -0.047 1
1 494 . 18 1 1 A 45 45 CYS HA H 45 4.120 3.994 0.126 1
1 497 . 18 1 1 A 45 45 CYS C C 45 176.100 176.800 -0.700 1
1 498 . 18 1 1 A 45 45 CYS CA C 45 62.500 63.071 -0.571 1
1 499 . 18 1 1 A 45 45 CYS CB C 45 26.200 26.621 -0.421 1
1 500 . 18 1 1 A 45 45 CYS N N 45 120.900 118.943 1.957 1
1 501 . 18 1 1 A 46 46 ALA H H 46 8.540 7.845 0.695 1
1 502 . 18 1 1 A 46 46 ALA HA H 46 3.900 3.954 -0.054 1
1 506 . 18 1 1 A 46 46 ALA C C 46 179.200 178.988 0.212 1
1 507 . 18 1 1 A 46 46 ALA CA C 46 55.500 55.421 0.079 1
1 508 . 18 1 1 A 46 46 ALA CB C 46 16.800 17.842 -1.042 1
1 509 . 18 1 1 A 46 46 ALA N N 46 121.500 122.035 -0.535 1
1 510 . 18 1 1 A 47 47 ASP H H 47 8.460 8.204 0.256 1
1 511 . 18 1 1 A 47 47 ASP HA H 47 4.340 4.324 0.016 1
1 514 . 18 1 1 A 47 47 ASP C C 47 178.800 178.550 0.250 1
1 515 . 18 1 1 A 47 47 ASP CA C 47 56.600 57.356 -0.756 1
1 516 . 18 1 1 A 47 47 ASP CB C 47 39.800 42.472 -2.672 1
1 517 . 18 1 1 A 47 47 ASP N N 47 119.000 118.550 0.450 1
1 518 . 18 1 1 A 48 48 LEU H H 48 8.040 7.649 0.391 1
1 519 . 18 1 1 A 48 48 LEU HA H 48 4.110 3.978 0.132 1
1 529 . 18 1 1 A 48 48 LEU C C 48 180.000 179.607 0.393 1
1 530 . 18 1 1 A 48 48 LEU CA C 48 58.000 58.201 -0.201 1
1 531 . 18 1 1 A 48 48 LEU CB C 48 41.700 41.623 0.077 1
1 535 . 18 1 1 A 48 48 LEU N N 48 123.000 119.884 3.116 1
1 536 . 18 1 1 A 49 49 LEU H H 49 8.300 7.723 0.577 1
1 537 . 18 1 1 A 49 49 LEU HA H 49 4.110 3.916 0.194 1
1 547 . 18 1 1 A 49 49 LEU C C 49 177.200 178.963 -1.763 1
1 548 . 18 1 1 A 49 49 LEU CA C 49 57.600 57.858 -0.258 1
1 549 . 18 1 1 A 49 49 LEU CB C 49 41.200 41.655 -0.455 1
1 553 . 18 1 1 A 49 49 LEU N N 49 120.900 119.859 1.041 1
1 554 . 18 1 1 A 50 50 SER H H 50 8.660 7.803 0.857 1
1 555 . 18 1 1 A 50 50 SER HA H 50 4.000 4.088 -0.088 1
1 558 . 18 1 1 A 50 50 SER C C 50 176.800 176.435 0.365 1
1 559 . 18 1 1 A 50 50 SER CA C 50 62.500 62.178 0.322 1
1 560 . 18 1 1 A 50 50 SER CB C 50 62.600 62.810 -0.210 1
1 561 . 18 1 1 A 50 50 SER N N 50 113.300 114.498 -1.198 1
1 562 . 18 1 1 A 51 51 SER H H 51 7.980 8.084 -0.104 1
1 563 . 18 1 1 A 51 51 SER HA H 51 4.220 4.056 0.164 1
1 566 . 18 1 1 A 51 51 SER C C 51 176.300 176.888 -0.588 1
1 567 . 18 1 1 A 51 51 SER CA C 51 61.200 61.574 -0.374 1
1 568 . 18 1 1 A 51 51 SER CB C 51 62.700 62.977 -0.277 1
1 569 . 18 1 1 A 51 51 SER N N 51 115.900 116.184 -0.284 1
1 570 . 18 1 1 A 52 52 ALA H H 52 8.030 8.061 -0.031 1
1 571 . 18 1 1 A 52 52 ALA HA H 52 4.130 4.108 0.022 1
1 575 . 18 1 1 A 52 52 ALA C C 52 178.500 178.423 0.077 1
1 576 . 18 1 1 A 52 52 ALA CA C 52 54.500 54.389 0.111 1
1 577 . 18 1 1 A 52 52 ALA CB C 52 18.000 18.242 -0.242 1
1 578 . 18 1 1 A 52 52 ALA N N 52 125.400 122.990 2.410 1
1 579 . 18 1 1 A 53 53 LEU H H 53 7.710 7.905 -0.195 1
1 580 . 18 1 1 A 53 53 LEU HA H 53 4.180 4.205 -0.025 1
1 590 . 18 1 1 A 53 53 LEU C C 53 177.700 178.301 -0.601 1
1 591 . 18 1 1 A 53 53 LEU CA C 53 56.500 56.050 0.450 1
1 592 . 18 1 1 A 53 53 LEU CB C 53 42.400 42.211 0.189 1
1 596 . 18 1 1 A 53 53 LEU N N 53 113.800 117.153 -3.353 1
1 597 . 18 1 1 A 54 54 THR H H 54 7.550 7.313 0.237 1
1 598 . 18 1 1 A 54 54 THR HA H 54 4.420 4.378 0.042 1
1 603 . 18 1 1 A 54 54 THR C C 54 174.100 175.019 -0.919 1
1 604 . 18 1 1 A 54 54 THR CA C 54 61.600 63.248 -1.648 1
1 605 . 18 1 1 A 54 54 THR CB C 54 69.300 69.521 -0.221 1
1 607 . 18 1 1 A 54 54 THR N N 54 107.700 108.156 -0.456 1
1 608 . 18 1 1 A 55 55 GLU H H 55 7.750 7.562 0.188 1
1 609 . 18 1 1 A 55 55 GLU HA H 55 4.760 4.537 0.223 1
1 614 . 18 1 1 A 55 55 GLU CA C 55 53.400 54.284 -0.884 1
1 615 . 18 1 1 A 55 55 GLU CB C 55 30.100 30.564 -0.464 1
1 617 . 18 1 1 A 55 55 GLU N N 55 122.800 120.829 1.971 1
1 618 . 18 1 1 A 56 56 PRO HA H 56 4.670 4.686 -0.016 1
1 625 . 18 1 1 A 56 56 PRO C C 56 176.200 176.407 -0.207 1
1 626 . 18 1 1 A 56 56 PRO CA C 56 62.900 63.145 -0.245 1
1 627 . 18 1 1 A 56 56 PRO CB C 56 29.200 31.829 -2.629 1
1 630 . 18 1 1 A 57 57 VAL H H 57 8.010 8.347 -0.337 1
1 631 . 18 1 1 A 57 57 VAL HA H 57 4.590 4.992 -0.402 1
1 639 . 18 1 1 A 57 57 VAL CA C 57 58.600 58.266 0.334 1
1 640 . 18 1 1 A 57 57 VAL CB C 57 32.800 34.813 -2.013 1
1 643 . 18 1 1 A 57 57 VAL N N 57 121.400 117.146 4.254 1
1 644 . 18 1 1 A 58 58 PRO HA H 58 4.450 4.964 -0.514 1
1 651 . 18 1 1 A 58 58 PRO C C 58 177.500 177.845 -0.345 1
1 652 . 18 1 1 A 58 58 PRO CA C 58 62.600 63.036 -0.436 1
1 653 . 18 1 1 A 58 58 PRO CB C 58 32.200 31.818 0.382 1
1 656 . 18 1 1 A 59 59 ASN H H 59 8.890 8.653 0.237 1
1 657 . 18 1 1 A 59 59 ASN HA H 59 4.330 4.343 -0.013 1
1 662 . 18 1 1 A 59 59 ASN C C 59 177.600 177.628 -0.028 1
1 663 . 18 1 1 A 59 59 ASN CA C 59 56.300 56.123 0.177 1
1 664 . 18 1 1 A 59 59 ASN CB C 59 38.400 38.215 0.185 1
1 665 . 18 1 1 A 59 59 ASN N N 59 122.200 121.877 0.323 1
1 667 . 18 1 1 A 60 60 SER H H 60 8.660 7.949 0.711 1
1 668 . 18 1 1 A 60 60 SER HA H 60 4.010 4.093 -0.083 1
1 671 . 18 1 1 A 60 60 SER C C 60 176.200 177.326 -1.126 1
1 672 . 18 1 1 A 60 60 SER CA C 60 60.800 61.511 -0.711 1
1 673 . 18 1 1 A 60 60 SER CB C 60 61.500 62.915 -1.415 1
1 674 . 18 1 1 A 60 60 SER N N 60 113.200 115.598 -2.398 1
1 675 . 18 1 1 A 61 61 GLN H H 61 7.420 7.901 -0.481 1
1 676 . 18 1 1 A 61 61 GLN HA H 61 4.280 4.014 0.266 1
1 683 . 18 1 1 A 61 61 GLN C C 61 178.600 178.624 -0.024 1
1 684 . 18 1 1 A 61 61 GLN CA C 61 57.900 58.824 -0.924 1
1 685 . 18 1 1 A 61 61 GLN CB C 61 28.600 28.109 0.491 1
1 687 . 18 1 1 A 61 61 GLN N N 61 122.200 120.483 1.717 1
1 689 . 18 1 1 A 62 62 LEU H H 62 7.430 7.779 -0.349 1
1 690 . 18 1 1 A 62 62 LEU HA H 62 3.850 4.006 -0.156 1
1 700 . 18 1 1 A 62 62 LEU C C 62 178.800 179.108 -0.308 1
1 701 . 18 1 1 A 62 62 LEU CA C 62 57.900 58.043 -0.143 1
1 702 . 18 1 1 A 62 62 LEU CB C 62 42.100 42.235 -0.135 1
1 706 . 18 1 1 A 62 62 LEU N N 62 120.600 120.043 0.557 1
1 707 . 18 1 1 A 63 63 VAL H H 63 8.200 7.988 0.212 1
1 708 . 18 1 1 A 63 63 VAL HA H 63 3.370 3.314 0.056 1
1 716 . 18 1 1 A 63 63 VAL C C 63 178.000 177.707 0.293 1
1 717 . 18 1 1 A 63 63 VAL CA C 63 66.600 66.916 -0.316 1
1 718 . 18 1 1 A 63 63 VAL CB C 63 31.700 31.259 0.441 1
1 721 . 18 1 1 A 63 63 VAL N N 63 118.200 117.344 0.856 1
1 722 . 18 1 1 A 64 64 ASP H H 64 7.960 8.204 -0.244 1
1 723 . 18 1 1 A 64 64 ASP HA H 64 4.460 4.339 0.121 1
1 726 . 18 1 1 A 64 64 ASP C C 64 178.100 178.561 -0.461 1
1 727 . 18 1 1 A 64 64 ASP CA C 64 57.700 57.348 0.352 1
1 728 . 18 1 1 A 64 64 ASP CB C 64 39.800 41.361 -1.561 1
1 729 . 18 1 1 A 64 64 ASP N N 64 120.200 120.245 -0.045 1
1 730 . 18 1 1 A 65 65 THR H H 65 8.380 8.531 -0.151 1
1 731 . 18 1 1 A 65 65 THR HA H 65 3.970 3.995 -0.025 1
1 736 . 18 1 1 A 65 65 THR C C 65 176.500 177.159 -0.659 1
1 737 . 18 1 1 A 65 65 THR CA C 65 66.500 66.455 0.045 1
1 738 . 18 1 1 A 65 65 THR CB C 65 67.800 67.942 -0.142 1
1 740 . 18 1 1 A 65 65 THR N N 65 118.100 115.063 3.037 1
1 741 . 18 1 1 A 66 66 GLY H H 66 8.900 8.264 0.636 1
1 742 . 18 1 1 A 66 66 GLY HA2 H 66 3.630 3.571 0.059 1
1 743 . 18 1 1 A 66 66 GLY HA3 H 66 3.630 3.612 0.018 1
1 744 . 18 1 1 A 66 66 GLY C C 66 174.200 176.702 -2.502 1
1 745 . 18 1 1 A 66 66 GLY CA C 66 47.500 47.166 0.334 1
1 746 . 18 1 1 A 66 66 GLY N N 66 110.500 107.468 3.032 1
1 747 . 18 1 1 A 67 67 HIS H H 67 8.650 7.664 0.986 1
1 748 . 18 1 1 A 67 67 HIS HA H 67 4.220 4.685 -0.465 1
1 752 . 18 1 1 A 67 67 HIS C C 67 176.900 177.767 -0.867 1
1 753 . 18 1 1 A 67 67 HIS CA C 67 59.000 58.379 0.621 1
1 754 . 18 1 1 A 67 67 HIS CB C 67 27.800 29.932 -2.132 1
1 756 . 18 1 1 A 67 67 HIS N N 67 120.100 120.255 -0.155 1
1 757 . 18 1 1 A 68 68 GLN H H 68 7.860 8.395 -0.535 1
1 758 . 18 1 1 A 68 68 GLN HA H 68 3.990 4.137 -0.147 1
1 765 . 18 1 1 A 68 68 GLN C C 68 177.800 178.323 -0.523 1
1 766 . 18 1 1 A 68 68 GLN CA C 68 58.800 58.728 0.072 1
1 767 . 18 1 1 A 68 68 GLN CB C 68 28.200 27.950 0.250 1
1 769 . 18 1 1 A 68 68 GLN N N 68 121.400 117.538 3.862 1
1 771 . 18 1 1 A 69 69 LEU H H 69 8.300 8.144 0.156 1
1 772 . 18 1 1 A 69 69 LEU HA H 69 4.330 4.008 0.322 1
1 782 . 18 1 1 A 69 69 LEU C C 69 179.300 179.484 -0.184 1
1 783 . 18 1 1 A 69 69 LEU CA C 69 58.200 58.196 0.004 1
1 784 . 18 1 1 A 69 69 LEU CB C 69 40.500 41.486 -0.986 1
1 788 . 18 1 1 A 69 69 LEU N N 69 120.300 121.194 -0.894 1
1 789 . 18 1 1 A 70 70 LEU H H 70 8.460 7.934 0.526 1
1 790 . 18 1 1 A 70 70 LEU HA H 70 3.880 3.971 -0.091 1
1 800 . 18 1 1 A 70 70 LEU C C 70 179.100 179.443 -0.343 1
1 801 . 18 1 1 A 70 70 LEU CA C 70 58.300 58.088 0.212 1
1 802 . 18 1 1 A 70 70 LEU CB C 70 41.500 41.348 0.152 1
1 806 . 18 1 1 A 70 70 LEU N N 70 121.200 119.377 1.823 1
1 807 . 18 1 1 A 71 71 ASP H H 71 8.140 7.947 0.193 1
1 808 . 18 1 1 A 71 71 ASP HA H 71 4.420 4.496 -0.076 1
1 811 . 18 1 1 A 71 71 ASP C C 71 180.000 178.266 1.734 1
1 812 . 18 1 1 A 71 71 ASP CA C 71 57.300 57.306 -0.006 1
1 813 . 18 1 1 A 71 71 ASP CB C 71 39.300 41.169 -1.869 1
1 814 . 18 1 1 A 71 71 ASP N N 71 121.100 119.159 1.941 1
1 815 . 18 1 1 A 72 72 TYR H H 72 8.320 8.629 -0.309 1
1 816 . 18 1 1 A 72 72 TYR HA H 72 4.550 4.515 0.035 1
1 823 . 18 1 1 A 72 72 TYR C C 72 179.100 178.555 0.545 1
1 824 . 18 1 1 A 72 72 TYR CA C 72 60.500 60.657 -0.157 1
1 825 . 18 1 1 A 72 72 TYR CB C 72 37.600 38.161 -0.561 1
1 828 . 18 1 1 A 72 72 TYR N N 72 120.300 118.091 2.209 1
1 829 . 18 1 1 A 73 73 CYS H H 73 8.850 8.539 0.311 1
1 830 . 18 1 1 A 73 73 CYS HA H 73 4.380 4.566 -0.186 1
1 834 . 18 1 1 A 73 73 CYS C C 73 177.300 177.209 0.091 1
1 835 . 18 1 1 A 73 73 CYS CA C 73 64.400 63.583 0.817 1
1 836 . 18 1 1 A 73 73 CYS CB C 73 27.600 27.102 0.498 1
1 837 . 18 1 1 A 73 73 CYS N N 73 116.800 118.700 -1.900 1
1 838 . 18 1 1 A 74 74 SER H H 74 8.410 8.500 -0.090 1
1 839 . 18 1 1 A 74 74 SER HA H 74 4.290 4.220 0.070 1
1 842 . 18 1 1 A 74 74 SER C C 74 176.300 176.988 -0.688 1
1 843 . 18 1 1 A 74 74 SER CA C 74 61.400 61.255 0.145 1
1 844 . 18 1 1 A 74 74 SER CB C 74 62.600 62.554 0.046 1
1 845 . 18 1 1 A 74 74 SER N N 74 115.900 117.063 -1.163 1
1 846 . 18 1 1 A 75 75 GLY H H 75 7.790 8.196 -0.406 1
1 847 . 18 1 1 A 75 75 GLY HA2 H 75 4.320 3.704 0.616 1
1 848 . 18 1 1 A 75 75 GLY HA3 H 75 3.900 3.709 0.191 1
1 849 . 18 1 1 A 75 75 GLY C C 75 174.600 175.212 -0.612 1
1 850 . 18 1 1 A 75 75 GLY CA C 75 45.600 47.175 -1.575 1
1 851 . 18 1 1 A 75 75 GLY N N 75 107.500 109.546 -2.046 1
1 852 . 18 1 1 A 76 76 TYR H H 76 8.040 8.396 -0.356 1
1 853 . 18 1 1 A 76 76 TYR HA H 76 4.310 4.060 0.250 1
1 860 . 18 1 1 A 76 76 TYR C C 76 176.200 177.788 -1.588 1
1 861 . 18 1 1 A 76 76 TYR CA C 76 60.000 61.119 -1.119 1
1 862 . 18 1 1 A 76 76 TYR CB C 76 40.700 38.753 1.947 1
1 865 . 18 1 1 A 76 76 TYR N N 76 121.900 123.347 -1.447 1
1 866 . 18 1 1 A 77 77 VAL H H 77 7.540 8.405 -0.865 1
1 867 . 18 1 1 A 77 77 VAL HA H 77 3.450 3.538 -0.088 1
1 875 . 18 1 1 A 77 77 VAL C C 77 175.500 177.194 -1.694 1
1 876 . 18 1 1 A 77 77 VAL CA C 77 65.500 64.261 1.239 1
1 877 . 18 1 1 A 77 77 VAL CB C 77 31.600 31.288 0.312 1
1 880 . 18 1 1 A 77 77 VAL N N 77 116.600 119.268 -2.668 1
1 881 . 18 1 1 A 78 78 ASP H H 78 7.580 8.054 -0.474 1
1 882 . 18 1 1 A 78 78 ASP HA H 78 4.380 4.386 -0.006 1
1 885 . 18 1 1 A 78 78 ASP C C 78 177.000 177.877 -0.877 1
1 886 . 18 1 1 A 78 78 ASP CA C 78 55.800 56.589 -0.789 1
1 887 . 18 1 1 A 78 78 ASP CB C 78 39.900 40.943 -1.043 1
1 888 . 18 1 1 A 78 78 ASP N N 78 116.400 120.942 -4.542 1
1 889 . 18 1 1 A 79 79 CYS H H 79 8.040 7.392 0.648 1
1 890 . 18 1 1 A 79 79 CYS HA H 79 4.110 4.401 -0.291 1
1 893 . 18 1 1 A 79 79 CYS C C 79 174.200 174.652 -0.452 1
1 894 . 18 1 1 A 79 79 CYS CA C 79 58.600 58.905 -0.305 1
1 895 . 18 1 1 A 79 79 CYS CB C 79 27.200 28.317 -1.117 1
1 896 . 18 1 1 A 79 79 CYS N N 79 117.000 116.208 0.792 1
1 897 . 18 1 1 A 80 80 ILE H H 80 6.960 7.000 -0.040 1
1 898 . 18 1 1 A 80 80 ILE HA H 80 4.120 4.086 0.034 1
1 908 . 18 1 1 A 80 80 ILE CA C 80 58.700 59.800 -1.100 1
1 909 . 18 1 1 A 80 80 ILE CB C 80 38.500 38.054 0.446 1
1 913 . 18 1 1 A 80 80 ILE N N 80 123.200 122.134 1.066 1
1 914 . 18 1 1 A 81 81 PRO HA H 81 4.340 4.378 -0.038 1
1 921 . 18 1 1 A 81 81 PRO C C 81 178.000 177.078 0.922 1
1 922 . 18 1 1 A 81 81 PRO CA C 81 64.700 64.907 -0.207 1
1 923 . 18 1 1 A 81 81 PRO CB C 81 32.600 32.081 0.519 1
1 926 . 18 1 1 A 82 82 GLN H H 82 7.560 7.971 -0.411 1
1 927 . 18 1 1 A 82 82 GLN HA H 82 4.600 4.296 0.304 1
1 934 . 18 1 1 A 82 82 GLN C C 82 177.400 176.340 1.060 1
1 935 . 18 1 1 A 82 82 GLN CA C 82 55.600 55.867 -0.267 1
1 936 . 18 1 1 A 82 82 GLN CB C 82 28.800 28.668 0.132 1
1 938 . 18 1 1 A 82 82 GLN N N 82 115.900 117.899 -1.999 1
1 940 . 18 1 1 A 83 83 THR H H 83 8.880 8.296 0.584 1
1 941 . 18 1 1 A 83 83 THR HA H 83 3.750 3.939 -0.189 1
1 946 . 18 1 1 A 83 83 THR C C 83 176.300 176.370 -0.070 1
1 947 . 18 1 1 A 83 83 THR CA C 83 66.500 66.555 -0.055 1
1 948 . 18 1 1 A 83 83 THR CB C 83 68.700 68.795 -0.095 1
1 950 . 18 1 1 A 83 83 THR N N 83 122.700 119.232 3.468 1
1 951 . 18 1 1 A 84 84 ARG H H 84 8.990 8.184 0.806 1
1 952 . 18 1 1 A 84 84 ARG HA H 84 4.250 4.047 0.203 1
1 960 . 18 1 1 A 84 84 ARG C C 84 178.900 179.325 -0.425 1
1 961 . 18 1 1 A 84 84 ARG CA C 84 59.100 59.651 -0.551 1
1 962 . 18 1 1 A 84 84 ARG CB C 84 29.300 30.296 -0.996 1
1 965 . 18 1 1 A 84 84 ARG N N 84 120.100 121.556 -1.456 1
1 967 . 18 1 1 A 85 85 ASN H H 85 7.270 8.289 -1.019 1
1 968 . 18 1 1 A 85 85 ASN HA H 85 4.810 4.641 0.169 1
1 973 . 18 1 1 A 85 85 ASN C C 85 176.800 177.629 -0.829 1
1 974 . 18 1 1 A 85 85 ASN CA C 85 54.800 56.205 -1.405 1
1 975 . 18 1 1 A 85 85 ASN CB C 85 37.600 37.842 -0.242 1
1 976 . 18 1 1 A 85 85 ASN N N 85 117.400 118.340 -0.940 1
1 978 . 18 1 1 A 86 86 LYS H H 86 8.340 8.085 0.255 1
1 979 . 18 1 1 A 86 86 LYS HA H 86 3.890 4.057 -0.167 1
1 988 . 18 1 1 A 86 86 LYS C C 86 178.600 179.070 -0.470 1
1 989 . 18 1 1 A 86 86 LYS CA C 86 60.800 59.092 1.708 1
1 990 . 18 1 1 A 86 86 LYS CB C 86 32.700 32.161 0.539 1
1 994 . 18 1 1 A 86 86 LYS N N 86 124.200 120.653 3.547 1
1 995 . 18 1 1 A 87 87 PHE H H 87 8.120 8.610 -0.490 1
1 996 . 18 1 1 A 87 87 PHE HA H 87 4.260 4.195 0.065 1
1 1004 . 18 1 1 A 87 87 PHE C C 87 178.100 177.660 0.440 1
1 1005 . 18 1 1 A 87 87 PHE CA C 87 61.300 61.715 -0.415 1
1 1006 . 18 1 1 A 87 87 PHE CB C 87 38.200 39.214 -1.014 1
1 1010 . 18 1 1 A 87 87 PHE N N 87 118.300 120.844 -2.544 1
1 1011 . 18 1 1 A 88 88 ALA H H 88 7.860 8.470 -0.610 1
1 1012 . 18 1 1 A 88 88 ALA HA H 88 4.200 4.094 0.106 1
1 1016 . 18 1 1 A 88 88 ALA C C 88 180.600 179.787 0.813 1
1 1017 . 18 1 1 A 88 88 ALA CA C 88 54.900 55.109 -0.209 1
1 1018 . 18 1 1 A 88 88 ALA CB C 88 18.100 18.013 0.087 1
1 1019 . 18 1 1 A 88 88 ALA N N 88 121.700 120.960 0.740 1
1 1020 . 18 1 1 A 89 89 PHE H H 89 8.690 8.461 0.229 1
1 1021 . 18 1 1 A 89 89 PHE HA H 89 4.080 4.125 -0.045 1
1 1029 . 18 1 1 A 89 89 PHE C C 89 176.300 177.701 -1.401 1
1 1030 . 18 1 1 A 89 89 PHE CA C 89 62.000 61.273 0.727 1
1 1031 . 18 1 1 A 89 89 PHE CB C 89 39.800 39.216 0.584 1
1 1035 . 18 1 1 A 89 89 PHE N N 89 120.100 120.145 -0.045 1
1 1036 . 18 1 1 A 90 90 ARG H H 90 8.560 8.275 0.285 1
1 1037 . 18 1 1 A 90 90 ARG HA H 90 3.790 3.909 -0.119 1
1 1045 . 18 1 1 A 90 90 ARG C C 90 179.600 178.134 1.466 1
1 1046 . 18 1 1 A 90 90 ARG CA C 90 60.000 59.622 0.378 1
1 1047 . 18 1 1 A 90 90 ARG CB C 90 30.000 30.101 -0.101 1
1 1050 . 18 1 1 A 90 90 ARG N N 90 118.000 118.138 -0.138 1
1 1052 . 18 1 1 A 91 91 GLU H H 91 8.120 8.228 -0.108 1
1 1053 . 18 1 1 A 91 91 GLU HA H 91 3.980 3.931 0.049 1
1 1058 . 18 1 1 A 91 91 GLU C C 91 178.400 178.947 -0.547 1
1 1059 . 18 1 1 A 91 91 GLU CA C 91 58.900 59.211 -0.311 1
1 1060 . 18 1 1 A 91 91 GLU CB C 91 28.800 29.146 -0.346 1
1 1062 . 18 1 1 A 91 91 GLU N N 91 119.300 118.015 1.285 1
1 1063 . 18 1 1 A 92 92 ALA H H 92 7.820 7.727 0.093 1
1 1064 . 18 1 1 A 92 92 ALA HA H 92 4.050 3.941 0.109 1
1 1068 . 18 1 1 A 92 92 ALA C C 92 179.800 179.953 -0.153 1
1 1069 . 18 1 1 A 92 92 ALA CA C 92 55.000 55.216 -0.216 1
1 1070 . 18 1 1 A 92 92 ALA CB C 92 18.000 18.002 -0.002 1
1 1071 . 18 1 1 A 92 92 ALA N N 92 123.400 122.077 1.323 1
1 1072 . 18 1 1 A 93 93 VAL H H 93 8.430 7.939 0.491 1
1 1073 . 18 1 1 A 93 93 VAL HA H 93 3.250 3.315 -0.065 1
1 1081 . 18 1 1 A 93 93 VAL C C 93 177.900 177.619 0.281 1
1 1082 . 18 1 1 A 93 93 VAL CA C 93 66.800 66.712 0.088 1
1 1083 . 18 1 1 A 93 93 VAL CB C 93 31.300 31.331 -0.031 1
1 1086 . 18 1 1 A 93 93 VAL N N 93 119.900 118.543 1.357 1
1 1087 . 18 1 1 A 94 94 SER H H 94 7.990 7.975 0.015 1
1 1088 . 18 1 1 A 94 94 SER HA H 94 4.230 4.169 0.061 1
1 1091 . 18 1 1 A 94 94 SER C C 94 177.200 177.429 -0.229 1
1 1092 . 18 1 1 A 94 94 SER CA C 94 61.600 61.606 -0.006 1
1 1093 . 18 1 1 A 94 94 SER CB C 94 62.700 62.956 -0.256 1
1 1094 . 18 1 1 A 94 94 SER N N 94 116.000 115.439 0.561 1
1 1095 . 18 1 1 A 95 95 LYS H H 95 7.710 7.942 -0.232 1
1 1096 . 18 1 1 A 95 95 LYS HA H 95 4.020 3.996 0.024 1
1 1105 . 18 1 1 A 95 95 LYS C C 95 179.400 179.044 0.356 1
1 1106 . 18 1 1 A 95 95 LYS CA C 95 59.600 59.401 0.199 1
1 1107 . 18 1 1 A 95 95 LYS CB C 95 32.300 32.582 -0.282 1
1 1111 . 18 1 1 A 95 95 LYS N N 95 121.400 121.458 -0.058 1
1 1112 . 18 1 1 A 96 96 LEU H H 96 8.270 8.018 0.252 1
1 1113 . 18 1 1 A 96 96 LEU HA H 96 4.040 3.927 0.113 1
1 1123 . 18 1 1 A 96 96 LEU C C 96 177.700 178.258 -0.558 1
1 1124 . 18 1 1 A 96 96 LEU CA C 96 58.600 58.227 0.373 1
1 1125 . 18 1 1 A 96 96 LEU CB C 96 41.000 41.685 -0.685 1
1 1129 . 18 1 1 A 96 96 LEU N N 96 124.800 120.669 4.131 1
1 1130 . 18 1 1 A 97 97 GLU H H 97 8.500 8.379 0.121 1
1 1131 . 18 1 1 A 97 97 GLU HA H 97 3.760 4.066 -0.306 1
1 1136 . 18 1 1 A 97 97 GLU C C 97 179.100 179.103 -0.003 1
1 1137 . 18 1 1 A 97 97 GLU CA C 97 59.900 59.013 0.887 1
1 1138 . 18 1 1 A 97 97 GLU CB C 97 28.700 29.196 -0.496 1
1 1140 . 18 1 1 A 97 97 GLU N N 97 119.000 117.378 1.622 1
1 1141 . 18 1 1 A 98 98 LEU H H 98 7.740 8.401 -0.661 1
1 1142 . 18 1 1 A 98 98 LEU HA H 98 4.110 3.980 0.130 1
1 1152 . 18 1 1 A 98 98 LEU C C 98 179.700 179.267 0.433 1
1 1153 . 18 1 1 A 98 98 LEU CA C 98 57.900 57.906 -0.006 1
1 1154 . 18 1 1 A 98 98 LEU CB C 98 41.800 41.759 0.041 1
1 1158 . 18 1 1 A 98 98 LEU N N 98 119.200 121.425 -2.225 1
1 1159 . 18 1 1 A 99 99 SER H H 99 8.290 8.169 0.121 1
1 1160 . 18 1 1 A 99 99 SER HA H 99 4.220 4.168 0.052 1
1 1163 . 18 1 1 A 99 99 SER C C 99 176.600 176.746 -0.146 1
1 1164 . 18 1 1 A 99 99 SER CA C 99 62.400 62.413 -0.013 1
1 1165 . 18 1 1 A 99 99 SER CB C 99 63.200 62.692 0.508 1
1 1166 . 18 1 1 A 99 99 SER N N 99 116.300 113.916 2.384 1
1 1167 . 18 1 1 A 100 100 LEU H H 100 8.490 8.082 0.408 1
1 1168 . 18 1 1 A 100 100 LEU HA H 100 3.960 3.955 0.005 1
1 1178 . 18 1 1 A 100 100 LEU C C 100 179.300 179.869 -0.569 1
1 1179 . 18 1 1 A 100 100 LEU CA C 100 57.700 57.862 -0.162 1
1 1180 . 18 1 1 A 100 100 LEU CB C 100 41.300 40.953 0.347 1
1 1184 . 18 1 1 A 100 100 LEU N N 100 120.900 123.037 -2.137 1
1 1185 . 18 1 1 A 101 101 GLN H H 101 7.680 8.696 -1.016 1
1 1186 . 18 1 1 A 101 101 GLN HA H 101 4.100 3.973 0.127 1
1 1193 . 18 1 1 A 101 101 GLN C C 101 178.700 177.810 0.890 1
1 1194 . 18 1 1 A 101 101 GLN CA C 101 58.800 58.860 -0.060 1
1 1195 . 18 1 1 A 101 101 GLN CB C 101 27.900 27.755 0.145 1
1 1197 . 18 1 1 A 101 101 GLN N N 101 119.100 118.017 1.083 1
1 1199 . 18 1 1 A 102 102 GLU H H 102 7.850 8.098 -0.248 1
1 1200 . 18 1 1 A 102 102 GLU HA H 102 4.050 4.110 -0.060 1
1 1205 . 18 1 1 A 102 102 GLU C C 102 179.100 178.864 0.236 1
1 1206 . 18 1 1 A 102 102 GLU CA C 102 58.400 59.312 -0.912 1
1 1207 . 18 1 1 A 102 102 GLU CB C 102 28.600 29.043 -0.443 1
1 1209 . 18 1 1 A 102 102 GLU N N 102 118.400 118.885 -0.485 1
1 1210 . 18 1 1 A 103 103 LEU H H 103 8.080 8.001 0.079 1
1 1211 . 18 1 1 A 103 103 LEU HA H 103 4.020 3.968 0.052 1
1 1221 . 18 1 1 A 103 103 LEU C C 103 178.200 178.354 -0.154 1
1 1222 . 18 1 1 A 103 103 LEU CA C 103 57.000 58.161 -1.161 1
1 1223 . 18 1 1 A 103 103 LEU CB C 103 41.900 41.888 0.012 1
1 1227 . 18 1 1 A 103 103 LEU N N 103 120.600 123.348 -2.748 1
1 1228 . 18 1 1 A 104 104 GLN H H 104 7.900 8.337 -0.437 1
1 1229 . 18 1 1 A 104 104 GLN HA H 104 4.090 4.083 0.007 1
1 1236 . 18 1 1 A 104 104 GLN C C 104 177.300 177.016 0.284 1
1 1237 . 18 1 1 A 104 104 GLN CA C 104 58.100 58.175 -0.075 1
1 1238 . 18 1 1 A 104 104 GLN CB C 104 29.400 27.936 1.464 1
1 1240 . 18 1 1 A 104 104 GLN N N 104 117.700 116.751 0.949 1
1 1242 . 18 1 1 A 105 105 VAL H H 105 7.620 7.340 0.280 1
1 1243 . 18 1 1 A 105 105 VAL HA H 105 4.190 4.177 0.013 1
1 1251 . 18 1 1 A 105 105 VAL C C 105 176.800 176.874 -0.074 1
1 1252 . 18 1 1 A 105 105 VAL CA C 105 62.600 63.099 -0.499 1
1 1253 . 18 1 1 A 105 105 VAL CB C 105 32.000 32.638 -0.638 1
1 1256 . 18 1 1 A 105 105 VAL N N 105 114.900 116.426 -1.526 1
1 1257 . 18 1 1 A 106 106 SER H H 106 7.900 7.695 0.205 1
1 1258 . 18 1 1 A 106 106 SER HA H 106 4.460 4.891 -0.431 1
1 1261 . 18 1 1 A 106 106 SER C C 106 175.000 175.198 -0.198 1
1 1262 . 18 1 1 A 106 106 SER CA C 106 58.900 57.896 1.004 1
1 1263 . 18 1 1 A 106 106 SER CB C 106 63.900 63.661 0.239 1
1 1264 . 18 1 1 A 106 106 SER N N 106 116.900 117.369 -0.469 1
1 1265 . 18 1 1 A 107 107 SER H H 107 8.230 7.815 0.415 1
1 1266 . 18 1 1 A 107 107 SER HA H 107 4.390 4.096 0.294 1
1 1269 . 18 1 1 A 107 107 SER C C 107 174.600 174.826 -0.226 1
1 1270 . 18 1 1 A 107 107 SER CA C 107 58.400 61.173 -2.773 1
1 1271 . 18 1 1 A 107 107 SER CB C 107 63.600 63.035 0.565 1
1 1272 . 18 1 1 A 107 107 SER N N 107 117.500 116.943 0.557 1
1 1273 . 18 1 1 A 108 108 ALA H H 108 8.080 7.954 0.126 1
1 1274 . 18 1 1 A 108 108 ALA HA H 108 4.280 3.965 0.315 1
1 1278 . 18 1 1 A 108 108 ALA C C 108 177.500 175.840 1.660 1
1 1279 . 18 1 1 A 108 108 ALA CA C 108 52.700 53.399 -0.699 1
1 1280 . 18 1 1 A 108 108 ALA CB C 108 19.200 18.001 1.199 1
1 1281 . 18 1 1 A 108 108 ALA N N 108 124.900 120.902 3.998 1
1 1282 . 18 1 1 A 109 109 ALA H H 109 8.080 7.398 0.682 1
1 1283 . 18 1 1 A 109 109 ALA HA H 109 4.280 4.457 -0.177 1
1 1287 . 18 1 1 A 109 109 ALA C C 109 177.700 176.300 1.400 1
1 1288 . 18 1 1 A 109 109 ALA CA C 109 52.400 51.402 0.998 1
1 1289 . 18 1 1 A 109 109 ALA CB C 109 19.400 22.170 -2.770 1
1 1290 . 18 1 1 A 109 109 ALA N N 109 123.000 116.522 6.478 1
1 1291 . 18 1 1 A 110 110 ALA H H 110 8.300 8.622 -0.322 1
1 1292 . 18 1 1 A 110 110 ALA HA H 110 4.280 4.494 -0.214 1
1 1296 . 18 1 1 A 110 110 ALA C C 110 178.200 178.057 0.143 1
1 1297 . 18 1 1 A 110 110 ALA CA C 110 52.700 52.925 -0.225 1
1 1298 . 18 1 1 A 110 110 ALA CB C 110 19.200 20.505 -1.305 1
1 1299 . 18 1 1 A 110 110 ALA N N 110 123.200 120.767 2.433 1
1 1300 . 18 1 1 A 111 111 GLY H H 111 8.300 7.412 0.888 1
1 1301 . 18 1 1 A 111 111 GLY HA2 H 111 3.930 4.063 -0.133 1
1 1302 . 18 1 1 A 111 111 GLY HA3 H 111 3.940 4.065 -0.125 1
1 1303 . 18 1 1 A 111 111 GLY C C 111 173.700 172.503 1.197 1
1 1304 . 18 1 1 A 111 111 GLY CA C 111 45.100 45.766 -0.666 1
1 1305 . 18 1 1 A 111 111 GLY N N 111 108.000 102.688 5.312 1
1 1306 . 18 1 1 A 112 112 VAL H H 112 7.930 8.650 -0.720 1
1 1307 . 18 1 1 A 112 112 VAL HA H 112 4.420 4.566 -0.146 1
1 1315 . 18 1 1 A 112 112 VAL CA C 112 60.000 58.942 1.058 1
1 1316 . 18 1 1 A 112 112 VAL CB C 112 32.200 35.262 -3.062 1
1 1319 . 18 1 1 A 112 112 VAL N N 112 120.400 122.259 -1.859 1
1 1320 . 18 1 1 A 113 113 PRO HA H 113 4.370 4.705 -0.335 1
1 1327 . 18 1 1 A 113 113 PRO C C 113 177.300 178.055 -0.755 1
1 1328 . 18 1 1 A 113 113 PRO CA C 113 63.900 62.733 1.167 1
1 1329 . 18 1 1 A 113 113 PRO CB C 113 31.800 32.527 -0.727 1
1 1332 . 18 1 1 A 114 114 GLY H H 114 8.570 8.723 -0.153 1
1 1333 . 18 1 1 A 114 114 GLY HA2 H 114 3.880 3.893 -0.013 1
1 1334 . 18 1 1 A 114 114 GLY HA3 H 114 4.120 3.894 0.226 1
1 1335 . 18 1 1 A 114 114 GLY C C 114 174.900 175.119 -0.219 1
1 1336 . 18 1 1 A 114 114 GLY CA C 114 45.200 45.434 -0.234 1
1 1337 . 18 1 1 A 114 114 GLY N N 114 109.000 111.390 -2.390 1
1 1338 . 18 1 1 A 115 115 THR H H 115 7.900 7.853 0.047 1
1 1339 . 18 1 1 A 115 115 THR HA H 115 4.400 4.069 0.331 1
1 1344 . 18 1 1 A 115 115 THR C C 115 174.300 173.542 0.758 1
1 1345 . 18 1 1 A 115 115 THR CA C 115 61.700 64.532 -2.832 1
1 1346 . 18 1 1 A 115 115 THR CB C 115 69.700 69.433 0.267 1
1 1348 . 18 1 1 A 115 115 THR N N 115 111.400 115.888 -4.488 1
1 1349 . 18 1 1 A 116 116 ASN H H 116 8.450 8.019 0.431 1
1 1350 . 18 1 1 A 116 116 ASN HA H 116 4.970 5.165 -0.195 1
1 1355 . 18 1 1 A 116 116 ASN CA C 116 51.500 49.512 1.988 1
1 1356 . 18 1 1 A 116 116 ASN CB C 116 38.900 39.951 -1.051 1
1 1357 . 18 1 1 A 116 116 ASN N N 116 123.100 116.847 6.253 1
1 1359 . 18 1 1 A 117 117 PRO HA H 117 4.370 4.344 0.026 1
1 1366 . 18 1 1 A 117 117 PRO C C 117 178.400 178.186 0.214 1
1 1367 . 18 1 1 A 117 117 PRO CA C 117 64.800 64.565 0.235 1
1 1368 . 18 1 1 A 117 117 PRO CB C 117 32.100 32.070 0.030 1
1 1371 . 18 1 1 A 118 118 VAL H H 118 7.750 7.507 0.243 1
1 1372 . 18 1 1 A 118 118 VAL HA H 118 3.810 3.747 0.063 1
1 1380 . 18 1 1 A 118 118 VAL C C 118 178.300 178.107 0.193 1
1 1381 . 18 1 1 A 118 118 VAL CA C 118 65.200 65.489 -0.289 1
1 1382 . 18 1 1 A 118 118 VAL CB C 118 31.500 31.414 0.086 1
1 1385 . 18 1 1 A 118 118 VAL N N 118 118.300 116.483 1.817 1
1 1386 . 18 1 1 A 119 119 LEU H H 119 7.540 7.850 -0.310 1
1 1387 . 18 1 1 A 119 119 LEU HA H 119 4.030 3.935 0.095 1
1 1397 . 18 1 1 A 119 119 LEU C C 119 178.900 179.757 -0.857 1
1 1398 . 18 1 1 A 119 119 LEU CA C 119 57.800 58.059 -0.259 1
1 1399 . 18 1 1 A 119 119 LEU CB C 119 40.700 40.792 -0.092 1
1 1403 . 18 1 1 A 119 119 LEU N N 119 119.700 120.243 -0.543 1
1 1404 . 18 1 1 A 120 120 ASN H H 120 8.080 7.851 0.229 1
1 1405 . 18 1 1 A 120 120 ASN HA H 120 4.420 4.477 -0.057 1
1 1410 . 18 1 1 A 120 120 ASN C C 120 178.100 178.350 -0.250 1
1 1411 . 18 1 1 A 120 120 ASN CA C 120 56.100 55.962 0.138 1
1 1412 . 18 1 1 A 120 120 ASN CB C 120 37.800 38.017 -0.217 1
1 1413 . 18 1 1 A 120 120 ASN N N 120 117.700 118.864 -1.164 1
1 1415 . 18 1 1 A 121 121 ASN H H 121 8.120 8.079 0.041 1
1 1416 . 18 1 1 A 121 121 ASN HA H 121 4.490 4.379 0.111 1
1 1421 . 18 1 1 A 121 121 ASN C C 121 178.000 178.216 -0.216 1
1 1422 . 18 1 1 A 121 121 ASN CA C 121 56.100 56.425 -0.325 1
1 1423 . 18 1 1 A 121 121 ASN CB C 121 37.800 38.437 -0.637 1
1 1424 . 18 1 1 A 121 121 ASN N N 121 120.000 117.688 2.312 1
1 1426 . 18 1 1 A 122 122 LEU H H 122 8.180 8.201 -0.021 1
1 1427 . 18 1 1 A 122 122 LEU HA H 122 4.050 3.917 0.133 1
1 1437 . 18 1 1 A 122 122 LEU C C 122 173.800 178.980 -5.180 1
1 1438 . 18 1 1 A 122 122 LEU CA C 122 58.500 57.870 0.630 1
1 1439 . 18 1 1 A 122 122 LEU CB C 122 41.900 41.962 -0.062 1
1 1443 . 18 1 1 A 122 122 LEU N N 122 122.600 120.319 2.281 1
1 1444 . 18 1 1 A 123 123 LEU H H 123 8.260 7.903 0.357 1
1 1445 . 18 1 1 A 123 123 LEU HA H 123 3.850 3.966 -0.116 1
1 1455 . 18 1 1 A 123 123 LEU C C 123 178.900 178.530 0.370 1
1 1456 . 18 1 1 A 123 123 LEU CA C 123 58.500 58.067 0.433 1
1 1457 . 18 1 1 A 123 123 LEU CB C 123 41.200 41.236 -0.036 1
1 1461 . 18 1 1 A 123 123 LEU N N 123 119.700 120.390 -0.690 1
1 1462 . 18 1 1 A 124 124 SER H H 124 7.950 8.227 -0.277 1
1 1463 . 18 1 1 A 124 124 SER HA H 124 4.240 4.114 0.126 1
1 1466 . 18 1 1 A 124 124 SER C C 124 177.500 177.343 0.157 1
1 1467 . 18 1 1 A 124 124 SER CA C 124 61.600 61.672 -0.072 1
1 1468 . 18 1 1 A 124 124 SER CB C 124 62.600 62.781 -0.181 1
1 1469 . 18 1 1 A 124 124 SER N N 124 113.400 113.968 -0.568 1
1 1470 . 18 1 1 A 125 125 CYS H H 125 8.040 8.439 -0.399 1
1 1471 . 18 1 1 A 125 125 CYS HA H 125 4.350 4.087 0.263 1
1 1474 . 18 1 1 A 125 125 CYS C C 125 176.800 177.065 -0.265 1
1 1475 . 18 1 1 A 125 125 CYS CA C 125 62.600 63.549 -0.949 1
1 1476 . 18 1 1 A 125 125 CYS CB C 125 27.100 26.199 0.901 1
1 1477 . 18 1 1 A 125 125 CYS N N 125 119.800 119.416 0.384 1
1 1478 . 18 1 1 A 126 126 VAL H H 126 8.290 8.505 -0.215 1
1 1479 . 18 1 1 A 126 126 VAL HA H 126 3.430 3.455 -0.025 1
1 1487 . 18 1 1 A 126 126 VAL C C 126 177.800 177.900 -0.100 1
1 1488 . 18 1 1 A 126 126 VAL CA C 126 67.100 66.633 0.467 1
1 1489 . 18 1 1 A 126 126 VAL CB C 126 31.400 31.639 -0.239 1
1 1492 . 18 1 1 A 126 126 VAL N N 126 121.900 120.514 1.386 1
1 1493 . 18 1 1 A 127 127 GLN H H 127 8.200 8.328 -0.128 1
1 1494 . 18 1 1 A 127 127 GLN HA H 127 3.970 3.970 0.000 1
1 1501 . 18 1 1 A 127 127 GLN C C 127 178.200 178.615 -0.415 1
1 1502 . 18 1 1 A 127 127 GLN CA C 127 58.700 58.868 -0.168 1
1 1503 . 18 1 1 A 127 127 GLN CB C 127 27.800 28.183 -0.383 1
1 1505 . 18 1 1 A 127 127 GLN N N 127 119.700 117.751 1.949 1
1 1507 . 18 1 1 A 128 128 GLU H H 128 7.880 7.914 -0.034 1
1 1508 . 18 1 1 A 128 128 GLU HA H 128 4.200 4.103 0.097 1
1 1513 . 18 1 1 A 128 128 GLU C C 128 178.400 178.793 -0.393 1
1 1514 . 18 1 1 A 128 128 GLU CA C 128 59.000 58.937 0.063 1
1 1515 . 18 1 1 A 128 128 GLU CB C 128 28.400 29.531 -1.131 1
1 1517 . 18 1 1 A 128 128 GLU N N 128 119.800 119.129 0.671 1
1 1518 . 18 1 1 A 129 129 ILE H H 129 8.000 8.160 -0.160 1
1 1519 . 18 1 1 A 129 129 ILE HA H 129 3.460 3.507 -0.047 1
1 1529 . 18 1 1 A 129 129 ILE C C 129 176.800 178.142 -1.342 1
1 1530 . 18 1 1 A 129 129 ILE CA C 129 66.100 65.509 0.591 1
1 1531 . 18 1 1 A 129 129 ILE CB C 129 38.200 37.366 0.834 1
1 1535 . 18 1 1 A 129 129 ILE N N 129 119.500 120.165 -0.665 1
1 1536 . 18 1 1 A 130 130 SER H H 130 8.040 8.222 -0.182 1
1 1537 . 18 1 1 A 130 130 SER HA H 130 3.780 4.185 -0.405 1
1 1540 . 18 1 1 A 130 130 SER C C 130 176.200 176.391 -0.191 1
1 1541 . 18 1 1 A 130 130 SER CA C 130 62.100 61.639 0.461 1
1 1542 . 18 1 1 A 130 130 SER CB C 130 62.600 62.210 0.390 1
1 1543 . 18 1 1 A 130 130 SER N N 130 112.800 114.914 -2.114 1
1 1544 . 18 1 1 A 131 131 ASP H H 131 8.270 7.897 0.373 1
1 1545 . 18 1 1 A 131 131 ASP HA H 131 4.310 4.440 -0.130 1
1 1548 . 18 1 1 A 131 131 ASP C C 131 179.200 178.675 0.525 1
1 1549 . 18 1 1 A 131 131 ASP CA C 131 56.800 57.197 -0.397 1
1 1550 . 18 1 1 A 131 131 ASP CB C 131 40.900 40.951 -0.051 1
1 1551 . 18 1 1 A 131 131 ASP N N 131 119.600 122.128 -2.528 1
1 1552 . 18 1 1 A 132 132 VAL H H 132 8.470 8.178 0.292 1
1 1553 . 18 1 1 A 132 132 VAL HA H 132 3.520 3.745 -0.225 1
1 1561 . 18 1 1 A 132 132 VAL C C 132 178.700 178.547 0.153 1
1 1562 . 18 1 1 A 132 132 VAL CA C 132 66.500 66.309 0.191 1
1 1563 . 18 1 1 A 132 132 VAL CB C 132 31.500 31.738 -0.238 1
1 1566 . 18 1 1 A 132 132 VAL N N 132 118.100 119.864 -1.764 1
1 1567 . 18 1 1 A 133 133 VAL H H 133 8.140 7.670 0.470 1
1 1568 . 18 1 1 A 133 133 VAL HA H 133 3.770 3.788 -0.018 1
1 1576 . 18 1 1 A 133 133 VAL C C 133 176.500 176.438 0.062 1
1 1577 . 18 1 1 A 133 133 VAL CA C 133 65.100 66.409 -1.309 1
1 1578 . 18 1 1 A 133 133 VAL CB C 133 31.600 31.418 0.182 1
1 1581 . 18 1 1 A 133 133 VAL N N 133 117.000 120.256 -3.256 1
1 1582 . 18 1 1 A 134 134 GLN H H 134 7.490 7.749 -0.259 1
1 1583 . 18 1 1 A 134 134 GLN HA H 134 4.350 4.507 -0.157 1
1 1590 . 18 1 1 A 134 134 GLN C C 134 175.400 175.515 -0.115 1
1 1591 . 18 1 1 A 134 134 GLN CA C 134 56.700 55.528 1.172 1
1 1592 . 18 1 1 A 134 134 GLN CB C 134 30.500 29.193 1.307 1
1 1594 . 18 1 1 A 134 134 GLN N N 134 116.300 117.181 -0.881 1
1 1 . 19 1 1 A 2 2 GLY HA2 H 2 3.890 4.007 -0.117 1
1 2 . 19 1 1 A 2 2 GLY HA3 H 2 3.890 4.050 -0.160 1
1 3 . 19 1 1 A 2 2 GLY C C 2 174.200 171.980 2.220 1
1 4 . 19 1 1 A 2 2 GLY CA C 2 44.700 45.043 -0.343 1
1 5 . 19 1 1 A 3 3 HIS H H 3 8.380 8.515 -0.135 1
1 6 . 19 1 1 A 3 3 HIS HA H 3 4.610 4.893 -0.283 1
1 9 . 19 1 1 A 3 3 HIS C C 3 174.500 174.577 -0.077 1
1 10 . 19 1 1 A 3 3 HIS CA C 3 55.200 54.671 0.529 1
1 11 . 19 1 1 A 3 3 HIS CB C 3 28.800 32.577 -3.777 1
1 12 . 19 1 1 A 3 3 HIS N N 3 117.600 123.472 -5.872 1
1 13 . 19 1 1 A 4 4 HIS H H 4 8.520 8.835 -0.315 1
1 14 . 19 1 1 A 4 4 HIS HA H 4 4.640 4.692 -0.052 1
1 17 . 19 1 1 A 4 4 HIS C C 4 174.200 174.752 -0.552 1
1 18 . 19 1 1 A 4 4 HIS CA C 4 55.100 56.546 -1.446 1
1 19 . 19 1 1 A 4 4 HIS CB C 4 28.900 30.227 -1.327 1
1 20 . 19 1 1 A 4 4 HIS N N 4 119.000 122.268 -3.268 1
1 21 . 19 1 1 A 5 5 HIS H H 5 8.530 8.947 -0.417 1
1 22 . 19 1 1 A 5 5 HIS HA H 5 4.410 4.531 -0.121 1
1 25 . 19 1 1 A 5 5 HIS CA C 5 54.900 56.176 -1.276 1
1 26 . 19 1 1 A 5 5 HIS CB C 5 27.300 30.110 -2.810 1
1 27 . 19 1 1 A 5 5 HIS N N 5 121.600 120.436 1.164 1
1 28 . 19 1 1 A 6 6 HIS HA H 6 4.640 4.502 0.138 1
1 31 . 19 1 1 A 6 6 HIS C C 6 174.100 175.423 -1.323 1
1 32 . 19 1 1 A 6 6 HIS CA C 6 55.100 56.799 -1.699 1
1 33 . 19 1 1 A 6 6 HIS CB C 6 29.100 29.458 -0.358 1
1 34 . 19 1 1 A 7 7 HIS H H 7 8.690 7.758 0.932 1
1 35 . 19 1 1 A 7 7 HIS HA H 7 4.650 4.353 0.297 1
1 38 . 19 1 1 A 7 7 HIS C C 7 174.200 174.259 -0.059 1
1 39 . 19 1 1 A 7 7 HIS CA C 7 55.200 55.597 -0.397 1
1 40 . 19 1 1 A 7 7 HIS CB C 7 29.300 28.866 0.434 1
1 41 . 19 1 1 A 7 7 HIS N N 7 121.400 118.434 2.966 1
1 42 . 19 1 1 A 8 8 HIS H H 8 8.660 8.086 0.574 1
1 43 . 19 1 1 A 8 8 HIS HA H 8 4.700 5.098 -0.398 1
1 46 . 19 1 1 A 8 8 HIS C C 8 174.200 174.010 0.190 1
1 47 . 19 1 1 A 8 8 HIS CA C 8 55.000 54.286 0.714 1
1 48 . 19 1 1 A 8 8 HIS CB C 8 29.300 32.868 -3.568 1
1 49 . 19 1 1 A 8 8 HIS N N 8 120.400 119.761 0.639 1
1 50 . 19 1 1 A 9 9 SER H H 9 8.490 8.684 -0.194 1
1 51 . 19 1 1 A 9 9 SER HA H 9 4.390 4.104 0.286 1
1 54 . 19 1 1 A 9 9 SER C C 9 174.100 172.861 1.239 1
1 55 . 19 1 1 A 9 9 SER CA C 9 58.300 59.961 -1.661 1
1 56 . 19 1 1 A 9 9 SER CB C 9 63.700 61.608 2.092 1
1 57 . 19 1 1 A 9 9 SER N N 9 118.100 113.660 4.440 1
1 58 . 19 1 1 A 10 10 HIS H H 10 8.710 7.723 0.987 1
1 59 . 19 1 1 A 10 10 HIS HA H 10 4.690 4.851 -0.161 1
1 63 . 19 1 1 A 10 10 HIS C C 10 174.200 173.303 0.897 1
1 64 . 19 1 1 A 10 10 HIS CA C 10 55.200 56.093 -0.893 1
1 65 . 19 1 1 A 10 10 HIS CB C 10 28.800 32.913 -4.113 1
1 66 . 19 1 1 A 10 10 HIS N N 10 120.700 118.540 2.160 1
1 67 . 19 1 1 A 11 11 MET H H 11 8.410 8.521 -0.111 1
1 68 . 19 1 1 A 11 11 MET HA H 11 4.420 4.330 0.090 1
1 76 . 19 1 1 A 11 11 MET C C 11 175.800 176.724 -0.924 1
1 77 . 19 1 1 A 11 11 MET CA C 11 55.100 55.284 -0.184 1
1 78 . 19 1 1 A 11 11 MET CB C 11 32.800 33.412 -0.612 1
1 81 . 19 1 1 A 11 11 MET N N 11 122.300 123.248 -0.948 1
1 82 . 19 1 1 A 12 12 ALA H H 12 8.440 8.303 0.137 1
1 83 . 19 1 1 A 12 12 ALA HA H 12 4.280 4.447 -0.167 1
1 87 . 19 1 1 A 12 12 ALA C C 12 177.400 177.381 0.019 1
1 88 . 19 1 1 A 12 12 ALA CA C 12 52.400 50.588 1.812 1
1 89 . 19 1 1 A 12 12 ALA CB C 12 18.800 19.030 -0.230 1
1 90 . 19 1 1 A 12 12 ALA N N 12 125.900 120.967 4.933 1
1 91 . 19 1 1 A 13 13 ASN H H 13 8.440 7.608 0.832 1
1 92 . 19 1 1 A 13 13 ASN HA H 13 4.660 4.787 -0.127 1
1 97 . 19 1 1 A 13 13 ASN C C 13 175.900 175.522 0.378 1
1 98 . 19 1 1 A 13 13 ASN CA C 13 53.200 53.032 0.168 1
1 99 . 19 1 1 A 13 13 ASN CB C 13 38.800 36.666 2.134 1
1 100 . 19 1 1 A 13 13 ASN N N 13 118.300 117.336 0.964 1
1 102 . 19 1 1 A 14 14 GLY H H 14 8.370 8.334 0.036 1
1 103 . 19 1 1 A 14 14 GLY HA2 H 14 3.920 4.007 -0.087 1
1 104 . 19 1 1 A 14 14 GLY HA3 H 14 3.920 4.008 -0.088 1
1 105 . 19 1 1 A 14 14 GLY C C 14 174.000 174.098 -0.098 1
1 106 . 19 1 1 A 14 14 GLY CA C 14 45.200 46.312 -1.112 1
1 107 . 19 1 1 A 14 14 GLY N N 14 109.600 107.426 2.174 1
1 108 . 19 1 1 A 15 15 ALA H H 15 8.140 7.734 0.406 1
1 109 . 19 1 1 A 15 15 ALA HA H 15 4.280 4.955 -0.675 1
1 113 . 19 1 1 A 15 15 ALA C C 15 177.300 176.072 1.228 1
1 114 . 19 1 1 A 15 15 ALA CA C 15 52.500 51.117 1.383 1
1 115 . 19 1 1 A 15 15 ALA CB C 15 19.100 21.183 -2.083 1
1 116 . 19 1 1 A 15 15 ALA N N 15 123.800 121.477 2.323 1
1 117 . 19 1 1 A 16 16 ALA H H 16 8.030 8.747 -0.717 1
1 118 . 19 1 1 A 16 16 ALA HA H 16 4.280 4.443 -0.163 1
1 122 . 19 1 1 A 16 16 ALA C C 16 178.400 179.009 -0.609 1
1 123 . 19 1 1 A 16 16 ALA CA C 16 52.600 52.399 0.201 1
1 124 . 19 1 1 A 16 16 ALA CB C 16 19.100 19.169 -0.069 1
1 125 . 19 1 1 A 16 16 ALA N N 16 122.300 127.099 -4.799 1
1 126 . 19 1 1 A 17 17 GLY H H 17 8.320 8.813 -0.493 1
1 127 . 19 1 1 A 17 17 GLY HA2 H 17 3.960 3.729 0.231 1
1 128 . 19 1 1 A 17 17 GLY HA3 H 17 3.960 3.810 0.150 1
1 129 . 19 1 1 A 17 17 GLY C C 17 174.500 176.108 -1.608 1
1 130 . 19 1 1 A 17 17 GLY CA C 17 45.200 46.645 -1.445 1
1 131 . 19 1 1 A 17 17 GLY N N 17 107.800 111.264 -3.464 1
1 132 . 19 1 1 A 18 18 THR H H 18 7.970 7.999 -0.029 1
1 133 . 19 1 1 A 18 18 THR HA H 18 4.290 4.034 0.256 1
1 138 . 19 1 1 A 18 18 THR C C 18 174.600 175.675 -1.075 1
1 139 . 19 1 1 A 18 18 THR CA C 18 62.000 65.717 -3.717 1
1 140 . 19 1 1 A 18 18 THR CB C 18 69.700 68.243 1.457 1
1 142 . 19 1 1 A 18 18 THR N N 18 113.800 115.043 -1.243 1
1 143 . 19 1 1 A 19 19 LYS H H 19 8.350 7.874 0.476 1
1 144 . 19 1 1 A 19 19 LYS HA H 19 4.270 4.467 -0.197 1
1 153 . 19 1 1 A 19 19 LYS C C 19 176.600 178.836 -2.236 1
1 154 . 19 1 1 A 19 19 LYS CA C 19 56.500 57.797 -1.297 1
1 155 . 19 1 1 A 19 19 LYS CB C 19 32.800 33.485 -0.685 1
1 159 . 19 1 1 A 19 19 LYS N N 19 124.000 119.949 4.051 1
1 160 . 19 1 1 A 20 20 VAL H H 20 8.060 7.354 0.706 1
1 161 . 19 1 1 A 20 20 VAL HA H 20 3.990 3.831 0.159 1
1 169 . 19 1 1 A 20 20 VAL C C 20 175.900 177.381 -1.481 1
1 170 . 19 1 1 A 20 20 VAL CA C 20 62.400 63.859 -1.459 1
1 171 . 19 1 1 A 20 20 VAL CB C 20 32.600 31.887 0.713 1
1 174 . 19 1 1 A 20 20 VAL N N 20 121.700 118.825 2.875 1
1 175 . 19 1 1 A 21 21 ALA H H 21 8.310 7.844 0.466 1
1 176 . 19 1 1 A 21 21 ALA HA H 21 4.290 3.984 0.306 1
1 180 . 19 1 1 A 21 21 ALA C C 21 177.600 179.242 -1.642 1
1 181 . 19 1 1 A 21 21 ALA CA C 21 52.400 55.172 -2.772 1
1 182 . 19 1 1 A 21 21 ALA CB C 21 19.000 18.520 0.480 1
1 183 . 19 1 1 A 21 21 ALA N N 21 127.700 123.496 4.204 1
1 184 . 19 1 1 A 22 22 LEU H H 22 8.150 7.683 0.467 1
1 185 . 19 1 1 A 22 22 LEU HA H 22 4.280 4.304 -0.024 1
1 195 . 19 1 1 A 22 22 LEU C C 22 177.400 177.312 0.088 1
1 196 . 19 1 1 A 22 22 LEU CA C 22 55.200 54.754 0.446 1
1 197 . 19 1 1 A 22 22 LEU CB C 22 42.200 41.609 0.591 1
1 201 . 19 1 1 A 22 22 LEU N N 22 121.800 117.397 4.403 1
1 202 . 19 1 1 A 23 23 ARG H H 23 8.240 7.684 0.556 1
1 203 . 19 1 1 A 23 23 ARG HA H 23 4.290 4.347 -0.057 1
1 211 . 19 1 1 A 23 23 ARG C C 23 176.300 175.674 0.626 1
1 212 . 19 1 1 A 23 23 ARG CA C 23 56.000 55.080 0.920 1
1 213 . 19 1 1 A 23 23 ARG CB C 23 30.600 29.045 1.555 1
1 216 . 19 1 1 A 23 23 ARG N N 23 122.000 121.867 0.133 1
1 218 . 19 1 1 A 24 24 LYS H H 24 8.370 7.944 0.426 1
1 219 . 19 1 1 A 24 24 LYS HA H 24 4.330 4.528 -0.198 1
1 228 . 19 1 1 A 24 24 LYS C C 24 176.800 176.248 0.552 1
1 229 . 19 1 1 A 24 24 LYS CA C 24 56.400 57.298 -0.898 1
1 230 . 19 1 1 A 24 24 LYS CB C 24 32.700 34.944 -2.244 1
1 234 . 19 1 1 A 24 24 LYS N N 24 122.900 125.421 -2.521 1
1 235 . 19 1 1 A 25 25 THR H H 25 8.100 7.730 0.370 1
1 236 . 19 1 1 A 25 25 THR HA H 25 4.290 4.523 -0.233 1
1 241 . 19 1 1 A 25 25 THR C C 25 174.600 174.495 0.105 1
1 242 . 19 1 1 A 25 25 THR CA C 25 61.500 60.704 0.796 1
1 243 . 19 1 1 A 25 25 THR CB C 25 69.800 71.430 -1.630 1
1 245 . 19 1 1 A 25 25 THR N N 25 115.500 110.825 4.675 1
1 246 . 19 1 1 A 26 26 LYS H H 26 8.370 8.697 -0.327 1
1 247 . 19 1 1 A 26 26 LYS HA H 26 4.270 4.368 -0.098 1
1 256 . 19 1 1 A 26 26 LYS C C 26 176.600 176.878 -0.278 1
1 257 . 19 1 1 A 26 26 LYS CA C 26 56.600 55.981 0.619 1
1 258 . 19 1 1 A 26 26 LYS CB C 26 32.700 33.547 -0.847 1
1 262 . 19 1 1 A 26 26 LYS N N 26 123.700 121.537 2.163 1
1 263 . 19 1 1 A 27 27 GLN H H 27 8.390 8.840 -0.450 1
1 264 . 19 1 1 A 27 27 GLN HA H 27 4.240 4.548 -0.308 1
1 271 . 19 1 1 A 27 27 GLN C C 27 175.900 175.828 0.072 1
1 272 . 19 1 1 A 27 27 GLN CA C 27 56.100 56.256 -0.156 1
1 273 . 19 1 1 A 27 27 GLN CB C 27 29.300 29.767 -0.467 1
1 275 . 19 1 1 A 27 27 GLN N N 27 121.700 118.765 2.935 1
1 277 . 19 1 1 A 28 28 ALA H H 28 8.330 7.856 0.474 1
1 278 . 19 1 1 A 28 28 ALA HA H 28 4.240 4.515 -0.275 1
1 282 . 19 1 1 A 28 28 ALA C C 28 177.700 177.604 0.096 1
1 283 . 19 1 1 A 28 28 ALA CA C 28 52.500 51.687 0.813 1
1 284 . 19 1 1 A 28 28 ALA CB C 28 19.100 22.630 -3.530 1
1 285 . 19 1 1 A 28 28 ALA N N 28 125.400 120.031 5.369 1
1 286 . 19 1 1 A 29 29 ALA H H 29 8.250 9.043 -0.793 1
1 287 . 19 1 1 A 29 29 ALA HA H 29 4.230 3.971 0.259 1
1 291 . 19 1 1 A 29 29 ALA C C 29 178.000 179.565 -1.565 1
1 292 . 19 1 1 A 29 29 ALA CA C 29 52.500 55.086 -2.586 1
1 293 . 19 1 1 A 29 29 ALA CB C 29 19.100 18.460 0.640 1
1 294 . 19 1 1 A 29 29 ALA N N 29 123.000 126.149 -3.149 1
1 295 . 19 1 1 A 30 30 GLU H H 30 8.260 8.175 0.085 1
1 296 . 19 1 1 A 30 30 GLU HA H 30 4.220 4.142 0.078 1
1 301 . 19 1 1 A 30 30 GLU C C 30 176.500 177.431 -0.931 1
1 302 . 19 1 1 A 30 30 GLU CA C 30 56.400 58.936 -2.536 1
1 303 . 19 1 1 A 30 30 GLU CB C 30 29.500 29.247 0.253 1
1 305 . 19 1 1 A 30 30 GLU N N 30 119.700 118.230 1.470 1
1 306 . 19 1 1 A 31 31 LYS H H 31 8.230 8.139 0.091 1
1 307 . 19 1 1 A 31 31 LYS HA H 31 4.280 4.520 -0.240 1
1 316 . 19 1 1 A 31 31 LYS C C 31 176.500 176.434 0.066 1
1 317 . 19 1 1 A 31 31 LYS CA C 31 56.400 55.814 0.586 1
1 318 . 19 1 1 A 31 31 LYS CB C 31 32.800 33.540 -0.740 1
1 322 . 19 1 1 A 31 31 LYS N N 31 122.700 118.192 4.508 1
1 323 . 19 1 1 A 32 32 ILE H H 32 8.140 7.312 0.828 1
1 324 . 19 1 1 A 32 32 ILE HA H 32 4.110 4.311 -0.201 1
1 334 . 19 1 1 A 32 32 ILE C C 32 176.400 176.363 0.037 1
1 335 . 19 1 1 A 32 32 ILE CA C 32 61.200 61.020 0.180 1
1 336 . 19 1 1 A 32 32 ILE CB C 32 38.600 38.212 0.388 1
1 340 . 19 1 1 A 32 32 ILE N N 32 122.300 121.408 0.892 1
1 341 . 19 1 1 A 33 33 SER H H 33 8.230 9.060 -0.830 1
1 342 . 19 1 1 A 33 33 SER HA H 33 4.400 4.057 0.343 1
1 345 . 19 1 1 A 33 33 SER C C 33 174.800 176.605 -1.805 1
1 346 . 19 1 1 A 33 33 SER CA C 33 58.300 61.411 -3.111 1
1 347 . 19 1 1 A 33 33 SER CB C 33 63.700 62.580 1.120 1
1 348 . 19 1 1 A 33 33 SER N N 33 119.600 124.365 -4.765 1
1 349 . 19 1 1 A 34 34 ALA H H 34 8.430 8.237 0.193 1
1 350 . 19 1 1 A 34 34 ALA HA H 34 4.220 4.068 0.152 1
1 354 . 19 1 1 A 34 34 ALA C C 34 179.500 179.454 0.046 1
1 355 . 19 1 1 A 34 34 ALA CA C 34 53.500 55.312 -1.812 1
1 356 . 19 1 1 A 34 34 ALA CB C 34 18.800 18.601 0.199 1
1 357 . 19 1 1 A 34 34 ALA N N 34 126.000 122.931 3.069 1
1 358 . 19 1 1 A 35 35 ASP H H 35 8.380 8.158 0.222 1
1 359 . 19 1 1 A 35 35 ASP HA H 35 4.520 4.632 -0.112 1
1 362 . 19 1 1 A 35 35 ASP C C 35 176.500 178.475 -1.975 1
1 363 . 19 1 1 A 35 35 ASP CA C 35 54.800 56.798 -1.998 1
1 364 . 19 1 1 A 35 35 ASP CB C 35 40.200 40.768 -0.568 1
1 365 . 19 1 1 A 35 35 ASP N N 35 118.200 118.193 0.007 1
1 366 . 19 1 1 A 36 36 LYS H H 36 8.000 7.843 0.157 1
1 367 . 19 1 1 A 36 36 LYS HA H 36 4.270 4.081 0.189 1
1 376 . 19 1 1 A 36 36 LYS C C 36 177.000 177.325 -0.325 1
1 377 . 19 1 1 A 36 36 LYS CA C 36 56.800 59.055 -2.255 1
1 378 . 19 1 1 A 36 36 LYS CB C 36 32.900 31.840 1.060 1
1 382 . 19 1 1 A 36 36 LYS N N 36 120.900 118.170 2.730 1
1 383 . 19 1 1 A 37 37 ILE H H 37 7.970 7.646 0.324 1
1 384 . 19 1 1 A 37 37 ILE HA H 37 4.020 4.008 0.012 1
1 394 . 19 1 1 A 37 37 ILE C C 37 176.100 175.391 0.709 1
1 395 . 19 1 1 A 37 37 ILE CA C 37 61.300 62.453 -1.153 1
1 396 . 19 1 1 A 37 37 ILE CB C 37 38.100 37.877 0.223 1
1 400 . 19 1 1 A 37 37 ILE N N 37 121.800 121.008 0.792 1
1 401 . 19 1 1 A 38 38 SER H H 38 7.980 8.498 -0.518 1
1 402 . 19 1 1 A 38 38 SER HA H 38 4.540 4.723 -0.183 1
1 405 . 19 1 1 A 38 38 SER C C 38 174.700 174.962 -0.262 1
1 406 . 19 1 1 A 38 38 SER CA C 38 58.200 57.033 1.167 1
1 407 . 19 1 1 A 38 38 SER CB C 38 64.400 65.588 -1.188 1
1 408 . 19 1 1 A 38 38 SER N N 38 119.000 124.386 -5.386 1
1 409 . 19 1 1 A 39 39 LYS H H 39 8.690 8.781 -0.091 1
1 410 . 19 1 1 A 39 39 LYS HA H 39 3.400 3.551 -0.151 1
1 419 . 19 1 1 A 39 39 LYS C C 39 177.400 178.059 -0.659 1
1 420 . 19 1 1 A 39 39 LYS CA C 39 59.800 60.177 -0.377 1
1 421 . 19 1 1 A 39 39 LYS CB C 39 32.400 32.266 0.134 1
1 425 . 19 1 1 A 39 39 LYS N N 39 124.200 124.312 -0.112 1
1 426 . 19 1 1 A 40 40 GLU H H 40 8.280 8.293 -0.013 1
1 427 . 19 1 1 A 40 40 GLU HA H 40 3.840 4.030 -0.190 1
1 432 . 19 1 1 A 40 40 GLU C C 40 178.400 178.852 -0.452 1
1 433 . 19 1 1 A 40 40 GLU CA C 40 59.400 59.208 0.192 1
1 434 . 19 1 1 A 40 40 GLU CB C 40 28.300 29.210 -0.910 1
1 436 . 19 1 1 A 40 40 GLU N N 40 116.300 117.330 -1.030 1
1 437 . 19 1 1 A 41 41 ALA H H 41 7.890 7.944 -0.054 1
1 438 . 19 1 1 A 41 41 ALA HA H 41 3.910 4.032 -0.122 1
1 442 . 19 1 1 A 41 41 ALA C C 41 179.900 179.583 0.317 1
1 443 . 19 1 1 A 41 41 ALA CA C 41 54.700 55.098 -0.398 1
1 444 . 19 1 1 A 41 41 ALA CB C 41 17.900 18.308 -0.408 1
1 445 . 19 1 1 A 41 41 ALA N N 41 122.300 122.462 -0.162 1
1 446 . 19 1 1 A 42 42 LEU H H 42 7.490 7.614 -0.124 1
1 447 . 19 1 1 A 42 42 LEU HA H 42 3.480 3.985 -0.505 1
1 457 . 19 1 1 A 42 42 LEU C C 42 178.900 178.488 0.412 1
1 458 . 19 1 1 A 42 42 LEU CA C 42 59.800 57.805 1.995 1
1 459 . 19 1 1 A 42 42 LEU CB C 42 42.300 41.709 0.591 1
1 463 . 19 1 1 A 42 42 LEU N N 42 121.000 119.357 1.643 1
1 464 . 19 1 1 A 43 43 LEU H H 43 8.290 7.804 0.486 1
1 465 . 19 1 1 A 43 43 LEU HA H 43 3.780 3.863 -0.083 1
1 475 . 19 1 1 A 43 43 LEU C C 43 179.400 179.092 0.308 1
1 476 . 19 1 1 A 43 43 LEU CA C 43 57.600 58.005 -0.405 1
1 477 . 19 1 1 A 43 43 LEU CB C 43 40.900 41.175 -0.275 1
1 481 . 19 1 1 A 43 43 LEU N N 43 119.200 118.150 1.050 1
1 482 . 19 1 1 A 44 44 GLU H H 44 8.330 8.550 -0.220 1
1 483 . 19 1 1 A 44 44 GLU HA H 44 4.050 3.863 0.187 1
1 488 . 19 1 1 A 44 44 GLU C C 44 178.600 179.532 -0.932 1
1 489 . 19 1 1 A 44 44 GLU CA C 44 58.900 59.700 -0.800 1
1 490 . 19 1 1 A 44 44 GLU CB C 44 28.300 29.172 -0.872 1
1 492 . 19 1 1 A 44 44 GLU N N 44 119.600 117.711 1.889 1
1 493 . 19 1 1 A 45 45 CYS H H 45 7.690 7.843 -0.153 1
1 494 . 19 1 1 A 45 45 CYS HA H 45 4.120 3.998 0.122 1
1 497 . 19 1 1 A 45 45 CYS C C 45 176.100 176.510 -0.410 1
1 498 . 19 1 1 A 45 45 CYS CA C 45 62.500 63.051 -0.551 1
1 499 . 19 1 1 A 45 45 CYS CB C 45 26.200 26.894 -0.694 1
1 500 . 19 1 1 A 45 45 CYS N N 45 120.900 118.561 2.339 1
1 501 . 19 1 1 A 46 46 ALA H H 46 8.540 8.227 0.313 1
1 502 . 19 1 1 A 46 46 ALA HA H 46 3.900 3.898 0.002 1
1 506 . 19 1 1 A 46 46 ALA C C 46 179.200 178.853 0.347 1
1 507 . 19 1 1 A 46 46 ALA CA C 46 55.500 55.614 -0.114 1
1 508 . 19 1 1 A 46 46 ALA CB C 46 16.800 17.774 -0.974 1
1 509 . 19 1 1 A 46 46 ALA N N 46 121.500 122.020 -0.520 1
1 510 . 19 1 1 A 47 47 ASP H H 47 8.460 8.295 0.165 1
1 511 . 19 1 1 A 47 47 ASP HA H 47 4.340 4.368 -0.028 1
1 514 . 19 1 1 A 47 47 ASP C C 47 178.800 178.556 0.244 1
1 515 . 19 1 1 A 47 47 ASP CA C 47 56.600 57.047 -0.447 1
1 516 . 19 1 1 A 47 47 ASP CB C 47 39.800 42.124 -2.324 1
1 517 . 19 1 1 A 47 47 ASP N N 47 119.000 118.691 0.309 1
1 518 . 19 1 1 A 48 48 LEU H H 48 8.040 7.677 0.363 1
1 519 . 19 1 1 A 48 48 LEU HA H 48 4.110 3.945 0.165 1
1 529 . 19 1 1 A 48 48 LEU C C 48 180.000 179.483 0.517 1
1 530 . 19 1 1 A 48 48 LEU CA C 48 58.000 58.214 -0.214 1
1 531 . 19 1 1 A 48 48 LEU CB C 48 41.700 41.508 0.192 1
1 535 . 19 1 1 A 48 48 LEU N N 48 123.000 119.289 3.711 1
1 536 . 19 1 1 A 49 49 LEU H H 49 8.300 7.840 0.460 1
1 537 . 19 1 1 A 49 49 LEU HA H 49 4.110 4.007 0.103 1
1 547 . 19 1 1 A 49 49 LEU C C 49 177.200 178.938 -1.738 1
1 548 . 19 1 1 A 49 49 LEU CA C 49 57.600 57.843 -0.243 1
1 549 . 19 1 1 A 49 49 LEU CB C 49 41.200 40.931 0.269 1
1 553 . 19 1 1 A 49 49 LEU N N 49 120.900 120.258 0.642 1
1 554 . 19 1 1 A 50 50 SER H H 50 8.660 7.701 0.959 1
1 555 . 19 1 1 A 50 50 SER HA H 50 4.000 4.062 -0.062 1
1 558 . 19 1 1 A 50 50 SER C C 50 176.800 177.375 -0.575 1
1 559 . 19 1 1 A 50 50 SER CA C 50 62.500 61.702 0.798 1
1 560 . 19 1 1 A 50 50 SER CB C 50 62.600 62.989 -0.389 1
1 561 . 19 1 1 A 50 50 SER N N 50 113.300 114.728 -1.428 1
1 562 . 19 1 1 A 51 51 SER H H 51 7.980 8.174 -0.194 1
1 563 . 19 1 1 A 51 51 SER HA H 51 4.220 4.258 -0.038 1
1 566 . 19 1 1 A 51 51 SER C C 51 176.300 177.106 -0.806 1
1 567 . 19 1 1 A 51 51 SER CA C 51 61.200 61.593 -0.393 1
1 568 . 19 1 1 A 51 51 SER CB C 51 62.700 62.915 -0.215 1
1 569 . 19 1 1 A 51 51 SER N N 51 115.900 115.165 0.735 1
1 570 . 19 1 1 A 52 52 ALA H H 52 8.030 8.188 -0.158 1
1 571 . 19 1 1 A 52 52 ALA HA H 52 4.130 4.163 -0.033 1
1 575 . 19 1 1 A 52 52 ALA C C 52 178.500 178.176 0.324 1
1 576 . 19 1 1 A 52 52 ALA CA C 52 54.500 54.367 0.133 1
1 577 . 19 1 1 A 52 52 ALA CB C 52 18.000 18.433 -0.433 1
1 578 . 19 1 1 A 52 52 ALA N N 52 125.400 123.305 2.095 1
1 579 . 19 1 1 A 53 53 LEU H H 53 7.710 7.327 0.383 1
1 580 . 19 1 1 A 53 53 LEU HA H 53 4.180 4.330 -0.150 1
1 590 . 19 1 1 A 53 53 LEU C C 53 177.700 178.288 -0.588 1
1 591 . 19 1 1 A 53 53 LEU CA C 53 56.500 55.115 1.385 1
1 592 . 19 1 1 A 53 53 LEU CB C 53 42.400 42.516 -0.116 1
1 596 . 19 1 1 A 53 53 LEU N N 53 113.800 116.191 -2.391 1
1 597 . 19 1 1 A 54 54 THR H H 54 7.550 7.593 -0.043 1
1 598 . 19 1 1 A 54 54 THR HA H 54 4.420 4.290 0.130 1
1 603 . 19 1 1 A 54 54 THR C C 54 174.100 174.257 -0.157 1
1 604 . 19 1 1 A 54 54 THR CA C 54 61.600 63.028 -1.428 1
1 605 . 19 1 1 A 54 54 THR CB C 54 69.300 69.244 0.056 1
1 607 . 19 1 1 A 54 54 THR N N 54 107.700 107.919 -0.219 1
1 608 . 19 1 1 A 55 55 GLU H H 55 7.750 7.838 -0.088 1
1 609 . 19 1 1 A 55 55 GLU HA H 55 4.760 4.821 -0.061 1
1 614 . 19 1 1 A 55 55 GLU CA C 55 53.400 54.251 -0.851 1
1 615 . 19 1 1 A 55 55 GLU CB C 55 30.100 31.182 -1.082 1
1 617 . 19 1 1 A 55 55 GLU N N 55 122.800 119.501 3.299 1
1 618 . 19 1 1 A 56 56 PRO HA H 56 4.670 4.766 -0.096 1
1 625 . 19 1 1 A 56 56 PRO C C 56 176.200 176.436 -0.236 1
1 626 . 19 1 1 A 56 56 PRO CA C 56 62.900 62.880 0.020 1
1 627 . 19 1 1 A 56 56 PRO CB C 56 29.200 31.681 -2.481 1
1 630 . 19 1 1 A 57 57 VAL H H 57 8.010 8.386 -0.376 1
1 631 . 19 1 1 A 57 57 VAL HA H 57 4.590 4.975 -0.385 1
1 639 . 19 1 1 A 57 57 VAL CA C 57 58.600 58.289 0.311 1
1 640 . 19 1 1 A 57 57 VAL CB C 57 32.800 34.891 -2.091 1
1 643 . 19 1 1 A 57 57 VAL N N 57 121.400 117.361 4.039 1
1 644 . 19 1 1 A 58 58 PRO HA H 58 4.450 4.889 -0.439 1
1 651 . 19 1 1 A 58 58 PRO C C 58 177.500 177.622 -0.122 1
1 652 . 19 1 1 A 58 58 PRO CA C 58 62.600 62.773 -0.173 1
1 653 . 19 1 1 A 58 58 PRO CB C 58 32.200 32.882 -0.682 1
1 656 . 19 1 1 A 59 59 ASN H H 59 8.890 8.662 0.228 1
1 657 . 19 1 1 A 59 59 ASN HA H 59 4.330 4.384 -0.054 1
1 662 . 19 1 1 A 59 59 ASN C C 59 177.600 177.639 -0.039 1
1 663 . 19 1 1 A 59 59 ASN CA C 59 56.300 56.185 0.115 1
1 664 . 19 1 1 A 59 59 ASN CB C 59 38.400 38.205 0.195 1
1 665 . 19 1 1 A 59 59 ASN N N 59 122.200 120.917 1.283 1
1 667 . 19 1 1 A 60 60 SER H H 60 8.660 7.947 0.713 1
1 668 . 19 1 1 A 60 60 SER HA H 60 4.010 4.118 -0.108 1
1 671 . 19 1 1 A 60 60 SER C C 60 176.200 177.263 -1.063 1
1 672 . 19 1 1 A 60 60 SER CA C 60 60.800 61.487 -0.687 1
1 673 . 19 1 1 A 60 60 SER CB C 60 61.500 62.864 -1.364 1
1 674 . 19 1 1 A 60 60 SER N N 60 113.200 115.660 -2.460 1
1 675 . 19 1 1 A 61 61 GLN H H 61 7.420 7.620 -0.200 1
1 676 . 19 1 1 A 61 61 GLN HA H 61 4.280 4.030 0.250 1
1 683 . 19 1 1 A 61 61 GLN C C 61 178.600 178.502 0.098 1
1 684 . 19 1 1 A 61 61 GLN CA C 61 57.900 58.879 -0.979 1
1 685 . 19 1 1 A 61 61 GLN CB C 61 28.600 28.153 0.447 1
1 687 . 19 1 1 A 61 61 GLN N N 61 122.200 120.377 1.823 1
1 689 . 19 1 1 A 62 62 LEU H H 62 7.430 7.785 -0.355 1
1 690 . 19 1 1 A 62 62 LEU HA H 62 3.850 4.037 -0.187 1
1 700 . 19 1 1 A 62 62 LEU C C 62 178.800 178.974 -0.174 1
1 701 . 19 1 1 A 62 62 LEU CA C 62 57.900 58.020 -0.120 1
1 702 . 19 1 1 A 62 62 LEU CB C 62 42.100 42.197 -0.097 1
1 706 . 19 1 1 A 62 62 LEU N N 62 120.600 119.956 0.644 1
1 707 . 19 1 1 A 63 63 VAL H H 63 8.200 8.082 0.118 1
1 708 . 19 1 1 A 63 63 VAL HA H 63 3.370 3.323 0.047 1
1 716 . 19 1 1 A 63 63 VAL C C 63 178.000 177.444 0.556 1
1 717 . 19 1 1 A 63 63 VAL CA C 63 66.600 66.816 -0.216 1
1 718 . 19 1 1 A 63 63 VAL CB C 63 31.700 31.038 0.662 1
1 721 . 19 1 1 A 63 63 VAL N N 63 118.200 117.348 0.852 1
1 722 . 19 1 1 A 64 64 ASP H H 64 7.960 8.358 -0.398 1
1 723 . 19 1 1 A 64 64 ASP HA H 64 4.460 4.384 0.076 1
1 726 . 19 1 1 A 64 64 ASP C C 64 178.100 178.568 -0.468 1
1 727 . 19 1 1 A 64 64 ASP CA C 64 57.700 57.380 0.320 1
1 728 . 19 1 1 A 64 64 ASP CB C 64 39.800 41.522 -1.722 1
1 729 . 19 1 1 A 64 64 ASP N N 64 120.200 120.154 0.046 1
1 730 . 19 1 1 A 65 65 THR H H 65 8.380 8.337 0.043 1
1 731 . 19 1 1 A 65 65 THR HA H 65 3.970 3.968 0.002 1
1 736 . 19 1 1 A 65 65 THR C C 65 176.500 177.163 -0.663 1
1 737 . 19 1 1 A 65 65 THR CA C 65 66.500 66.718 -0.218 1
1 738 . 19 1 1 A 65 65 THR CB C 65 67.800 68.001 -0.201 1
1 740 . 19 1 1 A 65 65 THR N N 65 118.100 115.043 3.057 1
1 741 . 19 1 1 A 66 66 GLY H H 66 8.900 8.240 0.660 1
1 742 . 19 1 1 A 66 66 GLY HA2 H 66 3.630 3.668 -0.038 1
1 743 . 19 1 1 A 66 66 GLY HA3 H 66 3.630 3.722 -0.092 1
1 744 . 19 1 1 A 66 66 GLY C C 66 174.200 176.558 -2.358 1
1 745 . 19 1 1 A 66 66 GLY CA C 66 47.500 47.254 0.246 1
1 746 . 19 1 1 A 66 66 GLY N N 66 110.500 107.733 2.767 1
1 747 . 19 1 1 A 67 67 HIS H H 67 8.650 7.438 1.212 1
1 748 . 19 1 1 A 67 67 HIS HA H 67 4.220 4.595 -0.375 1
1 752 . 19 1 1 A 67 67 HIS C C 67 176.900 177.843 -0.943 1
1 753 . 19 1 1 A 67 67 HIS CA C 67 59.000 58.151 0.849 1
1 754 . 19 1 1 A 67 67 HIS CB C 67 27.800 29.470 -1.670 1
1 756 . 19 1 1 A 67 67 HIS N N 67 120.100 120.210 -0.110 1
1 757 . 19 1 1 A 68 68 GLN H H 68 7.860 8.442 -0.582 1
1 758 . 19 1 1 A 68 68 GLN HA H 68 3.990 4.037 -0.047 1
1 765 . 19 1 1 A 68 68 GLN C C 68 177.800 178.113 -0.313 1
1 766 . 19 1 1 A 68 68 GLN CA C 68 58.800 58.593 0.207 1
1 767 . 19 1 1 A 68 68 GLN CB C 68 28.200 27.463 0.737 1
1 769 . 19 1 1 A 68 68 GLN N N 68 121.400 117.003 4.397 1
1 771 . 19 1 1 A 69 69 LEU H H 69 8.300 8.081 0.219 1
1 772 . 19 1 1 A 69 69 LEU HA H 69 4.330 4.152 0.178 1
1 782 . 19 1 1 A 69 69 LEU C C 69 179.300 179.216 0.084 1
1 783 . 19 1 1 A 69 69 LEU CA C 69 58.200 58.292 -0.092 1
1 784 . 19 1 1 A 69 69 LEU CB C 69 40.500 41.557 -1.057 1
1 788 . 19 1 1 A 69 69 LEU N N 69 120.300 121.945 -1.645 1
1 789 . 19 1 1 A 70 70 LEU H H 70 8.460 8.040 0.420 1
1 790 . 19 1 1 A 70 70 LEU HA H 70 3.880 4.049 -0.169 1
1 800 . 19 1 1 A 70 70 LEU C C 70 179.100 179.539 -0.439 1
1 801 . 19 1 1 A 70 70 LEU CA C 70 58.300 57.763 0.537 1
1 802 . 19 1 1 A 70 70 LEU CB C 70 41.500 40.642 0.858 1
1 806 . 19 1 1 A 70 70 LEU N N 70 121.200 118.988 2.212 1
1 807 . 19 1 1 A 71 71 ASP H H 71 8.140 7.844 0.296 1
1 808 . 19 1 1 A 71 71 ASP HA H 71 4.420 4.353 0.067 1
1 811 . 19 1 1 A 71 71 ASP C C 71 180.000 178.248 1.752 1
1 812 . 19 1 1 A 71 71 ASP CA C 71 57.300 57.383 -0.083 1
1 813 . 19 1 1 A 71 71 ASP CB C 71 39.300 40.955 -1.655 1
1 814 . 19 1 1 A 71 71 ASP N N 71 121.100 119.838 1.262 1
1 815 . 19 1 1 A 72 72 TYR H H 72 8.320 8.362 -0.042 1
1 816 . 19 1 1 A 72 72 TYR HA H 72 4.550 4.468 0.082 1
1 823 . 19 1 1 A 72 72 TYR C C 72 179.100 178.685 0.415 1
1 824 . 19 1 1 A 72 72 TYR CA C 72 60.500 60.820 -0.320 1
1 825 . 19 1 1 A 72 72 TYR CB C 72 37.600 37.827 -0.227 1
1 828 . 19 1 1 A 72 72 TYR N N 72 120.300 117.830 2.470 1
1 829 . 19 1 1 A 73 73 CYS H H 73 8.850 8.671 0.179 1
1 830 . 19 1 1 A 73 73 CYS HA H 73 4.380 4.595 -0.215 1
1 834 . 19 1 1 A 73 73 CYS C C 73 177.300 177.404 -0.104 1
1 835 . 19 1 1 A 73 73 CYS CA C 73 64.400 63.988 0.412 1
1 836 . 19 1 1 A 73 73 CYS CB C 73 27.600 26.362 1.238 1
1 837 . 19 1 1 A 73 73 CYS N N 73 116.800 118.679 -1.879 1
1 838 . 19 1 1 A 74 74 SER H H 74 8.410 7.970 0.440 1
1 839 . 19 1 1 A 74 74 SER HA H 74 4.290 4.325 -0.035 1
1 842 . 19 1 1 A 74 74 SER C C 74 176.300 176.998 -0.698 1
1 843 . 19 1 1 A 74 74 SER CA C 74 61.400 61.185 0.215 1
1 844 . 19 1 1 A 74 74 SER CB C 74 62.600 62.876 -0.276 1
1 845 . 19 1 1 A 74 74 SER N N 74 115.900 116.126 -0.226 1
1 846 . 19 1 1 A 75 75 GLY H H 75 7.790 8.469 -0.679 1
1 847 . 19 1 1 A 75 75 GLY HA2 H 75 4.320 3.595 0.725 1
1 848 . 19 1 1 A 75 75 GLY HA3 H 75 3.900 3.602 0.298 1
1 849 . 19 1 1 A 75 75 GLY C C 75 174.600 175.581 -0.981 1
1 850 . 19 1 1 A 75 75 GLY CA C 75 45.600 47.305 -1.705 1
1 851 . 19 1 1 A 75 75 GLY N N 75 107.500 107.804 -0.304 1
1 852 . 19 1 1 A 76 76 TYR H H 76 8.040 8.308 -0.268 1
1 853 . 19 1 1 A 76 76 TYR HA H 76 4.310 4.047 0.263 1
1 860 . 19 1 1 A 76 76 TYR C C 76 176.200 177.677 -1.477 1
1 861 . 19 1 1 A 76 76 TYR CA C 76 60.000 61.034 -1.034 1
1 862 . 19 1 1 A 76 76 TYR CB C 76 40.700 38.542 2.158 1
1 865 . 19 1 1 A 76 76 TYR N N 76 121.900 122.830 -0.930 1
1 866 . 19 1 1 A 77 77 VAL H H 77 7.540 8.394 -0.854 1
1 867 . 19 1 1 A 77 77 VAL HA H 77 3.450 3.357 0.093 1
1 875 . 19 1 1 A 77 77 VAL C C 77 175.500 177.235 -1.735 1
1 876 . 19 1 1 A 77 77 VAL CA C 77 65.500 64.493 1.007 1
1 877 . 19 1 1 A 77 77 VAL CB C 77 31.600 31.035 0.565 1
1 880 . 19 1 1 A 77 77 VAL N N 77 116.600 119.367 -2.767 1
1 881 . 19 1 1 A 78 78 ASP H H 78 7.580 7.815 -0.235 1
1 882 . 19 1 1 A 78 78 ASP HA H 78 4.380 4.410 -0.030 1
1 885 . 19 1 1 A 78 78 ASP C C 78 177.000 177.232 -0.232 1
1 886 . 19 1 1 A 78 78 ASP CA C 78 55.800 56.780 -0.980 1
1 887 . 19 1 1 A 78 78 ASP CB C 78 39.900 40.997 -1.097 1
1 888 . 19 1 1 A 78 78 ASP N N 78 116.400 120.753 -4.353 1
1 889 . 19 1 1 A 79 79 CYS H H 79 8.040 7.699 0.341 1
1 890 . 19 1 1 A 79 79 CYS HA H 79 4.110 4.560 -0.450 1
1 893 . 19 1 1 A 79 79 CYS C C 79 174.200 174.302 -0.102 1
1 894 . 19 1 1 A 79 79 CYS CA C 79 58.600 57.937 0.663 1
1 895 . 19 1 1 A 79 79 CYS CB C 79 27.200 28.641 -1.441 1
1 896 . 19 1 1 A 79 79 CYS N N 79 117.000 114.838 2.162 1
1 897 . 19 1 1 A 80 80 ILE H H 80 6.960 7.038 -0.078 1
1 898 . 19 1 1 A 80 80 ILE HA H 80 4.120 3.935 0.185 1
1 908 . 19 1 1 A 80 80 ILE CA C 80 58.700 59.262 -0.562 1
1 909 . 19 1 1 A 80 80 ILE CB C 80 38.500 37.638 0.862 1
1 913 . 19 1 1 A 80 80 ILE N N 80 123.200 122.969 0.231 1
1 914 . 19 1 1 A 81 81 PRO HA H 81 4.340 4.357 -0.017 1
1 921 . 19 1 1 A 81 81 PRO C C 81 178.000 176.388 1.612 1
1 922 . 19 1 1 A 81 81 PRO CA C 81 64.700 65.141 -0.441 1
1 923 . 19 1 1 A 81 81 PRO CB C 81 32.600 32.017 0.583 1
1 926 . 19 1 1 A 82 82 GLN H H 82 7.560 8.348 -0.788 1
1 927 . 19 1 1 A 82 82 GLN HA H 82 4.600 4.527 0.073 1
1 934 . 19 1 1 A 82 82 GLN C C 82 177.400 175.836 1.564 1
1 935 . 19 1 1 A 82 82 GLN CA C 82 55.600 54.835 0.765 1
1 936 . 19 1 1 A 82 82 GLN CB C 82 28.800 27.265 1.535 1
1 938 . 19 1 1 A 82 82 GLN N N 82 115.900 116.950 -1.050 1
1 940 . 19 1 1 A 83 83 THR H H 83 8.880 7.873 1.007 1
1 941 . 19 1 1 A 83 83 THR HA H 83 3.750 3.800 -0.050 1
1 946 . 19 1 1 A 83 83 THR C C 83 176.300 176.348 -0.048 1
1 947 . 19 1 1 A 83 83 THR CA C 83 66.500 66.479 0.021 1
1 948 . 19 1 1 A 83 83 THR CB C 83 68.700 68.850 -0.150 1
1 950 . 19 1 1 A 83 83 THR N N 83 122.700 118.915 3.785 1
1 951 . 19 1 1 A 84 84 ARG H H 84 8.990 8.173 0.817 1
1 952 . 19 1 1 A 84 84 ARG HA H 84 4.250 4.055 0.195 1
1 960 . 19 1 1 A 84 84 ARG C C 84 178.900 178.954 -0.054 1
1 961 . 19 1 1 A 84 84 ARG CA C 84 59.100 59.606 -0.506 1
1 962 . 19 1 1 A 84 84 ARG CB C 84 29.300 30.238 -0.938 1
1 965 . 19 1 1 A 84 84 ARG N N 84 120.100 121.486 -1.386 1
1 967 . 19 1 1 A 85 85 ASN H H 85 7.270 8.381 -1.111 1
1 968 . 19 1 1 A 85 85 ASN HA H 85 4.810 4.630 0.180 1
1 973 . 19 1 1 A 85 85 ASN C C 85 176.800 177.975 -1.175 1
1 974 . 19 1 1 A 85 85 ASN CA C 85 54.800 56.188 -1.388 1
1 975 . 19 1 1 A 85 85 ASN CB C 85 37.600 38.003 -0.403 1
1 976 . 19 1 1 A 85 85 ASN N N 85 117.400 118.243 -0.843 1
1 978 . 19 1 1 A 86 86 LYS H H 86 8.340 8.074 0.266 1
1 979 . 19 1 1 A 86 86 LYS HA H 86 3.890 4.063 -0.173 1
1 988 . 19 1 1 A 86 86 LYS C C 86 178.600 179.184 -0.584 1
1 989 . 19 1 1 A 86 86 LYS CA C 86 60.800 58.936 1.864 1
1 990 . 19 1 1 A 86 86 LYS CB C 86 32.700 32.030 0.670 1
1 994 . 19 1 1 A 86 86 LYS N N 86 124.200 120.654 3.546 1
1 995 . 19 1 1 A 87 87 PHE H H 87 8.120 8.528 -0.408 1
1 996 . 19 1 1 A 87 87 PHE HA H 87 4.260 4.202 0.058 1
1 1004 . 19 1 1 A 87 87 PHE C C 87 178.100 177.494 0.606 1
1 1005 . 19 1 1 A 87 87 PHE CA C 87 61.300 61.728 -0.428 1
1 1006 . 19 1 1 A 87 87 PHE CB C 87 38.200 39.036 -0.836 1
1 1010 . 19 1 1 A 87 87 PHE N N 87 118.300 120.987 -2.687 1
1 1011 . 19 1 1 A 88 88 ALA H H 88 7.860 8.068 -0.208 1
1 1012 . 19 1 1 A 88 88 ALA HA H 88 4.200 4.091 0.109 1
1 1016 . 19 1 1 A 88 88 ALA C C 88 180.600 179.653 0.947 1
1 1017 . 19 1 1 A 88 88 ALA CA C 88 54.900 55.072 -0.172 1
1 1018 . 19 1 1 A 88 88 ALA CB C 88 18.100 17.927 0.173 1
1 1019 . 19 1 1 A 88 88 ALA N N 88 121.700 120.864 0.836 1
1 1020 . 19 1 1 A 89 89 PHE H H 89 8.690 8.642 0.048 1
1 1021 . 19 1 1 A 89 89 PHE HA H 89 4.080 4.135 -0.055 1
1 1029 . 19 1 1 A 89 89 PHE C C 89 176.300 177.713 -1.413 1
1 1030 . 19 1 1 A 89 89 PHE CA C 89 62.000 61.322 0.678 1
1 1031 . 19 1 1 A 89 89 PHE CB C 89 39.800 39.379 0.421 1
1 1035 . 19 1 1 A 89 89 PHE N N 89 120.100 120.274 -0.174 1
1 1036 . 19 1 1 A 90 90 ARG H H 90 8.560 8.029 0.531 1
1 1037 . 19 1 1 A 90 90 ARG HA H 90 3.790 3.860 -0.070 1
1 1045 . 19 1 1 A 90 90 ARG C C 90 179.600 178.372 1.228 1
1 1046 . 19 1 1 A 90 90 ARG CA C 90 60.000 59.549 0.451 1
1 1047 . 19 1 1 A 90 90 ARG CB C 90 30.000 30.069 -0.069 1
1 1050 . 19 1 1 A 90 90 ARG N N 90 118.000 118.269 -0.269 1
1 1052 . 19 1 1 A 91 91 GLU H H 91 8.120 8.086 0.034 1
1 1053 . 19 1 1 A 91 91 GLU HA H 91 3.980 3.954 0.026 1
1 1058 . 19 1 1 A 91 91 GLU C C 91 178.400 178.601 -0.201 1
1 1059 . 19 1 1 A 91 91 GLU CA C 91 58.900 59.293 -0.393 1
1 1060 . 19 1 1 A 91 91 GLU CB C 91 28.800 29.086 -0.286 1
1 1062 . 19 1 1 A 91 91 GLU N N 91 119.300 118.106 1.194 1
1 1063 . 19 1 1 A 92 92 ALA H H 92 7.820 7.795 0.025 1
1 1064 . 19 1 1 A 92 92 ALA HA H 92 4.050 4.033 0.017 1
1 1068 . 19 1 1 A 92 92 ALA C C 92 179.800 179.529 0.271 1
1 1069 . 19 1 1 A 92 92 ALA CA C 92 55.000 55.036 -0.036 1
1 1070 . 19 1 1 A 92 92 ALA CB C 92 18.000 18.381 -0.381 1
1 1071 . 19 1 1 A 92 92 ALA N N 92 123.400 122.336 1.064 1
1 1072 . 19 1 1 A 93 93 VAL H H 93 8.430 7.956 0.474 1
1 1073 . 19 1 1 A 93 93 VAL HA H 93 3.250 3.348 -0.098 1
1 1081 . 19 1 1 A 93 93 VAL C C 93 177.900 177.900 0.000 1
1 1082 . 19 1 1 A 93 93 VAL CA C 93 66.800 66.469 0.331 1
1 1083 . 19 1 1 A 93 93 VAL CB C 93 31.300 31.299 0.001 1
1 1086 . 19 1 1 A 93 93 VAL N N 93 119.900 118.297 1.603 1
1 1087 . 19 1 1 A 94 94 SER H H 94 7.990 8.024 -0.034 1
1 1088 . 19 1 1 A 94 94 SER HA H 94 4.230 3.993 0.237 1
1 1091 . 19 1 1 A 94 94 SER C C 94 177.200 176.975 0.225 1
1 1092 . 19 1 1 A 94 94 SER CA C 94 61.600 61.157 0.443 1
1 1093 . 19 1 1 A 94 94 SER CB C 94 62.700 63.130 -0.430 1
1 1094 . 19 1 1 A 94 94 SER N N 94 116.000 116.080 -0.080 1
1 1095 . 19 1 1 A 95 95 LYS H H 95 7.710 7.476 0.234 1
1 1096 . 19 1 1 A 95 95 LYS HA H 95 4.020 4.072 -0.052 1
1 1105 . 19 1 1 A 95 95 LYS C C 95 179.400 179.142 0.258 1
1 1106 . 19 1 1 A 95 95 LYS CA C 95 59.600 59.272 0.328 1
1 1107 . 19 1 1 A 95 95 LYS CB C 95 32.300 32.295 0.005 1
1 1111 . 19 1 1 A 95 95 LYS N N 95 121.400 121.620 -0.220 1
1 1112 . 19 1 1 A 96 96 LEU H H 96 8.270 7.813 0.457 1
1 1113 . 19 1 1 A 96 96 LEU HA H 96 4.040 3.939 0.101 1
1 1123 . 19 1 1 A 96 96 LEU C C 96 177.700 178.260 -0.560 1
1 1124 . 19 1 1 A 96 96 LEU CA C 96 58.600 58.188 0.412 1
1 1125 . 19 1 1 A 96 96 LEU CB C 96 41.000 41.721 -0.721 1
1 1129 . 19 1 1 A 96 96 LEU N N 96 124.800 120.869 3.931 1
1 1130 . 19 1 1 A 97 97 GLU H H 97 8.500 8.218 0.282 1
1 1131 . 19 1 1 A 97 97 GLU HA H 97 3.760 4.088 -0.328 1
1 1136 . 19 1 1 A 97 97 GLU C C 97 179.100 179.572 -0.472 1
1 1137 . 19 1 1 A 97 97 GLU CA C 97 59.900 59.049 0.851 1
1 1138 . 19 1 1 A 97 97 GLU CB C 97 28.700 29.330 -0.630 1
1 1140 . 19 1 1 A 97 97 GLU N N 97 119.000 117.332 1.668 1
1 1141 . 19 1 1 A 98 98 LEU H H 98 7.740 8.023 -0.283 1
1 1142 . 19 1 1 A 98 98 LEU HA H 98 4.110 3.992 0.118 1
1 1152 . 19 1 1 A 98 98 LEU C C 98 179.700 179.085 0.615 1
1 1153 . 19 1 1 A 98 98 LEU CA C 98 57.900 57.788 0.112 1
1 1154 . 19 1 1 A 98 98 LEU CB C 98 41.800 41.321 0.479 1
1 1158 . 19 1 1 A 98 98 LEU N N 98 119.200 121.187 -1.987 1
1 1159 . 19 1 1 A 99 99 SER H H 99 8.290 7.990 0.300 1
1 1160 . 19 1 1 A 99 99 SER HA H 99 4.220 4.304 -0.084 1
1 1163 . 19 1 1 A 99 99 SER C C 99 176.600 176.596 0.004 1
1 1164 . 19 1 1 A 99 99 SER CA C 99 62.400 62.392 0.008 1
1 1165 . 19 1 1 A 99 99 SER CB C 99 63.200 62.573 0.627 1
1 1166 . 19 1 1 A 99 99 SER N N 99 116.300 113.892 2.408 1
1 1167 . 19 1 1 A 100 100 LEU H H 100 8.490 8.198 0.292 1
1 1168 . 19 1 1 A 100 100 LEU HA H 100 3.960 3.957 0.003 1
1 1178 . 19 1 1 A 100 100 LEU C C 100 179.300 179.783 -0.483 1
1 1179 . 19 1 1 A 100 100 LEU CA C 100 57.700 57.957 -0.257 1
1 1180 . 19 1 1 A 100 100 LEU CB C 100 41.300 41.114 0.186 1
1 1184 . 19 1 1 A 100 100 LEU N N 100 120.900 121.749 -0.849 1
1 1185 . 19 1 1 A 101 101 GLN H H 101 7.680 8.521 -0.841 1
1 1186 . 19 1 1 A 101 101 GLN HA H 101 4.100 4.033 0.067 1
1 1193 . 19 1 1 A 101 101 GLN C C 101 178.700 177.733 0.967 1
1 1194 . 19 1 1 A 101 101 GLN CA C 101 58.800 58.556 0.244 1
1 1195 . 19 1 1 A 101 101 GLN CB C 101 27.900 27.692 0.208 1
1 1197 . 19 1 1 A 101 101 GLN N N 101 119.100 118.250 0.850 1
1 1199 . 19 1 1 A 102 102 GLU H H 102 7.850 8.141 -0.291 1
1 1200 . 19 1 1 A 102 102 GLU HA H 102 4.050 4.118 -0.068 1
1 1205 . 19 1 1 A 102 102 GLU C C 102 179.100 178.901 0.199 1
1 1206 . 19 1 1 A 102 102 GLU CA C 102 58.400 59.417 -1.017 1
1 1207 . 19 1 1 A 102 102 GLU CB C 102 28.600 29.282 -0.682 1
1 1209 . 19 1 1 A 102 102 GLU N N 102 118.400 119.209 -0.809 1
1 1210 . 19 1 1 A 103 103 LEU H H 103 8.080 8.119 -0.039 1
1 1211 . 19 1 1 A 103 103 LEU HA H 103 4.020 4.016 0.004 1
1 1221 . 19 1 1 A 103 103 LEU C C 103 178.200 178.232 -0.032 1
1 1222 . 19 1 1 A 103 103 LEU CA C 103 57.000 58.060 -1.060 1
1 1223 . 19 1 1 A 103 103 LEU CB C 103 41.900 41.803 0.097 1
1 1227 . 19 1 1 A 103 103 LEU N N 103 120.600 123.388 -2.788 1
1 1228 . 19 1 1 A 104 104 GLN H H 104 7.900 8.463 -0.563 1
1 1229 . 19 1 1 A 104 104 GLN HA H 104 4.090 4.116 -0.026 1
1 1236 . 19 1 1 A 104 104 GLN C C 104 177.300 176.974 0.326 1
1 1237 . 19 1 1 A 104 104 GLN CA C 104 58.100 58.156 -0.056 1
1 1238 . 19 1 1 A 104 104 GLN CB C 104 29.400 27.961 1.439 1
1 1240 . 19 1 1 A 104 104 GLN N N 104 117.700 116.542 1.158 1
1 1242 . 19 1 1 A 105 105 VAL H H 105 7.620 7.291 0.329 1
1 1243 . 19 1 1 A 105 105 VAL HA H 105 4.190 4.288 -0.098 1
1 1251 . 19 1 1 A 105 105 VAL C C 105 176.800 176.239 0.561 1
1 1252 . 19 1 1 A 105 105 VAL CA C 105 62.600 62.218 0.382 1
1 1253 . 19 1 1 A 105 105 VAL CB C 105 32.000 32.691 -0.691 1
1 1256 . 19 1 1 A 105 105 VAL N N 105 114.900 116.011 -1.111 1
1 1257 . 19 1 1 A 106 106 SER H H 106 7.900 7.815 0.085 1
1 1258 . 19 1 1 A 106 106 SER HA H 106 4.460 4.692 -0.232 1
1 1261 . 19 1 1 A 106 106 SER C C 106 175.000 175.610 -0.610 1
1 1262 . 19 1 1 A 106 106 SER CA C 106 58.900 57.164 1.736 1
1 1263 . 19 1 1 A 106 106 SER CB C 106 63.900 63.412 0.488 1
1 1264 . 19 1 1 A 106 106 SER N N 106 116.900 117.689 -0.789 1
1 1265 . 19 1 1 A 107 107 SER H H 107 8.230 7.540 0.690 1
1 1266 . 19 1 1 A 107 107 SER HA H 107 4.390 4.146 0.244 1
1 1269 . 19 1 1 A 107 107 SER C C 107 174.600 175.302 -0.702 1
1 1270 . 19 1 1 A 107 107 SER CA C 107 58.400 61.058 -2.658 1
1 1271 . 19 1 1 A 107 107 SER CB C 107 63.600 63.074 0.526 1
1 1272 . 19 1 1 A 107 107 SER N N 107 117.500 115.711 1.789 1
1 1273 . 19 1 1 A 108 108 ALA H H 108 8.080 7.756 0.324 1
1 1274 . 19 1 1 A 108 108 ALA HA H 108 4.280 3.866 0.414 1
1 1278 . 19 1 1 A 108 108 ALA C C 108 177.500 178.455 -0.955 1
1 1279 . 19 1 1 A 108 108 ALA CA C 108 52.700 55.145 -2.445 1
1 1280 . 19 1 1 A 108 108 ALA CB C 108 19.200 17.774 1.426 1
1 1281 . 19 1 1 A 108 108 ALA N N 108 124.900 119.828 5.072 1
1 1282 . 19 1 1 A 109 109 ALA H H 109 8.080 8.392 -0.312 1
1 1283 . 19 1 1 A 109 109 ALA HA H 109 4.280 4.084 0.196 1
1 1287 . 19 1 1 A 109 109 ALA C C 109 177.700 177.434 0.266 1
1 1288 . 19 1 1 A 109 109 ALA CA C 109 52.400 54.154 -1.754 1
1 1289 . 19 1 1 A 109 109 ALA CB C 109 19.400 19.457 -0.057 1
1 1290 . 19 1 1 A 109 109 ALA N N 109 123.000 120.324 2.676 1
1 1291 . 19 1 1 A 110 110 ALA H H 110 8.300 7.603 0.697 1
1 1292 . 19 1 1 A 110 110 ALA HA H 110 4.280 4.085 0.195 1
1 1296 . 19 1 1 A 110 110 ALA C C 110 178.200 177.558 0.642 1
1 1297 . 19 1 1 A 110 110 ALA CA C 110 52.700 53.999 -1.299 1
1 1298 . 19 1 1 A 110 110 ALA CB C 110 19.200 18.146 1.054 1
1 1299 . 19 1 1 A 110 110 ALA N N 110 123.200 118.877 4.323 1
1 1300 . 19 1 1 A 111 111 GLY H H 111 8.300 8.106 0.194 1
1 1301 . 19 1 1 A 111 111 GLY HA2 H 111 3.930 4.007 -0.077 1
1 1302 . 19 1 1 A 111 111 GLY HA3 H 111 3.940 4.009 -0.069 1
1 1303 . 19 1 1 A 111 111 GLY C C 111 173.700 174.765 -1.065 1
1 1304 . 19 1 1 A 111 111 GLY CA C 111 45.100 45.483 -0.383 1
1 1305 . 19 1 1 A 111 111 GLY N N 111 108.000 104.437 3.563 1
1 1306 . 19 1 1 A 112 112 VAL H H 112 7.930 7.669 0.261 1
1 1307 . 19 1 1 A 112 112 VAL HA H 112 4.420 4.043 0.377 1
1 1315 . 19 1 1 A 112 112 VAL CA C 112 60.000 61.008 -1.008 1
1 1316 . 19 1 1 A 112 112 VAL CB C 112 32.200 32.392 -0.192 1
1 1319 . 19 1 1 A 112 112 VAL N N 112 120.400 121.290 -0.890 1
1 1320 . 19 1 1 A 113 113 PRO HA H 113 4.370 4.632 -0.262 1
1 1327 . 19 1 1 A 113 113 PRO C C 113 177.300 178.182 -0.882 1
1 1328 . 19 1 1 A 113 113 PRO CA C 113 63.900 62.901 0.999 1
1 1329 . 19 1 1 A 113 113 PRO CB C 113 31.800 32.481 -0.681 1
1 1332 . 19 1 1 A 114 114 GLY H H 114 8.570 8.761 -0.191 1
1 1333 . 19 1 1 A 114 114 GLY HA2 H 114 3.880 3.907 -0.027 1
1 1334 . 19 1 1 A 114 114 GLY HA3 H 114 4.120 3.908 0.212 1
1 1335 . 19 1 1 A 114 114 GLY C C 114 174.900 175.216 -0.316 1
1 1336 . 19 1 1 A 114 114 GLY CA C 114 45.200 45.428 -0.228 1
1 1337 . 19 1 1 A 114 114 GLY N N 114 109.000 111.407 -2.407 1
1 1338 . 19 1 1 A 115 115 THR H H 115 7.900 7.757 0.143 1
1 1339 . 19 1 1 A 115 115 THR HA H 115 4.400 4.040 0.360 1
1 1344 . 19 1 1 A 115 115 THR C C 115 174.300 173.729 0.571 1
1 1345 . 19 1 1 A 115 115 THR CA C 115 61.700 64.623 -2.923 1
1 1346 . 19 1 1 A 115 115 THR CB C 115 69.700 69.911 -0.211 1
1 1348 . 19 1 1 A 115 115 THR N N 115 111.400 115.753 -4.353 1
1 1349 . 19 1 1 A 116 116 ASN H H 116 8.450 7.916 0.534 1
1 1350 . 19 1 1 A 116 116 ASN HA H 116 4.970 5.125 -0.155 1
1 1355 . 19 1 1 A 116 116 ASN CA C 116 51.500 49.314 2.186 1
1 1356 . 19 1 1 A 116 116 ASN CB C 116 38.900 39.981 -1.081 1
1 1357 . 19 1 1 A 116 116 ASN N N 116 123.100 116.726 6.374 1
1 1359 . 19 1 1 A 117 117 PRO HA H 117 4.370 4.343 0.027 1
1 1366 . 19 1 1 A 117 117 PRO C C 117 178.400 178.454 -0.054 1
1 1367 . 19 1 1 A 117 117 PRO CA C 117 64.800 65.104 -0.304 1
1 1368 . 19 1 1 A 117 117 PRO CB C 117 32.100 31.800 0.300 1
1 1371 . 19 1 1 A 118 118 VAL H H 118 7.750 7.672 0.078 1
1 1372 . 19 1 1 A 118 118 VAL HA H 118 3.810 3.737 0.073 1
1 1380 . 19 1 1 A 118 118 VAL C C 118 178.300 178.004 0.296 1
1 1381 . 19 1 1 A 118 118 VAL CA C 118 65.200 65.466 -0.266 1
1 1382 . 19 1 1 A 118 118 VAL CB C 118 31.500 31.495 0.005 1
1 1385 . 19 1 1 A 118 118 VAL N N 118 118.300 116.091 2.209 1
1 1386 . 19 1 1 A 119 119 LEU H H 119 7.540 8.189 -0.649 1
1 1387 . 19 1 1 A 119 119 LEU HA H 119 4.030 3.887 0.143 1
1 1397 . 19 1 1 A 119 119 LEU C C 119 178.900 179.581 -0.681 1
1 1398 . 19 1 1 A 119 119 LEU CA C 119 57.800 58.108 -0.308 1
1 1399 . 19 1 1 A 119 119 LEU CB C 119 40.700 40.987 -0.287 1
1 1403 . 19 1 1 A 119 119 LEU N N 119 119.700 120.447 -0.747 1
1 1404 . 19 1 1 A 120 120 ASN H H 120 8.080 8.076 0.004 1
1 1405 . 19 1 1 A 120 120 ASN HA H 120 4.420 4.473 -0.053 1
1 1410 . 19 1 1 A 120 120 ASN C C 120 178.100 178.254 -0.154 1
1 1411 . 19 1 1 A 120 120 ASN CA C 120 56.100 56.034 0.066 1
1 1412 . 19 1 1 A 120 120 ASN CB C 120 37.800 37.983 -0.183 1
1 1413 . 19 1 1 A 120 120 ASN N N 120 117.700 118.485 -0.785 1
1 1415 . 19 1 1 A 121 121 ASN H H 121 8.120 8.201 -0.081 1
1 1416 . 19 1 1 A 121 121 ASN HA H 121 4.490 4.589 -0.099 1
1 1421 . 19 1 1 A 121 121 ASN C C 121 178.000 178.305 -0.305 1
1 1422 . 19 1 1 A 121 121 ASN CA C 121 56.100 56.669 -0.569 1
1 1423 . 19 1 1 A 121 121 ASN CB C 121 37.800 38.425 -0.625 1
1 1424 . 19 1 1 A 121 121 ASN N N 121 120.000 118.107 1.893 1
1 1426 . 19 1 1 A 122 122 LEU H H 122 8.180 8.240 -0.060 1
1 1427 . 19 1 1 A 122 122 LEU HA H 122 4.050 3.902 0.148 1
1 1437 . 19 1 1 A 122 122 LEU C C 122 173.800 179.004 -5.204 1
1 1438 . 19 1 1 A 122 122 LEU CA C 122 58.500 57.959 0.541 1
1 1439 . 19 1 1 A 122 122 LEU CB C 122 41.900 41.892 0.008 1
1 1443 . 19 1 1 A 122 122 LEU N N 122 122.600 121.096 1.504 1
1 1444 . 19 1 1 A 123 123 LEU H H 123 8.260 7.670 0.590 1
1 1445 . 19 1 1 A 123 123 LEU HA H 123 3.850 3.969 -0.119 1
1 1455 . 19 1 1 A 123 123 LEU C C 123 178.900 178.541 0.359 1
1 1456 . 19 1 1 A 123 123 LEU CA C 123 58.500 58.055 0.445 1
1 1457 . 19 1 1 A 123 123 LEU CB C 123 41.200 41.310 -0.110 1
1 1461 . 19 1 1 A 123 123 LEU N N 123 119.700 120.543 -0.843 1
1 1462 . 19 1 1 A 124 124 SER H H 124 7.950 8.348 -0.398 1
1 1463 . 19 1 1 A 124 124 SER HA H 124 4.240 4.062 0.178 1
1 1466 . 19 1 1 A 124 124 SER C C 124 177.500 177.189 0.311 1
1 1467 . 19 1 1 A 124 124 SER CA C 124 61.600 61.786 -0.186 1
1 1468 . 19 1 1 A 124 124 SER CB C 124 62.600 62.792 -0.192 1
1 1469 . 19 1 1 A 124 124 SER N N 124 113.400 114.233 -0.833 1
1 1470 . 19 1 1 A 125 125 CYS H H 125 8.040 8.365 -0.325 1
1 1471 . 19 1 1 A 125 125 CYS HA H 125 4.350 4.116 0.234 1
1 1474 . 19 1 1 A 125 125 CYS C C 125 176.800 177.073 -0.273 1
1 1475 . 19 1 1 A 125 125 CYS CA C 125 62.600 63.817 -1.217 1
1 1476 . 19 1 1 A 125 125 CYS CB C 125 27.100 26.795 0.305 1
1 1477 . 19 1 1 A 125 125 CYS N N 125 119.800 119.638 0.162 1
1 1478 . 19 1 1 A 126 126 VAL H H 126 8.290 8.467 -0.177 1
1 1479 . 19 1 1 A 126 126 VAL HA H 126 3.430 3.414 0.016 1
1 1487 . 19 1 1 A 126 126 VAL C C 126 177.800 177.827 -0.027 1
1 1488 . 19 1 1 A 126 126 VAL CA C 126 67.100 66.947 0.153 1
1 1489 . 19 1 1 A 126 126 VAL CB C 126 31.400 31.465 -0.065 1
1 1492 . 19 1 1 A 126 126 VAL N N 126 121.900 120.613 1.287 1
1 1493 . 19 1 1 A 127 127 GLN H H 127 8.200 8.245 -0.045 1
1 1494 . 19 1 1 A 127 127 GLN HA H 127 3.970 3.995 -0.025 1
1 1501 . 19 1 1 A 127 127 GLN C C 127 178.200 178.502 -0.302 1
1 1502 . 19 1 1 A 127 127 GLN CA C 127 58.700 58.825 -0.125 1
1 1503 . 19 1 1 A 127 127 GLN CB C 127 27.800 28.263 -0.463 1
1 1505 . 19 1 1 A 127 127 GLN N N 127 119.700 117.905 1.795 1
1 1507 . 19 1 1 A 128 128 GLU H H 128 7.880 8.110 -0.230 1
1 1508 . 19 1 1 A 128 128 GLU HA H 128 4.200 4.097 0.103 1
1 1513 . 19 1 1 A 128 128 GLU C C 128 178.400 178.672 -0.272 1
1 1514 . 19 1 1 A 128 128 GLU CA C 128 59.000 58.986 0.014 1
1 1515 . 19 1 1 A 128 128 GLU CB C 128 28.400 29.568 -1.168 1
1 1517 . 19 1 1 A 128 128 GLU N N 128 119.800 119.414 0.386 1
1 1518 . 19 1 1 A 129 129 ILE H H 129 8.000 8.402 -0.402 1
1 1519 . 19 1 1 A 129 129 ILE HA H 129 3.460 3.595 -0.135 1
1 1529 . 19 1 1 A 129 129 ILE C C 129 176.800 178.153 -1.353 1
1 1530 . 19 1 1 A 129 129 ILE CA C 129 66.100 65.471 0.629 1
1 1531 . 19 1 1 A 129 129 ILE CB C 129 38.200 37.454 0.746 1
1 1535 . 19 1 1 A 129 129 ILE N N 129 119.500 120.188 -0.688 1
1 1536 . 19 1 1 A 130 130 SER H H 130 8.040 8.369 -0.329 1
1 1537 . 19 1 1 A 130 130 SER HA H 130 3.780 4.223 -0.443 1
1 1540 . 19 1 1 A 130 130 SER C C 130 176.200 176.420 -0.220 1
1 1541 . 19 1 1 A 130 130 SER CA C 130 62.100 61.574 0.526 1
1 1542 . 19 1 1 A 130 130 SER CB C 130 62.600 62.238 0.362 1
1 1543 . 19 1 1 A 130 130 SER N N 130 112.800 114.855 -2.055 1
1 1544 . 19 1 1 A 131 131 ASP H H 131 8.270 7.968 0.302 1
1 1545 . 19 1 1 A 131 131 ASP HA H 131 4.310 4.418 -0.108 1
1 1548 . 19 1 1 A 131 131 ASP C C 131 179.200 178.557 0.643 1
1 1549 . 19 1 1 A 131 131 ASP CA C 131 56.800 57.538 -0.738 1
1 1550 . 19 1 1 A 131 131 ASP CB C 131 40.900 41.562 -0.662 1
1 1551 . 19 1 1 A 131 131 ASP N N 131 119.600 122.429 -2.829 1
1 1552 . 19 1 1 A 132 132 VAL H H 132 8.470 8.216 0.254 1
1 1553 . 19 1 1 A 132 132 VAL HA H 132 3.520 3.735 -0.215 1
1 1561 . 19 1 1 A 132 132 VAL C C 132 178.700 178.529 0.171 1
1 1562 . 19 1 1 A 132 132 VAL CA C 132 66.500 66.442 0.058 1
1 1563 . 19 1 1 A 132 132 VAL CB C 132 31.500 31.670 -0.170 1
1 1566 . 19 1 1 A 132 132 VAL N N 132 118.100 119.489 -1.389 1
1 1567 . 19 1 1 A 133 133 VAL H H 133 8.140 7.887 0.253 1
1 1568 . 19 1 1 A 133 133 VAL HA H 133 3.770 3.750 0.020 1
1 1576 . 19 1 1 A 133 133 VAL C C 133 176.500 176.884 -0.384 1
1 1577 . 19 1 1 A 133 133 VAL CA C 133 65.100 66.740 -1.640 1
1 1578 . 19 1 1 A 133 133 VAL CB C 133 31.600 31.636 -0.036 1
1 1581 . 19 1 1 A 133 133 VAL N N 133 117.000 120.888 -3.888 1
1 1582 . 19 1 1 A 134 134 GLN H H 134 7.490 7.717 -0.227 1
1 1583 . 19 1 1 A 134 134 GLN HA H 134 4.350 4.347 0.003 1
1 1590 . 19 1 1 A 134 134 GLN C C 134 175.400 176.296 -0.896 1
1 1591 . 19 1 1 A 134 134 GLN CA C 134 56.700 56.070 0.630 1
1 1592 . 19 1 1 A 134 134 GLN CB C 134 30.500 28.997 1.503 1
1 1594 . 19 1 1 A 134 134 GLN N N 134 116.300 118.437 -2.137 1
1 1 . 20 1 1 A 2 2 GLY HA2 H 2 3.890 3.975 -0.085 1
1 2 . 20 1 1 A 2 2 GLY HA3 H 2 3.890 3.986 -0.096 1
1 3 . 20 1 1 A 2 2 GLY C C 2 174.200 175.004 -0.804 1
1 4 . 20 1 1 A 2 2 GLY CA C 2 44.700 47.167 -2.467 1
1 5 . 20 1 1 A 3 3 HIS H H 3 8.380 8.871 -0.491 1
1 6 . 20 1 1 A 3 3 HIS HA H 3 4.610 4.703 -0.093 1
1 9 . 20 1 1 A 3 3 HIS C C 3 174.500 174.794 -0.294 1
1 10 . 20 1 1 A 3 3 HIS CA C 3 55.200 54.659 0.541 1
1 11 . 20 1 1 A 3 3 HIS CB C 3 28.800 28.082 0.718 1
1 12 . 20 1 1 A 3 3 HIS N N 3 117.600 124.840 -7.240 1
1 13 . 20 1 1 A 4 4 HIS H H 4 8.520 7.880 0.640 1
1 14 . 20 1 1 A 4 4 HIS HA H 4 4.640 4.245 0.395 1
1 17 . 20 1 1 A 4 4 HIS C C 4 174.200 174.796 -0.596 1
1 18 . 20 1 1 A 4 4 HIS CA C 4 55.100 54.393 0.707 1
1 19 . 20 1 1 A 4 4 HIS CB C 4 28.900 28.189 0.711 1
1 20 . 20 1 1 A 4 4 HIS N N 4 119.000 121.174 -2.174 1
1 21 . 20 1 1 A 5 5 HIS H H 5 8.530 8.612 -0.082 1
1 22 . 20 1 1 A 5 5 HIS HA H 5 4.410 3.878 0.532 1
1 25 . 20 1 1 A 5 5 HIS CA C 5 54.900 58.946 -4.046 1
1 26 . 20 1 1 A 5 5 HIS CB C 5 27.300 27.868 -0.568 1
1 27 . 20 1 1 A 5 5 HIS N N 5 121.600 119.257 2.343 1
1 28 . 20 1 1 A 6 6 HIS HA H 6 4.640 3.918 0.722 1
1 31 . 20 1 1 A 6 6 HIS C C 6 174.100 174.452 -0.352 1
1 32 . 20 1 1 A 6 6 HIS CA C 6 55.100 57.849 -2.749 1
1 33 . 20 1 1 A 6 6 HIS CB C 6 29.100 27.388 1.712 1
1 34 . 20 1 1 A 7 7 HIS H H 7 8.690 7.863 0.827 1
1 35 . 20 1 1 A 7 7 HIS HA H 7 4.650 4.490 0.160 1
1 38 . 20 1 1 A 7 7 HIS C C 7 174.200 174.395 -0.195 1
1 39 . 20 1 1 A 7 7 HIS CA C 7 55.200 55.312 -0.112 1
1 40 . 20 1 1 A 7 7 HIS CB C 7 29.300 29.033 0.267 1
1 41 . 20 1 1 A 7 7 HIS N N 7 121.400 118.357 3.043 1
1 42 . 20 1 1 A 8 8 HIS H H 8 8.660 8.549 0.111 1
1 43 . 20 1 1 A 8 8 HIS HA H 8 4.700 4.713 -0.013 1
1 46 . 20 1 1 A 8 8 HIS C C 8 174.200 174.518 -0.318 1
1 47 . 20 1 1 A 8 8 HIS CA C 8 55.000 54.866 0.134 1
1 48 . 20 1 1 A 8 8 HIS CB C 8 29.300 30.712 -1.412 1
1 49 . 20 1 1 A 8 8 HIS N N 8 120.400 126.044 -5.644 1
1 50 . 20 1 1 A 9 9 SER H H 9 8.490 7.565 0.925 1
1 51 . 20 1 1 A 9 9 SER HA H 9 4.390 4.300 0.090 1
1 54 . 20 1 1 A 9 9 SER C C 9 174.100 174.167 -0.067 1
1 55 . 20 1 1 A 9 9 SER CA C 9 58.300 58.598 -0.298 1
1 56 . 20 1 1 A 9 9 SER CB C 9 63.700 63.820 -0.120 1
1 57 . 20 1 1 A 9 9 SER N N 9 118.100 116.828 1.272 1
1 58 . 20 1 1 A 10 10 HIS H H 10 8.710 8.745 -0.035 1
1 59 . 20 1 1 A 10 10 HIS HA H 10 4.690 4.895 -0.205 1
1 63 . 20 1 1 A 10 10 HIS C C 10 174.200 173.421 0.779 1
1 64 . 20 1 1 A 10 10 HIS CA C 10 55.200 55.372 -0.172 1
1 65 . 20 1 1 A 10 10 HIS CB C 10 28.800 32.794 -3.994 1
1 66 . 20 1 1 A 10 10 HIS N N 10 120.700 127.272 -6.572 1
1 67 . 20 1 1 A 11 11 MET H H 11 8.410 8.532 -0.122 1
1 68 . 20 1 1 A 11 11 MET HA H 11 4.420 4.754 -0.334 1
1 76 . 20 1 1 A 11 11 MET C C 11 175.800 174.609 1.191 1
1 77 . 20 1 1 A 11 11 MET CA C 11 55.100 53.885 1.215 1
1 78 . 20 1 1 A 11 11 MET CB C 11 32.800 34.785 -1.985 1
1 81 . 20 1 1 A 11 11 MET N N 11 122.300 126.693 -4.393 1
1 82 . 20 1 1 A 12 12 ALA H H 12 8.440 8.374 0.066 1
1 83 . 20 1 1 A 12 12 ALA HA H 12 4.280 4.493 -0.213 1
1 87 . 20 1 1 A 12 12 ALA C C 12 177.400 177.715 -0.315 1
1 88 . 20 1 1 A 12 12 ALA CA C 12 52.400 50.744 1.656 1
1 89 . 20 1 1 A 12 12 ALA CB C 12 18.800 20.319 -1.519 1
1 90 . 20 1 1 A 12 12 ALA N N 12 125.900 123.255 2.645 1
1 91 . 20 1 1 A 13 13 ASN H H 13 8.440 9.117 -0.677 1
1 92 . 20 1 1 A 13 13 ASN HA H 13 4.660 4.766 -0.106 1
1 97 . 20 1 1 A 13 13 ASN C C 13 175.900 175.257 0.643 1
1 98 . 20 1 1 A 13 13 ASN CA C 13 53.200 53.476 -0.276 1
1 99 . 20 1 1 A 13 13 ASN CB C 13 38.800 39.697 -0.897 1
1 100 . 20 1 1 A 13 13 ASN N N 13 118.300 119.198 -0.898 1
1 102 . 20 1 1 A 14 14 GLY H H 14 8.370 7.439 0.931 1
1 103 . 20 1 1 A 14 14 GLY HA2 H 14 3.920 4.012 -0.092 1
1 104 . 20 1 1 A 14 14 GLY HA3 H 14 3.920 4.014 -0.094 1
1 105 . 20 1 1 A 14 14 GLY C C 14 174.000 172.621 1.379 1
1 106 . 20 1 1 A 14 14 GLY CA C 14 45.200 44.262 0.938 1
1 107 . 20 1 1 A 14 14 GLY N N 14 109.600 105.763 3.837 1
1 108 . 20 1 1 A 15 15 ALA H H 15 8.140 8.175 -0.035 1
1 109 . 20 1 1 A 15 15 ALA HA H 15 4.280 4.528 -0.248 1
1 113 . 20 1 1 A 15 15 ALA C C 15 177.300 177.786 -0.486 1
1 114 . 20 1 1 A 15 15 ALA CA C 15 52.500 51.739 0.761 1
1 115 . 20 1 1 A 15 15 ALA CB C 15 19.100 19.071 0.029 1
1 116 . 20 1 1 A 15 15 ALA N N 15 123.800 123.523 0.277 1
1 117 . 20 1 1 A 16 16 ALA H H 16 8.030 8.488 -0.458 1
1 118 . 20 1 1 A 16 16 ALA HA H 16 4.280 4.722 -0.442 1
1 122 . 20 1 1 A 16 16 ALA C C 16 178.400 178.656 -0.256 1
1 123 . 20 1 1 A 16 16 ALA CA C 16 52.600 51.196 1.404 1
1 124 . 20 1 1 A 16 16 ALA CB C 16 19.100 19.943 -0.843 1
1 125 . 20 1 1 A 16 16 ALA N N 16 122.300 126.070 -3.770 1
1 126 . 20 1 1 A 17 17 GLY H H 17 8.320 8.380 -0.060 1
1 127 . 20 1 1 A 17 17 GLY HA2 H 17 3.960 3.873 0.087 1
1 128 . 20 1 1 A 17 17 GLY HA3 H 17 3.960 3.873 0.087 1
1 129 . 20 1 1 A 17 17 GLY C C 17 174.500 175.896 -1.396 1
1 130 . 20 1 1 A 17 17 GLY CA C 17 45.200 46.574 -1.374 1
1 131 . 20 1 1 A 17 17 GLY N N 17 107.800 107.604 0.196 1
1 132 . 20 1 1 A 18 18 THR H H 18 7.970 7.877 0.093 1
1 133 . 20 1 1 A 18 18 THR HA H 18 4.290 4.008 0.282 1
1 138 . 20 1 1 A 18 18 THR C C 18 174.600 176.431 -1.831 1
1 139 . 20 1 1 A 18 18 THR CA C 18 62.000 66.533 -4.533 1
1 140 . 20 1 1 A 18 18 THR CB C 18 69.700 68.369 1.331 1
1 142 . 20 1 1 A 18 18 THR N N 18 113.800 117.512 -3.712 1
1 143 . 20 1 1 A 19 19 LYS H H 19 8.350 8.127 0.223 1
1 144 . 20 1 1 A 19 19 LYS HA H 19 4.270 4.111 0.159 1
1 153 . 20 1 1 A 19 19 LYS C C 19 176.600 176.830 -0.230 1
1 154 . 20 1 1 A 19 19 LYS CA C 19 56.500 58.958 -2.458 1
1 155 . 20 1 1 A 19 19 LYS CB C 19 32.800 32.111 0.689 1
1 159 . 20 1 1 A 19 19 LYS N N 19 124.000 119.761 4.239 1
1 160 . 20 1 1 A 20 20 VAL H H 20 8.060 8.061 -0.001 1
1 161 . 20 1 1 A 20 20 VAL HA H 20 3.990 4.220 -0.230 1
1 169 . 20 1 1 A 20 20 VAL C C 20 175.900 175.311 0.589 1
1 170 . 20 1 1 A 20 20 VAL CA C 20 62.400 61.878 0.522 1
1 171 . 20 1 1 A 20 20 VAL CB C 20 32.600 30.990 1.610 1
1 174 . 20 1 1 A 20 20 VAL N N 20 121.700 118.911 2.789 1
1 175 . 20 1 1 A 21 21 ALA H H 21 8.310 8.512 -0.202 1
1 176 . 20 1 1 A 21 21 ALA HA H 21 4.290 4.651 -0.361 1
1 180 . 20 1 1 A 21 21 ALA C C 21 177.600 177.847 -0.247 1
1 181 . 20 1 1 A 21 21 ALA CA C 21 52.400 52.542 -0.142 1
1 182 . 20 1 1 A 21 21 ALA CB C 21 19.000 21.053 -2.053 1
1 183 . 20 1 1 A 21 21 ALA N N 21 127.700 128.282 -0.582 1
1 184 . 20 1 1 A 22 22 LEU H H 22 8.150 7.901 0.249 1
1 185 . 20 1 1 A 22 22 LEU HA H 22 4.280 4.589 -0.309 1
1 195 . 20 1 1 A 22 22 LEU C C 22 177.400 175.249 2.151 1
1 196 . 20 1 1 A 22 22 LEU CA C 22 55.200 53.750 1.450 1
1 197 . 20 1 1 A 22 22 LEU CB C 22 42.200 42.315 -0.115 1
1 201 . 20 1 1 A 22 22 LEU N N 22 121.800 116.787 5.013 1
1 202 . 20 1 1 A 23 23 ARG H H 23 8.240 7.551 0.689 1
1 203 . 20 1 1 A 23 23 ARG HA H 23 4.290 4.611 -0.321 1
1 211 . 20 1 1 A 23 23 ARG C C 23 176.300 175.792 0.508 1
1 212 . 20 1 1 A 23 23 ARG CA C 23 56.000 55.346 0.654 1
1 213 . 20 1 1 A 23 23 ARG CB C 23 30.600 31.105 -0.505 1
1 216 . 20 1 1 A 23 23 ARG N N 23 122.000 120.860 1.140 1
1 218 . 20 1 1 A 24 24 LYS H H 24 8.370 8.567 -0.197 1
1 219 . 20 1 1 A 24 24 LYS HA H 24 4.330 4.543 -0.213 1
1 228 . 20 1 1 A 24 24 LYS C C 24 176.800 176.354 0.446 1
1 229 . 20 1 1 A 24 24 LYS CA C 24 56.400 56.880 -0.480 1
1 230 . 20 1 1 A 24 24 LYS CB C 24 32.700 35.226 -2.526 1
1 234 . 20 1 1 A 24 24 LYS N N 24 122.900 125.514 -2.614 1
1 235 . 20 1 1 A 25 25 THR H H 25 8.100 7.607 0.493 1
1 236 . 20 1 1 A 25 25 THR HA H 25 4.290 4.331 -0.041 1
1 241 . 20 1 1 A 25 25 THR C C 25 174.600 174.613 -0.013 1
1 242 . 20 1 1 A 25 25 THR CA C 25 61.500 62.252 -0.752 1
1 243 . 20 1 1 A 25 25 THR CB C 25 69.800 69.656 0.144 1
1 245 . 20 1 1 A 25 25 THR N N 25 115.500 114.741 0.759 1
1 246 . 20 1 1 A 26 26 LYS H H 26 8.370 8.600 -0.230 1
1 247 . 20 1 1 A 26 26 LYS HA H 26 4.270 4.485 -0.215 1
1 256 . 20 1 1 A 26 26 LYS C C 26 176.600 176.733 -0.133 1
1 257 . 20 1 1 A 26 26 LYS CA C 26 56.600 55.830 0.770 1
1 258 . 20 1 1 A 26 26 LYS CB C 26 32.700 33.722 -1.022 1
1 262 . 20 1 1 A 26 26 LYS N N 26 123.700 124.306 -0.606 1
1 263 . 20 1 1 A 27 27 GLN H H 27 8.390 8.688 -0.298 1
1 264 . 20 1 1 A 27 27 GLN HA H 27 4.240 4.627 -0.387 1
1 271 . 20 1 1 A 27 27 GLN C C 27 175.900 175.763 0.137 1
1 272 . 20 1 1 A 27 27 GLN CA C 27 56.100 56.326 -0.226 1
1 273 . 20 1 1 A 27 27 GLN CB C 27 29.300 30.582 -1.282 1
1 275 . 20 1 1 A 27 27 GLN N N 27 121.700 117.855 3.845 1
1 277 . 20 1 1 A 28 28 ALA H H 28 8.330 7.703 0.627 1
1 278 . 20 1 1 A 28 28 ALA HA H 28 4.240 4.501 -0.261 1
1 282 . 20 1 1 A 28 28 ALA C C 28 177.700 176.949 0.751 1
1 283 . 20 1 1 A 28 28 ALA CA C 28 52.500 51.435 1.065 1
1 284 . 20 1 1 A 28 28 ALA CB C 28 19.100 22.221 -3.121 1
1 285 . 20 1 1 A 28 28 ALA N N 28 125.400 119.508 5.892 1
1 286 . 20 1 1 A 29 29 ALA H H 29 8.250 8.870 -0.620 1
1 287 . 20 1 1 A 29 29 ALA HA H 29 4.230 4.036 0.194 1
1 291 . 20 1 1 A 29 29 ALA C C 29 178.000 179.243 -1.243 1
1 292 . 20 1 1 A 29 29 ALA CA C 29 52.500 54.965 -2.465 1
1 293 . 20 1 1 A 29 29 ALA CB C 29 19.100 18.428 0.672 1
1 294 . 20 1 1 A 29 29 ALA N N 29 123.000 123.543 -0.543 1
1 295 . 20 1 1 A 30 30 GLU H H 30 8.260 7.952 0.308 1
1 296 . 20 1 1 A 30 30 GLU HA H 30 4.220 4.194 0.026 1
1 301 . 20 1 1 A 30 30 GLU C C 30 176.500 176.795 -0.295 1
1 302 . 20 1 1 A 30 30 GLU CA C 30 56.400 58.282 -1.882 1
1 303 . 20 1 1 A 30 30 GLU CB C 30 29.500 29.631 -0.131 1
1 305 . 20 1 1 A 30 30 GLU N N 30 119.700 117.245 2.455 1
1 306 . 20 1 1 A 31 31 LYS H H 31 8.230 8.258 -0.028 1
1 307 . 20 1 1 A 31 31 LYS HA H 31 4.280 4.542 -0.262 1
1 316 . 20 1 1 A 31 31 LYS C C 31 176.500 176.329 0.171 1
1 317 . 20 1 1 A 31 31 LYS CA C 31 56.400 55.888 0.512 1
1 318 . 20 1 1 A 31 31 LYS CB C 31 32.800 34.355 -1.555 1
1 322 . 20 1 1 A 31 31 LYS N N 31 122.700 119.103 3.597 1
1 323 . 20 1 1 A 32 32 ILE H H 32 8.140 7.365 0.775 1
1 324 . 20 1 1 A 32 32 ILE HA H 32 4.110 4.176 -0.066 1
1 334 . 20 1 1 A 32 32 ILE C C 32 176.400 178.005 -1.605 1
1 335 . 20 1 1 A 32 32 ILE CA C 32 61.200 62.100 -0.900 1
1 336 . 20 1 1 A 32 32 ILE CB C 32 38.600 37.662 0.938 1
1 340 . 20 1 1 A 32 32 ILE N N 32 122.300 122.536 -0.236 1
1 341 . 20 1 1 A 33 33 SER H H 33 8.230 9.036 -0.806 1
1 342 . 20 1 1 A 33 33 SER HA H 33 4.400 4.145 0.255 1
1 345 . 20 1 1 A 33 33 SER C C 33 174.800 176.534 -1.734 1
1 346 . 20 1 1 A 33 33 SER CA C 33 58.300 61.932 -3.632 1
1 347 . 20 1 1 A 33 33 SER CB C 33 63.700 62.571 1.129 1
1 348 . 20 1 1 A 33 33 SER N N 33 119.600 122.259 -2.659 1
1 349 . 20 1 1 A 34 34 ALA H H 34 8.430 8.255 0.175 1
1 350 . 20 1 1 A 34 34 ALA HA H 34 4.220 4.114 0.106 1
1 354 . 20 1 1 A 34 34 ALA C C 34 179.500 179.543 -0.043 1
1 355 . 20 1 1 A 34 34 ALA CA C 34 53.500 55.252 -1.752 1
1 356 . 20 1 1 A 34 34 ALA CB C 34 18.800 18.771 0.029 1
1 357 . 20 1 1 A 34 34 ALA N N 34 126.000 122.659 3.341 1
1 358 . 20 1 1 A 35 35 ASP H H 35 8.380 7.915 0.465 1
1 359 . 20 1 1 A 35 35 ASP HA H 35 4.520 4.505 0.015 1
1 362 . 20 1 1 A 35 35 ASP C C 35 176.500 178.204 -1.704 1
1 363 . 20 1 1 A 35 35 ASP CA C 35 54.800 56.133 -1.333 1
1 364 . 20 1 1 A 35 35 ASP CB C 35 40.200 40.552 -0.352 1
1 365 . 20 1 1 A 35 35 ASP N N 35 118.200 117.809 0.391 1
1 366 . 20 1 1 A 36 36 LYS H H 36 8.000 7.990 0.010 1
1 367 . 20 1 1 A 36 36 LYS HA H 36 4.270 4.127 0.143 1
1 376 . 20 1 1 A 36 36 LYS C C 36 177.000 177.206 -0.206 1
1 377 . 20 1 1 A 36 36 LYS CA C 36 56.800 58.351 -1.551 1
1 378 . 20 1 1 A 36 36 LYS CB C 36 32.900 32.541 0.359 1
1 382 . 20 1 1 A 36 36 LYS N N 36 120.900 118.803 2.097 1
1 383 . 20 1 1 A 37 37 ILE H H 37 7.970 7.183 0.787 1
1 384 . 20 1 1 A 37 37 ILE HA H 37 4.020 4.174 -0.154 1
1 394 . 20 1 1 A 37 37 ILE C C 37 176.100 175.451 0.649 1
1 395 . 20 1 1 A 37 37 ILE CA C 37 61.300 62.126 -0.826 1
1 396 . 20 1 1 A 37 37 ILE CB C 37 38.100 38.212 -0.112 1
1 400 . 20 1 1 A 37 37 ILE N N 37 121.800 122.149 -0.349 1
1 401 . 20 1 1 A 38 38 SER H H 38 7.980 8.740 -0.760 1
1 402 . 20 1 1 A 38 38 SER HA H 38 4.540 4.964 -0.424 1
1 405 . 20 1 1 A 38 38 SER C C 38 174.700 174.464 0.236 1
1 406 . 20 1 1 A 38 38 SER CA C 38 58.200 57.188 1.012 1
1 407 . 20 1 1 A 38 38 SER CB C 38 64.400 67.028 -2.628 1
1 408 . 20 1 1 A 38 38 SER N N 38 119.000 120.746 -1.746 1
1 409 . 20 1 1 A 39 39 LYS H H 39 8.690 8.833 -0.143 1
1 410 . 20 1 1 A 39 39 LYS HA H 39 3.400 3.518 -0.118 1
1 419 . 20 1 1 A 39 39 LYS C C 39 177.400 177.894 -0.494 1
1 420 . 20 1 1 A 39 39 LYS CA C 39 59.800 60.217 -0.417 1
1 421 . 20 1 1 A 39 39 LYS CB C 39 32.400 32.381 0.019 1
1 425 . 20 1 1 A 39 39 LYS N N 39 124.200 125.189 -0.989 1
1 426 . 20 1 1 A 40 40 GLU H H 40 8.280 8.365 -0.085 1
1 427 . 20 1 1 A 40 40 GLU HA H 40 3.840 4.029 -0.189 1
1 432 . 20 1 1 A 40 40 GLU C C 40 178.400 178.787 -0.387 1
1 433 . 20 1 1 A 40 40 GLU CA C 40 59.400 59.084 0.316 1
1 434 . 20 1 1 A 40 40 GLU CB C 40 28.300 29.449 -1.149 1
1 436 . 20 1 1 A 40 40 GLU N N 40 116.300 117.423 -1.123 1
1 437 . 20 1 1 A 41 41 ALA H H 41 7.890 7.886 0.004 1
1 438 . 20 1 1 A 41 41 ALA HA H 41 3.910 3.992 -0.082 1
1 442 . 20 1 1 A 41 41 ALA C C 41 179.900 178.568 1.332 1
1 443 . 20 1 1 A 41 41 ALA CA C 41 54.700 54.907 -0.207 1
1 444 . 20 1 1 A 41 41 ALA CB C 41 17.900 18.155 -0.255 1
1 445 . 20 1 1 A 41 41 ALA N N 41 122.300 122.187 0.113 1
1 446 . 20 1 1 A 42 42 LEU H H 42 7.490 7.749 -0.259 1
1 447 . 20 1 1 A 42 42 LEU HA H 42 3.480 3.709 -0.229 1
1 457 . 20 1 1 A 42 42 LEU C C 42 178.900 178.347 0.553 1
1 458 . 20 1 1 A 42 42 LEU CA C 42 59.800 57.505 2.295 1
1 459 . 20 1 1 A 42 42 LEU CB C 42 42.300 41.604 0.696 1
1 463 . 20 1 1 A 42 42 LEU N N 42 121.000 119.574 1.426 1
1 464 . 20 1 1 A 43 43 LEU H H 43 8.290 8.151 0.139 1
1 465 . 20 1 1 A 43 43 LEU HA H 43 3.780 3.840 -0.060 1
1 475 . 20 1 1 A 43 43 LEU C C 43 179.400 179.098 0.302 1
1 476 . 20 1 1 A 43 43 LEU CA C 43 57.600 57.952 -0.352 1
1 477 . 20 1 1 A 43 43 LEU CB C 43 40.900 41.187 -0.287 1
1 481 . 20 1 1 A 43 43 LEU N N 43 119.200 118.103 1.097 1
1 482 . 20 1 1 A 44 44 GLU H H 44 8.330 8.310 0.020 1
1 483 . 20 1 1 A 44 44 GLU HA H 44 4.050 3.920 0.130 1
1 488 . 20 1 1 A 44 44 GLU C C 44 178.600 179.420 -0.820 1
1 489 . 20 1 1 A 44 44 GLU CA C 44 58.900 59.216 -0.316 1
1 490 . 20 1 1 A 44 44 GLU CB C 44 28.300 29.573 -1.273 1
1 492 . 20 1 1 A 44 44 GLU N N 44 119.600 118.108 1.492 1
1 493 . 20 1 1 A 45 45 CYS H H 45 7.690 7.839 -0.149 1
1 494 . 20 1 1 A 45 45 CYS HA H 45 4.120 4.088 0.032 1
1 497 . 20 1 1 A 45 45 CYS C C 45 176.100 176.701 -0.601 1
1 498 . 20 1 1 A 45 45 CYS CA C 45 62.500 63.128 -0.628 1
1 499 . 20 1 1 A 45 45 CYS CB C 45 26.200 26.857 -0.657 1
1 500 . 20 1 1 A 45 45 CYS N N 45 120.900 118.652 2.248 1
1 501 . 20 1 1 A 46 46 ALA H H 46 8.540 8.269 0.271 1
1 502 . 20 1 1 A 46 46 ALA HA H 46 3.900 3.925 -0.025 1
1 506 . 20 1 1 A 46 46 ALA C C 46 179.200 178.963 0.237 1
1 507 . 20 1 1 A 46 46 ALA CA C 46 55.500 55.560 -0.060 1
1 508 . 20 1 1 A 46 46 ALA CB C 46 16.800 18.145 -1.345 1
1 509 . 20 1 1 A 46 46 ALA N N 46 121.500 122.199 -0.699 1
1 510 . 20 1 1 A 47 47 ASP H H 47 8.460 7.823 0.637 1
1 511 . 20 1 1 A 47 47 ASP HA H 47 4.340 4.403 -0.063 1
1 514 . 20 1 1 A 47 47 ASP C C 47 178.800 178.652 0.148 1
1 515 . 20 1 1 A 47 47 ASP CA C 47 56.600 56.802 -0.202 1
1 516 . 20 1 1 A 47 47 ASP CB C 47 39.800 42.354 -2.554 1
1 517 . 20 1 1 A 47 47 ASP N N 47 119.000 118.665 0.335 1
1 518 . 20 1 1 A 48 48 LEU H H 48 8.040 7.749 0.291 1
1 519 . 20 1 1 A 48 48 LEU HA H 48 4.110 4.039 0.071 1
1 529 . 20 1 1 A 48 48 LEU C C 48 180.000 179.560 0.440 1
1 530 . 20 1 1 A 48 48 LEU CA C 48 58.000 58.102 -0.102 1
1 531 . 20 1 1 A 48 48 LEU CB C 48 41.700 41.509 0.191 1
1 535 . 20 1 1 A 48 48 LEU N N 48 123.000 119.894 3.106 1
1 536 . 20 1 1 A 49 49 LEU H H 49 8.300 7.629 0.671 1
1 537 . 20 1 1 A 49 49 LEU HA H 49 4.110 3.890 0.220 1
1 547 . 20 1 1 A 49 49 LEU C C 49 177.200 178.830 -1.630 1
1 548 . 20 1 1 A 49 49 LEU CA C 49 57.600 57.953 -0.353 1
1 549 . 20 1 1 A 49 49 LEU CB C 49 41.200 41.573 -0.373 1
1 553 . 20 1 1 A 49 49 LEU N N 49 120.900 119.934 0.966 1
1 554 . 20 1 1 A 50 50 SER H H 50 8.660 7.976 0.684 1
1 555 . 20 1 1 A 50 50 SER HA H 50 4.000 4.207 -0.207 1
1 558 . 20 1 1 A 50 50 SER C C 50 176.800 176.675 0.125 1
1 559 . 20 1 1 A 50 50 SER CA C 50 62.500 61.660 0.840 1
1 560 . 20 1 1 A 50 50 SER CB C 50 62.600 62.257 0.343 1
1 561 . 20 1 1 A 50 50 SER N N 50 113.300 113.183 0.117 1
1 562 . 20 1 1 A 51 51 SER H H 51 7.980 7.985 -0.005 1
1 563 . 20 1 1 A 51 51 SER HA H 51 4.220 4.093 0.127 1
1 566 . 20 1 1 A 51 51 SER C C 51 176.300 177.256 -0.956 1
1 567 . 20 1 1 A 51 51 SER CA C 51 61.200 61.533 -0.333 1
1 568 . 20 1 1 A 51 51 SER CB C 51 62.700 62.885 -0.185 1
1 569 . 20 1 1 A 51 51 SER N N 51 115.900 116.941 -1.041 1
1 570 . 20 1 1 A 52 52 ALA H H 52 8.030 8.189 -0.159 1
1 571 . 20 1 1 A 52 52 ALA HA H 52 4.130 4.202 -0.072 1
1 575 . 20 1 1 A 52 52 ALA C C 52 178.500 180.128 -1.628 1
1 576 . 20 1 1 A 52 52 ALA CA C 52 54.500 54.981 -0.481 1
1 577 . 20 1 1 A 52 52 ALA CB C 52 18.000 18.180 -0.180 1
1 578 . 20 1 1 A 52 52 ALA N N 52 125.400 123.064 2.336 1
1 579 . 20 1 1 A 53 53 LEU H H 53 7.710 8.234 -0.524 1
1 580 . 20 1 1 A 53 53 LEU HA H 53 4.180 4.170 0.010 1
1 590 . 20 1 1 A 53 53 LEU C C 53 177.700 177.948 -0.248 1
1 591 . 20 1 1 A 53 53 LEU CA C 53 56.500 56.859 -0.359 1
1 592 . 20 1 1 A 53 53 LEU CB C 53 42.400 41.755 0.645 1
1 596 . 20 1 1 A 53 53 LEU N N 53 113.800 118.096 -4.296 1
1 597 . 20 1 1 A 54 54 THR H H 54 7.550 7.374 0.176 1
1 598 . 20 1 1 A 54 54 THR HA H 54 4.420 4.508 -0.088 1
1 603 . 20 1 1 A 54 54 THR C C 54 174.100 173.252 0.848 1
1 604 . 20 1 1 A 54 54 THR CA C 54 61.600 61.862 -0.262 1
1 605 . 20 1 1 A 54 54 THR CB C 54 69.300 69.799 -0.499 1
1 607 . 20 1 1 A 54 54 THR N N 54 107.700 105.737 1.963 1
1 608 . 20 1 1 A 55 55 GLU H H 55 7.750 7.602 0.148 1
1 609 . 20 1 1 A 55 55 GLU HA H 55 4.760 4.966 -0.206 1
1 614 . 20 1 1 A 55 55 GLU CA C 55 53.400 53.677 -0.277 1
1 615 . 20 1 1 A 55 55 GLU CB C 55 30.100 32.367 -2.267 1
1 617 . 20 1 1 A 55 55 GLU N N 55 122.800 118.821 3.979 1
1 618 . 20 1 1 A 56 56 PRO HA H 56 4.670 4.589 0.081 1
1 625 . 20 1 1 A 56 56 PRO C C 56 176.200 176.366 -0.166 1
1 626 . 20 1 1 A 56 56 PRO CA C 56 62.900 63.273 -0.373 1
1 627 . 20 1 1 A 56 56 PRO CB C 56 29.200 31.860 -2.660 1
1 630 . 20 1 1 A 57 57 VAL H H 57 8.010 8.385 -0.375 1
1 631 . 20 1 1 A 57 57 VAL HA H 57 4.590 4.980 -0.390 1
1 639 . 20 1 1 A 57 57 VAL CA C 57 58.600 58.297 0.303 1
1 640 . 20 1 1 A 57 57 VAL CB C 57 32.800 34.926 -2.126 1
1 643 . 20 1 1 A 57 57 VAL N N 57 121.400 117.363 4.037 1
1 644 . 20 1 1 A 58 58 PRO HA H 58 4.450 4.678 -0.228 1
1 651 . 20 1 1 A 58 58 PRO C C 58 177.500 177.881 -0.381 1
1 652 . 20 1 1 A 58 58 PRO CA C 58 62.600 62.746 -0.146 1
1 653 . 20 1 1 A 58 58 PRO CB C 58 32.200 32.574 -0.374 1
1 656 . 20 1 1 A 59 59 ASN H H 59 8.890 9.288 -0.398 1
1 657 . 20 1 1 A 59 59 ASN HA H 59 4.330 4.443 -0.113 1
1 662 . 20 1 1 A 59 59 ASN C C 59 177.600 176.953 0.647 1
1 663 . 20 1 1 A 59 59 ASN CA C 59 56.300 56.264 0.036 1
1 664 . 20 1 1 A 59 59 ASN CB C 59 38.400 38.976 -0.576 1
1 665 . 20 1 1 A 59 59 ASN N N 59 122.200 123.280 -1.080 1
1 667 . 20 1 1 A 60 60 SER H H 60 8.660 8.065 0.595 1
1 668 . 20 1 1 A 60 60 SER HA H 60 4.010 4.103 -0.093 1
1 671 . 20 1 1 A 60 60 SER C C 60 176.200 176.104 0.096 1
1 672 . 20 1 1 A 60 60 SER CA C 60 60.800 61.619 -0.819 1
1 673 . 20 1 1 A 60 60 SER CB C 60 61.500 63.056 -1.556 1
1 674 . 20 1 1 A 60 60 SER N N 60 113.200 115.910 -2.710 1
1 675 . 20 1 1 A 61 61 GLN H H 61 7.420 7.619 -0.199 1
1 676 . 20 1 1 A 61 61 GLN HA H 61 4.280 4.132 0.148 1
1 683 . 20 1 1 A 61 61 GLN C C 61 178.600 178.532 0.068 1
1 684 . 20 1 1 A 61 61 GLN CA C 61 57.900 58.850 -0.950 1
1 685 . 20 1 1 A 61 61 GLN CB C 61 28.600 28.301 0.299 1
1 687 . 20 1 1 A 61 61 GLN N N 61 122.200 120.677 1.523 1
1 689 . 20 1 1 A 62 62 LEU H H 62 7.430 7.995 -0.565 1
1 690 . 20 1 1 A 62 62 LEU HA H 62 3.850 4.094 -0.244 1
1 700 . 20 1 1 A 62 62 LEU C C 62 178.800 178.838 -0.038 1
1 701 . 20 1 1 A 62 62 LEU CA C 62 57.900 58.059 -0.159 1
1 702 . 20 1 1 A 62 62 LEU CB C 62 42.100 41.942 0.158 1
1 706 . 20 1 1 A 62 62 LEU N N 62 120.600 119.788 0.812 1
1 707 . 20 1 1 A 63 63 VAL H H 63 8.200 8.211 -0.011 1
1 708 . 20 1 1 A 63 63 VAL HA H 63 3.370 3.488 -0.118 1
1 716 . 20 1 1 A 63 63 VAL C C 63 178.000 178.166 -0.166 1
1 717 . 20 1 1 A 63 63 VAL CA C 63 66.600 67.025 -0.425 1
1 718 . 20 1 1 A 63 63 VAL CB C 63 31.700 31.324 0.376 1
1 721 . 20 1 1 A 63 63 VAL N N 63 118.200 118.062 0.138 1
1 722 . 20 1 1 A 64 64 ASP H H 64 7.960 7.938 0.022 1
1 723 . 20 1 1 A 64 64 ASP HA H 64 4.460 4.447 0.013 1
1 726 . 20 1 1 A 64 64 ASP C C 64 178.100 178.492 -0.392 1
1 727 . 20 1 1 A 64 64 ASP CA C 64 57.700 57.383 0.317 1
1 728 . 20 1 1 A 64 64 ASP CB C 64 39.800 41.204 -1.404 1
1 729 . 20 1 1 A 64 64 ASP N N 64 120.200 120.290 -0.090 1
1 730 . 20 1 1 A 65 65 THR H H 65 8.380 8.624 -0.244 1
1 731 . 20 1 1 A 65 65 THR HA H 65 3.970 4.033 -0.063 1
1 736 . 20 1 1 A 65 65 THR C C 65 176.500 177.190 -0.690 1
1 737 . 20 1 1 A 65 65 THR CA C 65 66.500 66.571 -0.071 1
1 738 . 20 1 1 A 65 65 THR CB C 65 67.800 68.006 -0.206 1
1 740 . 20 1 1 A 65 65 THR N N 65 118.100 115.158 2.942 1
1 741 . 20 1 1 A 66 66 GLY H H 66 8.900 8.572 0.328 1
1 742 . 20 1 1 A 66 66 GLY HA2 H 66 3.630 3.703 -0.073 1
1 743 . 20 1 1 A 66 66 GLY HA3 H 66 3.630 3.703 -0.073 1
1 744 . 20 1 1 A 66 66 GLY C C 66 174.200 175.732 -1.532 1
1 745 . 20 1 1 A 66 66 GLY CA C 66 47.500 47.294 0.206 1
1 746 . 20 1 1 A 66 66 GLY N N 66 110.500 107.558 2.942 1
1 747 . 20 1 1 A 67 67 HIS H H 67 8.650 8.272 0.378 1
1 748 . 20 1 1 A 67 67 HIS HA H 67 4.220 4.076 0.144 1
1 752 . 20 1 1 A 67 67 HIS C C 67 176.900 177.408 -0.508 1
1 753 . 20 1 1 A 67 67 HIS CA C 67 59.000 59.379 -0.379 1
1 754 . 20 1 1 A 67 67 HIS CB C 67 27.800 29.701 -1.901 1
1 756 . 20 1 1 A 67 67 HIS N N 67 120.100 121.845 -1.745 1
1 757 . 20 1 1 A 68 68 GLN H H 68 7.860 8.243 -0.383 1
1 758 . 20 1 1 A 68 68 GLN HA H 68 3.990 3.714 0.276 1
1 765 . 20 1 1 A 68 68 GLN C C 68 177.800 177.524 0.276 1
1 766 . 20 1 1 A 68 68 GLN CA C 68 58.800 58.367 0.433 1
1 767 . 20 1 1 A 68 68 GLN CB C 68 28.200 27.514 0.686 1
1 769 . 20 1 1 A 68 68 GLN N N 68 121.400 116.814 4.586 1
1 771 . 20 1 1 A 69 69 LEU H H 69 8.300 8.090 0.210 1
1 772 . 20 1 1 A 69 69 LEU HA H 69 4.330 4.333 -0.003 1
1 782 . 20 1 1 A 69 69 LEU C C 69 179.300 179.965 -0.665 1
1 783 . 20 1 1 A 69 69 LEU CA C 69 58.200 58.131 0.069 1
1 784 . 20 1 1 A 69 69 LEU CB C 69 40.500 40.862 -0.362 1
1 788 . 20 1 1 A 69 69 LEU N N 69 120.300 122.095 -1.795 1
1 789 . 20 1 1 A 70 70 LEU H H 70 8.460 8.124 0.336 1
1 790 . 20 1 1 A 70 70 LEU HA H 70 3.880 3.902 -0.022 1
1 800 . 20 1 1 A 70 70 LEU C C 70 179.100 178.995 0.105 1
1 801 . 20 1 1 A 70 70 LEU CA C 70 58.300 57.979 0.321 1
1 802 . 20 1 1 A 70 70 LEU CB C 70 41.500 40.425 1.075 1
1 806 . 20 1 1 A 70 70 LEU N N 70 121.200 119.878 1.322 1
1 807 . 20 1 1 A 71 71 ASP H H 71 8.140 7.672 0.468 1
1 808 . 20 1 1 A 71 71 ASP HA H 71 4.420 4.169 0.251 1
1 811 . 20 1 1 A 71 71 ASP C C 71 180.000 178.077 1.923 1
1 812 . 20 1 1 A 71 71 ASP CA C 71 57.300 57.087 0.213 1
1 813 . 20 1 1 A 71 71 ASP CB C 71 39.300 41.181 -1.881 1
1 814 . 20 1 1 A 71 71 ASP N N 71 121.100 119.198 1.902 1
1 815 . 20 1 1 A 72 72 TYR H H 72 8.320 7.743 0.577 1
1 816 . 20 1 1 A 72 72 TYR HA H 72 4.550 4.386 0.164 1
1 823 . 20 1 1 A 72 72 TYR C C 72 179.100 178.810 0.290 1
1 824 . 20 1 1 A 72 72 TYR CA C 72 60.500 61.024 -0.524 1
1 825 . 20 1 1 A 72 72 TYR CB C 72 37.600 37.930 -0.330 1
1 828 . 20 1 1 A 72 72 TYR N N 72 120.300 117.885 2.415 1
1 829 . 20 1 1 A 73 73 CYS H H 73 8.850 8.641 0.209 1
1 830 . 20 1 1 A 73 73 CYS HA H 73 4.380 4.598 -0.218 1
1 834 . 20 1 1 A 73 73 CYS C C 73 177.300 177.283 0.017 1
1 835 . 20 1 1 A 73 73 CYS CA C 73 64.400 63.530 0.870 1
1 836 . 20 1 1 A 73 73 CYS CB C 73 27.600 26.558 1.042 1
1 837 . 20 1 1 A 73 73 CYS N N 73 116.800 118.550 -1.750 1
1 838 . 20 1 1 A 74 74 SER H H 74 8.410 8.434 -0.024 1
1 839 . 20 1 1 A 74 74 SER HA H 74 4.290 4.276 0.014 1
1 842 . 20 1 1 A 74 74 SER C C 74 176.300 176.836 -0.536 1
1 843 . 20 1 1 A 74 74 SER CA C 74 61.400 61.135 0.265 1
1 844 . 20 1 1 A 74 74 SER CB C 74 62.600 63.193 -0.593 1
1 845 . 20 1 1 A 74 74 SER N N 74 115.900 116.034 -0.134 1
1 846 . 20 1 1 A 75 75 GLY H H 75 7.790 8.105 -0.315 1
1 847 . 20 1 1 A 75 75 GLY HA2 H 75 4.320 3.784 0.536 1
1 848 . 20 1 1 A 75 75 GLY HA3 H 75 3.900 3.813 0.087 1
1 849 . 20 1 1 A 75 75 GLY C C 75 174.600 175.339 -0.739 1
1 850 . 20 1 1 A 75 75 GLY CA C 75 45.600 47.006 -1.406 1
1 851 . 20 1 1 A 75 75 GLY N N 75 107.500 107.129 0.371 1
1 852 . 20 1 1 A 76 76 TYR H H 76 8.040 8.495 -0.455 1
1 853 . 20 1 1 A 76 76 TYR HA H 76 4.310 4.053 0.257 1
1 860 . 20 1 1 A 76 76 TYR C C 76 176.200 177.632 -1.432 1
1 861 . 20 1 1 A 76 76 TYR CA C 76 60.000 61.044 -1.044 1
1 862 . 20 1 1 A 76 76 TYR CB C 76 40.700 38.679 2.021 1
1 865 . 20 1 1 A 76 76 TYR N N 76 121.900 123.480 -1.580 1
1 866 . 20 1 1 A 77 77 VAL H H 77 7.540 8.542 -1.002 1
1 867 . 20 1 1 A 77 77 VAL HA H 77 3.450 3.597 -0.147 1
1 875 . 20 1 1 A 77 77 VAL C C 77 175.500 177.258 -1.758 1
1 876 . 20 1 1 A 77 77 VAL CA C 77 65.500 64.532 0.968 1
1 877 . 20 1 1 A 77 77 VAL CB C 77 31.600 31.265 0.335 1
1 880 . 20 1 1 A 77 77 VAL N N 77 116.600 119.399 -2.799 1
1 881 . 20 1 1 A 78 78 ASP H H 78 7.580 7.687 -0.107 1
1 882 . 20 1 1 A 78 78 ASP HA H 78 4.380 4.313 0.067 1
1 885 . 20 1 1 A 78 78 ASP C C 78 177.000 177.391 -0.391 1
1 886 . 20 1 1 A 78 78 ASP CA C 78 55.800 57.241 -1.441 1
1 887 . 20 1 1 A 78 78 ASP CB C 78 39.900 41.199 -1.299 1
1 888 . 20 1 1 A 78 78 ASP N N 78 116.400 120.952 -4.552 1
1 889 . 20 1 1 A 79 79 CYS H H 79 8.040 7.565 0.475 1
1 890 . 20 1 1 A 79 79 CYS HA H 79 4.110 4.443 -0.333 1
1 893 . 20 1 1 A 79 79 CYS C C 79 174.200 174.779 -0.579 1
1 894 . 20 1 1 A 79 79 CYS CA C 79 58.600 58.298 0.302 1
1 895 . 20 1 1 A 79 79 CYS CB C 79 27.200 27.355 -0.155 1
1 896 . 20 1 1 A 79 79 CYS N N 79 117.000 114.819 2.181 1
1 897 . 20 1 1 A 80 80 ILE H H 80 6.960 6.810 0.150 1
1 898 . 20 1 1 A 80 80 ILE HA H 80 4.120 4.010 0.110 1
1 908 . 20 1 1 A 80 80 ILE CA C 80 58.700 59.998 -1.298 1
1 909 . 20 1 1 A 80 80 ILE CB C 80 38.500 38.187 0.313 1
1 913 . 20 1 1 A 80 80 ILE N N 80 123.200 123.114 0.086 1
1 914 . 20 1 1 A 81 81 PRO HA H 81 4.340 4.469 -0.129 1
1 921 . 20 1 1 A 81 81 PRO C C 81 178.000 176.349 1.651 1
1 922 . 20 1 1 A 81 81 PRO CA C 81 64.700 64.469 0.231 1
1 923 . 20 1 1 A 81 81 PRO CB C 81 32.600 32.123 0.477 1
1 926 . 20 1 1 A 82 82 GLN H H 82 7.560 8.040 -0.480 1
1 927 . 20 1 1 A 82 82 GLN HA H 82 4.600 4.505 0.095 1
1 934 . 20 1 1 A 82 82 GLN C C 82 177.400 176.326 1.074 1
1 935 . 20 1 1 A 82 82 GLN CA C 82 55.600 55.585 0.015 1
1 936 . 20 1 1 A 82 82 GLN CB C 82 28.800 29.293 -0.493 1
1 938 . 20 1 1 A 82 82 GLN N N 82 115.900 118.602 -2.702 1
1 940 . 20 1 1 A 83 83 THR H H 83 8.880 8.615 0.265 1
1 941 . 20 1 1 A 83 83 THR HA H 83 3.750 3.920 -0.170 1
1 946 . 20 1 1 A 83 83 THR C C 83 176.300 176.469 -0.169 1
1 947 . 20 1 1 A 83 83 THR CA C 83 66.500 66.603 -0.103 1
1 948 . 20 1 1 A 83 83 THR CB C 83 68.700 68.789 -0.089 1
1 950 . 20 1 1 A 83 83 THR N N 83 122.700 119.062 3.638 1
1 951 . 20 1 1 A 84 84 ARG H H 84 8.990 8.234 0.756 1
1 952 . 20 1 1 A 84 84 ARG HA H 84 4.250 4.014 0.236 1
1 960 . 20 1 1 A 84 84 ARG C C 84 178.900 178.809 0.091 1
1 961 . 20 1 1 A 84 84 ARG CA C 84 59.100 59.532 -0.432 1
1 962 . 20 1 1 A 84 84 ARG CB C 84 29.300 29.970 -0.670 1
1 965 . 20 1 1 A 84 84 ARG N N 84 120.100 121.104 -1.004 1
1 967 . 20 1 1 A 85 85 ASN H H 85 7.270 8.290 -1.020 1
1 968 . 20 1 1 A 85 85 ASN HA H 85 4.810 4.647 0.163 1
1 973 . 20 1 1 A 85 85 ASN C C 85 176.800 178.120 -1.320 1
1 974 . 20 1 1 A 85 85 ASN CA C 85 54.800 56.255 -1.455 1
1 975 . 20 1 1 A 85 85 ASN CB C 85 37.600 38.441 -0.841 1
1 976 . 20 1 1 A 85 85 ASN N N 85 117.400 118.304 -0.904 1
1 978 . 20 1 1 A 86 86 LYS H H 86 8.340 8.098 0.242 1
1 979 . 20 1 1 A 86 86 LYS HA H 86 3.890 4.048 -0.158 1
1 988 . 20 1 1 A 86 86 LYS C C 86 178.600 178.866 -0.266 1
1 989 . 20 1 1 A 86 86 LYS CA C 86 60.800 59.145 1.655 1
1 990 . 20 1 1 A 86 86 LYS CB C 86 32.700 32.143 0.557 1
1 994 . 20 1 1 A 86 86 LYS N N 86 124.200 120.885 3.315 1
1 995 . 20 1 1 A 87 87 PHE H H 87 8.120 8.653 -0.533 1
1 996 . 20 1 1 A 87 87 PHE HA H 87 4.260 4.226 0.034 1
1 1004 . 20 1 1 A 87 87 PHE C C 87 178.100 177.386 0.714 1
1 1005 . 20 1 1 A 87 87 PHE CA C 87 61.300 61.684 -0.384 1
1 1006 . 20 1 1 A 87 87 PHE CB C 87 38.200 39.179 -0.979 1
1 1010 . 20 1 1 A 87 87 PHE N N 87 118.300 120.863 -2.563 1
1 1011 . 20 1 1 A 88 88 ALA H H 88 7.860 7.960 -0.100 1
1 1012 . 20 1 1 A 88 88 ALA HA H 88 4.200 4.116 0.084 1
1 1016 . 20 1 1 A 88 88 ALA C C 88 180.600 179.607 0.993 1
1 1017 . 20 1 1 A 88 88 ALA CA C 88 54.900 55.052 -0.152 1
1 1018 . 20 1 1 A 88 88 ALA CB C 88 18.100 18.317 -0.217 1
1 1019 . 20 1 1 A 88 88 ALA N N 88 121.700 120.793 0.907 1
1 1020 . 20 1 1 A 89 89 PHE H H 89 8.690 8.864 -0.174 1
1 1021 . 20 1 1 A 89 89 PHE HA H 89 4.080 4.149 -0.069 1
1 1029 . 20 1 1 A 89 89 PHE C C 89 176.300 177.585 -1.285 1
1 1030 . 20 1 1 A 89 89 PHE CA C 89 62.000 61.160 0.840 1
1 1031 . 20 1 1 A 89 89 PHE CB C 89 39.800 39.119 0.681 1
1 1035 . 20 1 1 A 89 89 PHE N N 89 120.100 120.304 -0.204 1
1 1036 . 20 1 1 A 90 90 ARG H H 90 8.560 8.656 -0.096 1
1 1037 . 20 1 1 A 90 90 ARG HA H 90 3.790 3.902 -0.112 1
1 1045 . 20 1 1 A 90 90 ARG C C 90 179.600 178.501 1.099 1
1 1046 . 20 1 1 A 90 90 ARG CA C 90 60.000 59.633 0.367 1
1 1047 . 20 1 1 A 90 90 ARG CB C 90 30.000 30.171 -0.171 1
1 1050 . 20 1 1 A 90 90 ARG N N 90 118.000 117.925 0.075 1
1 1052 . 20 1 1 A 91 91 GLU H H 91 8.120 8.067 0.053 1
1 1053 . 20 1 1 A 91 91 GLU HA H 91 3.980 3.955 0.025 1
1 1058 . 20 1 1 A 91 91 GLU C C 91 178.400 179.045 -0.645 1
1 1059 . 20 1 1 A 91 91 GLU CA C 91 58.900 59.266 -0.366 1
1 1060 . 20 1 1 A 91 91 GLU CB C 91 28.800 29.020 -0.220 1
1 1062 . 20 1 1 A 91 91 GLU N N 91 119.300 117.622 1.678 1
1 1063 . 20 1 1 A 92 92 ALA H H 92 7.820 8.051 -0.231 1
1 1064 . 20 1 1 A 92 92 ALA HA H 92 4.050 3.968 0.082 1
1 1068 . 20 1 1 A 92 92 ALA C C 92 179.800 179.827 -0.027 1
1 1069 . 20 1 1 A 92 92 ALA CA C 92 55.000 55.212 -0.212 1
1 1070 . 20 1 1 A 92 92 ALA CB C 92 18.000 18.151 -0.151 1
1 1071 . 20 1 1 A 92 92 ALA N N 92 123.400 122.147 1.253 1
1 1072 . 20 1 1 A 93 93 VAL H H 93 8.430 7.908 0.522 1
1 1073 . 20 1 1 A 93 93 VAL HA H 93 3.250 3.304 -0.054 1
1 1081 . 20 1 1 A 93 93 VAL C C 93 177.900 177.907 -0.007 1
1 1082 . 20 1 1 A 93 93 VAL CA C 93 66.800 66.670 0.130 1
1 1083 . 20 1 1 A 93 93 VAL CB C 93 31.300 31.051 0.249 1
1 1086 . 20 1 1 A 93 93 VAL N N 93 119.900 118.447 1.453 1
1 1087 . 20 1 1 A 94 94 SER H H 94 7.990 8.057 -0.067 1
1 1088 . 20 1 1 A 94 94 SER HA H 94 4.230 4.168 0.062 1
1 1091 . 20 1 1 A 94 94 SER C C 94 177.200 176.589 0.611 1
1 1092 . 20 1 1 A 94 94 SER CA C 94 61.600 62.097 -0.497 1
1 1093 . 20 1 1 A 94 94 SER CB C 94 62.700 62.769 -0.069 1
1 1094 . 20 1 1 A 94 94 SER N N 94 116.000 116.593 -0.593 1
1 1095 . 20 1 1 A 95 95 LYS H H 95 7.710 7.517 0.193 1
1 1096 . 20 1 1 A 95 95 LYS HA H 95 4.020 4.047 -0.027 1
1 1105 . 20 1 1 A 95 95 LYS C C 95 179.400 179.075 0.325 1
1 1106 . 20 1 1 A 95 95 LYS CA C 95 59.600 59.542 0.058 1
1 1107 . 20 1 1 A 95 95 LYS CB C 95 32.300 32.431 -0.131 1
1 1111 . 20 1 1 A 95 95 LYS N N 95 121.400 121.897 -0.497 1
1 1112 . 20 1 1 A 96 96 LEU H H 96 8.270 7.914 0.356 1
1 1113 . 20 1 1 A 96 96 LEU HA H 96 4.040 3.965 0.075 1
1 1123 . 20 1 1 A 96 96 LEU C C 96 177.700 178.279 -0.579 1
1 1124 . 20 1 1 A 96 96 LEU CA C 96 58.600 58.243 0.357 1
1 1125 . 20 1 1 A 96 96 LEU CB C 96 41.000 41.486 -0.486 1
1 1129 . 20 1 1 A 96 96 LEU N N 96 124.800 121.052 3.748 1
1 1130 . 20 1 1 A 97 97 GLU H H 97 8.500 8.461 0.039 1
1 1131 . 20 1 1 A 97 97 GLU HA H 97 3.760 4.050 -0.290 1
1 1136 . 20 1 1 A 97 97 GLU C C 97 179.100 179.212 -0.112 1
1 1137 . 20 1 1 A 97 97 GLU CA C 97 59.900 59.013 0.887 1
1 1138 . 20 1 1 A 97 97 GLU CB C 97 28.700 29.224 -0.524 1
1 1140 . 20 1 1 A 97 97 GLU N N 97 119.000 117.366 1.634 1
1 1141 . 20 1 1 A 98 98 LEU H H 98 7.740 8.298 -0.558 1
1 1142 . 20 1 1 A 98 98 LEU HA H 98 4.110 3.985 0.125 1
1 1152 . 20 1 1 A 98 98 LEU C C 98 179.700 179.377 0.323 1
1 1153 . 20 1 1 A 98 98 LEU CA C 98 57.900 57.978 -0.078 1
1 1154 . 20 1 1 A 98 98 LEU CB C 98 41.800 41.775 0.025 1
1 1158 . 20 1 1 A 98 98 LEU N N 98 119.200 121.193 -1.993 1
1 1159 . 20 1 1 A 99 99 SER H H 99 8.290 8.172 0.118 1
1 1160 . 20 1 1 A 99 99 SER HA H 99 4.220 4.273 -0.053 1
1 1163 . 20 1 1 A 99 99 SER C C 99 176.600 177.524 -0.924 1
1 1164 . 20 1 1 A 99 99 SER CA C 99 62.400 61.158 1.242 1
1 1165 . 20 1 1 A 99 99 SER CB C 99 63.200 62.778 0.422 1
1 1166 . 20 1 1 A 99 99 SER N N 99 116.300 114.275 2.025 1
1 1167 . 20 1 1 A 100 100 LEU H H 100 8.490 8.420 0.070 1
1 1168 . 20 1 1 A 100 100 LEU HA H 100 3.960 3.981 -0.021 1
1 1178 . 20 1 1 A 100 100 LEU C C 100 179.300 179.661 -0.361 1
1 1179 . 20 1 1 A 100 100 LEU CA C 100 57.700 57.937 -0.237 1
1 1180 . 20 1 1 A 100 100 LEU CB C 100 41.300 41.423 -0.123 1
1 1184 . 20 1 1 A 100 100 LEU N N 100 120.900 122.305 -1.405 1
1 1185 . 20 1 1 A 101 101 GLN H H 101 7.680 8.607 -0.927 1
1 1186 . 20 1 1 A 101 101 GLN HA H 101 4.100 3.951 0.149 1
1 1193 . 20 1 1 A 101 101 GLN C C 101 178.700 177.763 0.937 1
1 1194 . 20 1 1 A 101 101 GLN CA C 101 58.800 58.812 -0.012 1
1 1195 . 20 1 1 A 101 101 GLN CB C 101 27.900 27.764 0.136 1
1 1197 . 20 1 1 A 101 101 GLN N N 101 119.100 118.087 1.013 1
1 1199 . 20 1 1 A 102 102 GLU H H 102 7.850 7.931 -0.081 1
1 1200 . 20 1 1 A 102 102 GLU HA H 102 4.050 4.119 -0.069 1
1 1205 . 20 1 1 A 102 102 GLU C C 102 179.100 179.064 0.036 1
1 1206 . 20 1 1 A 102 102 GLU CA C 102 58.400 59.404 -1.004 1
1 1207 . 20 1 1 A 102 102 GLU CB C 102 28.600 29.225 -0.625 1
1 1209 . 20 1 1 A 102 102 GLU N N 102 118.400 118.913 -0.513 1
1 1210 . 20 1 1 A 103 103 LEU H H 103 8.080 8.351 -0.271 1
1 1211 . 20 1 1 A 103 103 LEU HA H 103 4.020 3.997 0.023 1
1 1221 . 20 1 1 A 103 103 LEU C C 103 178.200 178.226 -0.026 1
1 1222 . 20 1 1 A 103 103 LEU CA C 103 57.000 58.271 -1.271 1
1 1223 . 20 1 1 A 103 103 LEU CB C 103 41.900 41.617 0.283 1
1 1227 . 20 1 1 A 103 103 LEU N N 103 120.600 123.226 -2.626 1
1 1228 . 20 1 1 A 104 104 GLN H H 104 7.900 8.570 -0.670 1
1 1229 . 20 1 1 A 104 104 GLN HA H 104 4.090 4.069 0.021 1
1 1236 . 20 1 1 A 104 104 GLN C C 104 177.300 176.956 0.344 1
1 1237 . 20 1 1 A 104 104 GLN CA C 104 58.100 58.227 -0.127 1
1 1238 . 20 1 1 A 104 104 GLN CB C 104 29.400 27.962 1.438 1
1 1240 . 20 1 1 A 104 104 GLN N N 104 117.700 116.647 1.053 1
1 1242 . 20 1 1 A 105 105 VAL H H 105 7.620 7.308 0.312 1
1 1243 . 20 1 1 A 105 105 VAL HA H 105 4.190 4.323 -0.133 1
1 1251 . 20 1 1 A 105 105 VAL C C 105 176.800 176.912 -0.112 1
1 1252 . 20 1 1 A 105 105 VAL CA C 105 62.600 61.936 0.664 1
1 1253 . 20 1 1 A 105 105 VAL CB C 105 32.000 33.208 -1.208 1
1 1256 . 20 1 1 A 105 105 VAL N N 105 114.900 115.647 -0.747 1
1 1257 . 20 1 1 A 106 106 SER H H 106 7.900 7.935 -0.035 1
1 1258 . 20 1 1 A 106 106 SER HA H 106 4.460 4.741 -0.281 1
1 1261 . 20 1 1 A 106 106 SER C C 106 175.000 174.926 0.074 1
1 1262 . 20 1 1 A 106 106 SER CA C 106 58.900 57.942 0.958 1
1 1263 . 20 1 1 A 106 106 SER CB C 106 63.900 64.347 -0.447 1
1 1264 . 20 1 1 A 106 106 SER N N 106 116.900 117.311 -0.411 1
1 1265 . 20 1 1 A 107 107 SER H H 107 8.230 7.878 0.352 1
1 1266 . 20 1 1 A 107 107 SER HA H 107 4.390 4.214 0.176 1
1 1269 . 20 1 1 A 107 107 SER C C 107 174.600 174.434 0.166 1
1 1270 . 20 1 1 A 107 107 SER CA C 107 58.400 61.418 -3.018 1
1 1271 . 20 1 1 A 107 107 SER CB C 107 63.600 63.032 0.568 1
1 1272 . 20 1 1 A 107 107 SER N N 107 117.500 117.024 0.476 1
1 1273 . 20 1 1 A 108 108 ALA H H 108 8.080 7.804 0.276 1
1 1274 . 20 1 1 A 108 108 ALA HA H 108 4.280 3.904 0.376 1
1 1278 . 20 1 1 A 108 108 ALA C C 108 177.500 176.727 0.773 1
1 1279 . 20 1 1 A 108 108 ALA CA C 108 52.700 55.078 -2.378 1
1 1280 . 20 1 1 A 108 108 ALA CB C 108 19.200 17.644 1.556 1
1 1281 . 20 1 1 A 108 108 ALA N N 108 124.900 122.106 2.794 1
1 1282 . 20 1 1 A 109 109 ALA H H 109 8.080 8.251 -0.171 1
1 1283 . 20 1 1 A 109 109 ALA HA H 109 4.280 4.181 0.099 1
1 1287 . 20 1 1 A 109 109 ALA C C 109 177.700 178.887 -1.187 1
1 1288 . 20 1 1 A 109 109 ALA CA C 109 52.400 53.037 -0.637 1
1 1289 . 20 1 1 A 109 109 ALA CB C 109 19.400 19.529 -0.129 1
1 1290 . 20 1 1 A 109 109 ALA N N 109 123.000 121.076 1.924 1
1 1291 . 20 1 1 A 110 110 ALA H H 110 8.300 8.538 -0.238 1
1 1292 . 20 1 1 A 110 110 ALA HA H 110 4.280 4.071 0.209 1
1 1296 . 20 1 1 A 110 110 ALA C C 110 178.200 178.579 -0.379 1
1 1297 . 20 1 1 A 110 110 ALA CA C 110 52.700 54.633 -1.933 1
1 1298 . 20 1 1 A 110 110 ALA CB C 110 19.200 19.582 -0.382 1
1 1299 . 20 1 1 A 110 110 ALA N N 110 123.200 126.155 -2.955 1
1 1300 . 20 1 1 A 111 111 GLY H H 111 8.300 7.308 0.992 1
1 1301 . 20 1 1 A 111 111 GLY HA2 H 111 3.930 4.121 -0.191 1
1 1302 . 20 1 1 A 111 111 GLY HA3 H 111 3.940 4.121 -0.181 1
1 1303 . 20 1 1 A 111 111 GLY C C 111 173.700 173.155 0.545 1
1 1304 . 20 1 1 A 111 111 GLY CA C 111 45.100 45.802 -0.702 1
1 1305 . 20 1 1 A 111 111 GLY N N 111 108.000 102.301 5.699 1
1 1306 . 20 1 1 A 112 112 VAL H H 112 7.930 8.288 -0.358 1
1 1307 . 20 1 1 A 112 112 VAL HA H 112 4.420 4.425 -0.005 1
1 1315 . 20 1 1 A 112 112 VAL CA C 112 60.000 59.244 0.756 1
1 1316 . 20 1 1 A 112 112 VAL CB C 112 32.200 32.502 -0.302 1
1 1319 . 20 1 1 A 112 112 VAL N N 112 120.400 121.509 -1.109 1
1 1320 . 20 1 1 A 113 113 PRO HA H 113 4.370 4.284 0.086 1
1 1327 . 20 1 1 A 113 113 PRO C C 113 177.300 178.052 -0.752 1
1 1328 . 20 1 1 A 113 113 PRO CA C 113 63.900 63.923 -0.023 1
1 1329 . 20 1 1 A 113 113 PRO CB C 113 31.800 31.256 0.544 1
1 1332 . 20 1 1 A 114 114 GLY H H 114 8.570 8.874 -0.304 1
1 1333 . 20 1 1 A 114 114 GLY HA2 H 114 3.880 3.969 -0.089 1
1 1334 . 20 1 1 A 114 114 GLY HA3 H 114 4.120 3.969 0.151 1
1 1335 . 20 1 1 A 114 114 GLY C C 114 174.900 175.107 -0.207 1
1 1336 . 20 1 1 A 114 114 GLY CA C 114 45.200 46.097 -0.897 1
1 1337 . 20 1 1 A 114 114 GLY N N 114 109.000 113.140 -4.140 1
1 1338 . 20 1 1 A 115 115 THR H H 115 7.900 7.393 0.507 1
1 1339 . 20 1 1 A 115 115 THR HA H 115 4.400 4.006 0.394 1
1 1344 . 20 1 1 A 115 115 THR C C 115 174.300 174.313 -0.013 1
1 1345 . 20 1 1 A 115 115 THR CA C 115 61.700 64.872 -3.172 1
1 1346 . 20 1 1 A 115 115 THR CB C 115 69.700 70.211 -0.511 1
1 1348 . 20 1 1 A 115 115 THR N N 115 111.400 115.519 -4.119 1
1 1349 . 20 1 1 A 116 116 ASN H H 116 8.450 8.141 0.309 1
1 1350 . 20 1 1 A 116 116 ASN HA H 116 4.970 5.089 -0.119 1
1 1355 . 20 1 1 A 116 116 ASN CA C 116 51.500 49.755 1.745 1
1 1356 . 20 1 1 A 116 116 ASN CB C 116 38.900 39.636 -0.736 1
1 1357 . 20 1 1 A 116 116 ASN N N 116 123.100 116.960 6.140 1
1 1359 . 20 1 1 A 117 117 PRO HA H 117 4.370 4.350 0.020 1
1 1366 . 20 1 1 A 117 117 PRO C C 117 178.400 178.171 0.229 1
1 1367 . 20 1 1 A 117 117 PRO CA C 117 64.800 64.432 0.368 1
1 1368 . 20 1 1 A 117 117 PRO CB C 117 32.100 31.950 0.150 1
1 1371 . 20 1 1 A 118 118 VAL H H 118 7.750 7.530 0.220 1
1 1372 . 20 1 1 A 118 118 VAL HA H 118 3.810 3.727 0.083 1
1 1380 . 20 1 1 A 118 118 VAL C C 118 178.300 178.235 0.065 1
1 1381 . 20 1 1 A 118 118 VAL CA C 118 65.200 65.766 -0.566 1
1 1382 . 20 1 1 A 118 118 VAL CB C 118 31.500 31.501 -0.001 1
1 1385 . 20 1 1 A 118 118 VAL N N 118 118.300 116.473 1.827 1
1 1386 . 20 1 1 A 119 119 LEU H H 119 7.540 8.045 -0.505 1
1 1387 . 20 1 1 A 119 119 LEU HA H 119 4.030 3.883 0.147 1
1 1397 . 20 1 1 A 119 119 LEU C C 119 178.900 179.191 -0.291 1
1 1398 . 20 1 1 A 119 119 LEU CA C 119 57.800 57.941 -0.141 1
1 1399 . 20 1 1 A 119 119 LEU CB C 119 40.700 41.038 -0.338 1
1 1403 . 20 1 1 A 119 119 LEU N N 119 119.700 119.554 0.146 1
1 1404 . 20 1 1 A 120 120 ASN H H 120 8.080 8.334 -0.254 1
1 1405 . 20 1 1 A 120 120 ASN HA H 120 4.420 4.391 0.029 1
1 1410 . 20 1 1 A 120 120 ASN C C 120 178.100 177.692 0.408 1
1 1411 . 20 1 1 A 120 120 ASN CA C 120 56.100 57.006 -0.906 1
1 1412 . 20 1 1 A 120 120 ASN CB C 120 37.800 39.166 -1.366 1
1 1413 . 20 1 1 A 120 120 ASN N N 120 117.700 118.078 -0.378 1
1 1415 . 20 1 1 A 121 121 ASN H H 121 8.120 8.251 -0.131 1
1 1416 . 20 1 1 A 121 121 ASN HA H 121 4.490 4.466 0.024 1
1 1421 . 20 1 1 A 121 121 ASN C C 121 178.000 178.148 -0.148 1
1 1422 . 20 1 1 A 121 121 ASN CA C 121 56.100 56.448 -0.348 1
1 1423 . 20 1 1 A 121 121 ASN CB C 121 37.800 38.583 -0.783 1
1 1424 . 20 1 1 A 121 121 ASN N N 121 120.000 117.397 2.603 1
1 1426 . 20 1 1 A 122 122 LEU H H 122 8.180 8.211 -0.031 1
1 1427 . 20 1 1 A 122 122 LEU HA H 122 4.050 3.902 0.148 1
1 1437 . 20 1 1 A 122 122 LEU C C 122 173.800 178.909 -5.109 1
1 1438 . 20 1 1 A 122 122 LEU CA C 122 58.500 57.886 0.614 1
1 1439 . 20 1 1 A 122 122 LEU CB C 122 41.900 42.032 -0.132 1
1 1443 . 20 1 1 A 122 122 LEU N N 122 122.600 120.642 1.958 1
1 1444 . 20 1 1 A 123 123 LEU H H 123 8.260 8.233 0.027 1
1 1445 . 20 1 1 A 123 123 LEU HA H 123 3.850 3.985 -0.135 1
1 1455 . 20 1 1 A 123 123 LEU C C 123 178.900 178.428 0.472 1
1 1456 . 20 1 1 A 123 123 LEU CA C 123 58.500 58.166 0.334 1
1 1457 . 20 1 1 A 123 123 LEU CB C 123 41.200 41.443 -0.243 1
1 1461 . 20 1 1 A 123 123 LEU N N 123 119.700 120.410 -0.710 1
1 1462 . 20 1 1 A 124 124 SER H H 124 7.950 8.163 -0.213 1
1 1463 . 20 1 1 A 124 124 SER HA H 124 4.240 4.075 0.165 1
1 1466 . 20 1 1 A 124 124 SER C C 124 177.500 177.245 0.255 1
1 1467 . 20 1 1 A 124 124 SER CA C 124 61.600 61.792 -0.192 1
1 1468 . 20 1 1 A 124 124 SER CB C 124 62.600 62.800 -0.200 1
1 1469 . 20 1 1 A 124 124 SER N N 124 113.400 113.938 -0.538 1
1 1470 . 20 1 1 A 125 125 CYS H H 125 8.040 8.445 -0.405 1
1 1471 . 20 1 1 A 125 125 CYS HA H 125 4.350 4.128 0.222 1
1 1474 . 20 1 1 A 125 125 CYS C C 125 176.800 176.879 -0.079 1
1 1475 . 20 1 1 A 125 125 CYS CA C 125 62.600 63.923 -1.323 1
1 1476 . 20 1 1 A 125 125 CYS CB C 125 27.100 26.834 0.266 1
1 1477 . 20 1 1 A 125 125 CYS N N 125 119.800 119.681 0.119 1
1 1478 . 20 1 1 A 126 126 VAL H H 126 8.290 8.518 -0.228 1
1 1479 . 20 1 1 A 126 126 VAL HA H 126 3.430 3.403 0.027 1
1 1487 . 20 1 1 A 126 126 VAL C C 126 177.800 177.755 0.045 1
1 1488 . 20 1 1 A 126 126 VAL CA C 126 67.100 66.946 0.154 1
1 1489 . 20 1 1 A 126 126 VAL CB C 126 31.400 31.356 0.044 1
1 1492 . 20 1 1 A 126 126 VAL N N 126 121.900 120.520 1.380 1
1 1493 . 20 1 1 A 127 127 GLN H H 127 8.200 8.056 0.144 1
1 1494 . 20 1 1 A 127 127 GLN HA H 127 3.970 4.001 -0.031 1
1 1501 . 20 1 1 A 127 127 GLN C C 127 178.200 178.435 -0.235 1
1 1502 . 20 1 1 A 127 127 GLN CA C 127 58.700 58.822 -0.122 1
1 1503 . 20 1 1 A 127 127 GLN CB C 127 27.800 28.176 -0.376 1
1 1505 . 20 1 1 A 127 127 GLN N N 127 119.700 118.345 1.355 1
1 1507 . 20 1 1 A 128 128 GLU H H 128 7.880 7.981 -0.101 1
1 1508 . 20 1 1 A 128 128 GLU HA H 128 4.200 4.102 0.098 1
1 1513 . 20 1 1 A 128 128 GLU C C 128 178.400 178.769 -0.369 1
1 1514 . 20 1 1 A 128 128 GLU CA C 128 59.000 58.929 0.071 1
1 1515 . 20 1 1 A 128 128 GLU CB C 128 28.400 29.446 -1.046 1
1 1517 . 20 1 1 A 128 128 GLU N N 128 119.800 119.090 0.710 1
1 1518 . 20 1 1 A 129 129 ILE H H 129 8.000 8.488 -0.488 1
1 1519 . 20 1 1 A 129 129 ILE HA H 129 3.460 3.633 -0.173 1
1 1529 . 20 1 1 A 129 129 ILE C C 129 176.800 178.119 -1.319 1
1 1530 . 20 1 1 A 129 129 ILE CA C 129 66.100 65.503 0.597 1
1 1531 . 20 1 1 A 129 129 ILE CB C 129 38.200 37.448 0.752 1
1 1535 . 20 1 1 A 129 129 ILE N N 129 119.500 120.195 -0.695 1
1 1536 . 20 1 1 A 130 130 SER H H 130 8.040 8.315 -0.275 1
1 1537 . 20 1 1 A 130 130 SER HA H 130 3.780 4.161 -0.381 1
1 1540 . 20 1 1 A 130 130 SER C C 130 176.200 176.411 -0.211 1
1 1541 . 20 1 1 A 130 130 SER CA C 130 62.100 61.477 0.623 1
1 1542 . 20 1 1 A 130 130 SER CB C 130 62.600 62.154 0.446 1
1 1543 . 20 1 1 A 130 130 SER N N 130 112.800 114.929 -2.129 1
1 1544 . 20 1 1 A 131 131 ASP H H 131 8.270 7.841 0.429 1
1 1545 . 20 1 1 A 131 131 ASP HA H 131 4.310 4.414 -0.104 1
1 1548 . 20 1 1 A 131 131 ASP C C 131 179.200 178.585 0.615 1
1 1549 . 20 1 1 A 131 131 ASP CA C 131 56.800 57.584 -0.784 1
1 1550 . 20 1 1 A 131 131 ASP CB C 131 40.900 41.222 -0.322 1
1 1551 . 20 1 1 A 131 131 ASP N N 131 119.600 121.559 -1.959 1
1 1552 . 20 1 1 A 132 132 VAL H H 132 8.470 8.239 0.231 1
1 1553 . 20 1 1 A 132 132 VAL HA H 132 3.520 3.754 -0.234 1
1 1561 . 20 1 1 A 132 132 VAL C C 132 178.700 178.573 0.127 1
1 1562 . 20 1 1 A 132 132 VAL CA C 132 66.500 65.993 0.507 1
1 1563 . 20 1 1 A 132 132 VAL CB C 132 31.500 31.837 -0.337 1
1 1566 . 20 1 1 A 132 132 VAL N N 132 118.100 119.557 -1.457 1
1 1567 . 20 1 1 A 133 133 VAL H H 133 8.140 7.745 0.395 1
1 1568 . 20 1 1 A 133 133 VAL HA H 133 3.770 3.736 0.034 1
1 1576 . 20 1 1 A 133 133 VAL C C 133 176.500 176.366 0.134 1
1 1577 . 20 1 1 A 133 133 VAL CA C 133 65.100 66.401 -1.301 1
1 1578 . 20 1 1 A 133 133 VAL CB C 133 31.600 31.300 0.300 1
1 1581 . 20 1 1 A 133 133 VAL N N 133 117.000 120.342 -3.342 1
1 1582 . 20 1 1 A 134 134 GLN H H 134 7.490 7.663 -0.173 1
1 1583 . 20 1 1 A 134 134 GLN HA H 134 4.350 4.447 -0.097 1
1 1590 . 20 1 1 A 134 134 GLN C C 134 175.400 176.198 -0.798 1
1 1591 . 20 1 1 A 134 134 GLN CA C 134 56.700 55.696 1.004 1
1 1592 . 20 1 1 A 134 134 GLN CB C 134 30.500 29.169 1.331 1
1 1594 . 20 1 1 A 134 134 GLN N N 134 116.300 117.389 -1.089 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 127 0.957 1
2 1 1 1 "RMS(OBS, PRED)" CA 133 1.209 1
3 1 1 1 "RMS(OBS, PRED)" CB 126 0.993 1
4 1 1 1 "RMS(OBS, PRED)" H 126 0.399 1
5 1 1 1 "RMS(OBS, PRED)" HA 140 0.213 1
6 1 1 1 "RMS(OBS, PRED)" N 126 2.700 1
7 1 2 1 "RMS(OBS, PRED)" C 127 0.968 1
8 1 2 1 "RMS(OBS, PRED)" CA 133 1.246 1
9 1 2 1 "RMS(OBS, PRED)" CB 126 1.250 1
10 1 2 1 "RMS(OBS, PRED)" H 126 0.430 1
11 1 2 1 "RMS(OBS, PRED)" HA 140 0.238 1
12 1 2 1 "RMS(OBS, PRED)" N 126 2.663 1
13 1 3 1 "RMS(OBS, PRED)" C 127 0.934 1
14 1 3 1 "RMS(OBS, PRED)" CA 133 1.182 1
15 1 3 1 "RMS(OBS, PRED)" CB 126 1.091 1
16 1 3 1 "RMS(OBS, PRED)" H 126 0.425 1
17 1 3 1 "RMS(OBS, PRED)" HA 140 0.216 1
18 1 3 1 "RMS(OBS, PRED)" N 126 2.394 1
19 1 4 1 "RMS(OBS, PRED)" C 127 1.034 1
20 1 4 1 "RMS(OBS, PRED)" CA 133 1.166 1
21 1 4 1 "RMS(OBS, PRED)" CB 126 1.256 1
22 1 4 1 "RMS(OBS, PRED)" H 126 0.419 1
23 1 4 1 "RMS(OBS, PRED)" HA 140 0.248 1
24 1 4 1 "RMS(OBS, PRED)" N 126 2.623 1
25 1 5 1 "RMS(OBS, PRED)" C 127 1.031 1
26 1 5 1 "RMS(OBS, PRED)" CA 133 1.134 1
27 1 5 1 "RMS(OBS, PRED)" CB 126 1.072 1
28 1 5 1 "RMS(OBS, PRED)" H 126 0.430 1
29 1 5 1 "RMS(OBS, PRED)" HA 140 0.200 1
30 1 5 1 "RMS(OBS, PRED)" N 126 2.708 1
31 1 6 1 "RMS(OBS, PRED)" C 127 0.969 1
32 1 6 1 "RMS(OBS, PRED)" CA 133 1.195 1
33 1 6 1 "RMS(OBS, PRED)" CB 126 1.184 1
34 1 6 1 "RMS(OBS, PRED)" H 126 0.410 1
35 1 6 1 "RMS(OBS, PRED)" HA 140 0.237 1
36 1 6 1 "RMS(OBS, PRED)" N 126 2.548 1
37 1 7 1 "RMS(OBS, PRED)" C 127 0.966 1
38 1 7 1 "RMS(OBS, PRED)" CA 133 1.211 1
39 1 7 1 "RMS(OBS, PRED)" CB 126 1.120 1
40 1 7 1 "RMS(OBS, PRED)" H 126 0.403 1
41 1 7 1 "RMS(OBS, PRED)" HA 140 0.200 1
42 1 7 1 "RMS(OBS, PRED)" N 126 2.557 1
43 1 8 1 "RMS(OBS, PRED)" C 127 0.934 1
44 1 8 1 "RMS(OBS, PRED)" CA 133 1.092 1
45 1 8 1 "RMS(OBS, PRED)" CB 126 1.234 1
46 1 8 1 "RMS(OBS, PRED)" H 126 0.405 1
47 1 8 1 "RMS(OBS, PRED)" HA 140 0.206 1
48 1 8 1 "RMS(OBS, PRED)" N 126 2.665 1
49 1 9 1 "RMS(OBS, PRED)" C 127 0.909 1
50 1 9 1 "RMS(OBS, PRED)" CA 133 1.157 1
51 1 9 1 "RMS(OBS, PRED)" CB 126 1.153 1
52 1 9 1 "RMS(OBS, PRED)" H 126 0.431 1
53 1 9 1 "RMS(OBS, PRED)" HA 140 0.217 1
54 1 9 1 "RMS(OBS, PRED)" N 126 2.680 1
55 1 10 1 "RMS(OBS, PRED)" C 127 1.006 1
56 1 10 1 "RMS(OBS, PRED)" CA 133 1.163 1
57 1 10 1 "RMS(OBS, PRED)" CB 126 1.155 1
58 1 10 1 "RMS(OBS, PRED)" H 126 0.407 1
59 1 10 1 "RMS(OBS, PRED)" HA 140 0.238 1
60 1 10 1 "RMS(OBS, PRED)" N 126 2.599 1
61 1 11 1 "RMS(OBS, PRED)" C 127 0.976 1
62 1 11 1 "RMS(OBS, PRED)" CA 133 1.238 1
63 1 11 1 "RMS(OBS, PRED)" CB 126 1.161 1
64 1 11 1 "RMS(OBS, PRED)" H 126 0.438 1
65 1 11 1 "RMS(OBS, PRED)" HA 140 0.232 1
66 1 11 1 "RMS(OBS, PRED)" N 126 2.553 1
67 1 12 1 "RMS(OBS, PRED)" C 127 0.879 1
68 1 12 1 "RMS(OBS, PRED)" CA 133 1.197 1
69 1 12 1 "RMS(OBS, PRED)" CB 126 1.110 1
70 1 12 1 "RMS(OBS, PRED)" H 126 0.406 1
71 1 12 1 "RMS(OBS, PRED)" HA 140 0.214 1
72 1 12 1 "RMS(OBS, PRED)" N 126 2.631 1
73 1 13 1 "RMS(OBS, PRED)" C 127 0.945 1
74 1 13 1 "RMS(OBS, PRED)" CA 133 1.170 1
75 1 13 1 "RMS(OBS, PRED)" CB 126 1.274 1
76 1 13 1 "RMS(OBS, PRED)" H 126 0.412 1
77 1 13 1 "RMS(OBS, PRED)" HA 140 0.242 1
78 1 13 1 "RMS(OBS, PRED)" N 126 2.792 1
79 1 14 1 "RMS(OBS, PRED)" C 127 0.918 1
80 1 14 1 "RMS(OBS, PRED)" CA 133 1.138 1
81 1 14 1 "RMS(OBS, PRED)" CB 126 1.121 1
82 1 14 1 "RMS(OBS, PRED)" H 126 0.413 1
83 1 14 1 "RMS(OBS, PRED)" HA 140 0.219 1
84 1 14 1 "RMS(OBS, PRED)" N 126 2.729 1
85 1 15 1 "RMS(OBS, PRED)" C 127 0.921 1
86 1 15 1 "RMS(OBS, PRED)" CA 133 1.166 1
87 1 15 1 "RMS(OBS, PRED)" CB 126 1.123 1
88 1 15 1 "RMS(OBS, PRED)" H 126 0.422 1
89 1 15 1 "RMS(OBS, PRED)" HA 140 0.214 1
90 1 15 1 "RMS(OBS, PRED)" N 126 2.539 1
91 1 16 1 "RMS(OBS, PRED)" C 127 0.954 1
92 1 16 1 "RMS(OBS, PRED)" CA 133 1.145 1
93 1 16 1 "RMS(OBS, PRED)" CB 126 1.188 1
94 1 16 1 "RMS(OBS, PRED)" H 126 0.405 1
95 1 16 1 "RMS(OBS, PRED)" HA 140 0.224 1
96 1 16 1 "RMS(OBS, PRED)" N 126 2.773 1
97 1 17 1 "RMS(OBS, PRED)" C 127 0.997 1
98 1 17 1 "RMS(OBS, PRED)" CA 133 1.365 1
99 1 17 1 "RMS(OBS, PRED)" CB 126 1.151 1
100 1 17 1 "RMS(OBS, PRED)" H 126 0.441 1
101 1 17 1 "RMS(OBS, PRED)" HA 140 0.238 1
102 1 17 1 "RMS(OBS, PRED)" N 126 2.661 1
103 1 18 1 "RMS(OBS, PRED)" C 127 0.965 1
104 1 18 1 "RMS(OBS, PRED)" CA 133 1.154 1
105 1 18 1 "RMS(OBS, PRED)" CB 126 1.233 1
106 1 18 1 "RMS(OBS, PRED)" H 126 0.438 1
107 1 18 1 "RMS(OBS, PRED)" HA 140 0.263 1
108 1 18 1 "RMS(OBS, PRED)" N 126 2.682 1
109 1 19 1 "RMS(OBS, PRED)" C 127 0.952 1
110 1 19 1 "RMS(OBS, PRED)" CA 133 1.110 1
111 1 19 1 "RMS(OBS, PRED)" CB 126 1.157 1
112 1 19 1 "RMS(OBS, PRED)" H 126 0.453 1
113 1 19 1 "RMS(OBS, PRED)" HA 140 0.203 1
114 1 19 1 "RMS(OBS, PRED)" N 126 2.572 1
115 1 20 1 "RMS(OBS, PRED)" C 127 0.891 1
116 1 20 1 "RMS(OBS, PRED)" CA 133 1.167 1
117 1 20 1 "RMS(OBS, PRED)" CB 126 1.065 1
118 1 20 1 "RMS(OBS, PRED)" H 126 0.420 1
119 1 20 1 "RMS(OBS, PRED)" HA 140 0.198 1
120 1 20 1 "RMS(OBS, PRED)" N 126 2.558 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 A 2 2 GLY HA2 H 2 3.890 3.950 -0.060 2
1 2 . 1 1 A 2 2 GLY HA3 H 2 3.890 4.015 -0.125 2
1 3 . 1 1 A 2 2 GLY C C 2 174.200 173.509 0.691 2
1 4 . 1 1 A 2 2 GLY CA C 2 44.700 45.810 -1.110 2
1 5 . 1 1 A 3 3 HIS H H 3 8.380 8.426 -0.046 2
1 6 . 1 1 A 3 3 HIS HA H 3 4.610 4.730 -0.120 2
1 9 . 1 1 A 3 3 HIS C C 3 174.500 174.990 -0.490 2
1 10 . 1 1 A 3 3 HIS CA C 3 55.200 55.673 -0.473 2
1 11 . 1 1 A 3 3 HIS CB C 3 28.800 30.231 -1.431 2
1 12 . 1 1 A 3 3 HIS N N 3 117.600 121.093 -3.493 2
1 13 . 1 1 A 4 4 HIS H H 4 8.520 8.266 0.254 2
1 14 . 1 1 A 4 4 HIS HA H 4 4.640 4.487 0.152 2
1 17 . 1 1 A 4 4 HIS C C 4 174.200 174.806 -0.606 2
1 18 . 1 1 A 4 4 HIS CA C 4 55.100 56.282 -1.182 2
1 19 . 1 1 A 4 4 HIS CB C 4 28.900 30.098 -1.198 2
1 20 . 1 1 A 4 4 HIS N N 4 119.000 119.721 -0.721 2
1 21 . 1 1 A 5 5 HIS H H 5 8.530 8.248 0.282 2
1 22 . 1 1 A 5 5 HIS HA H 5 4.410 4.606 -0.196 2
1 25 . 1 1 A 5 5 HIS CA C 5 54.900 56.061 -1.161 2
1 26 . 1 1 A 5 5 HIS CB C 5 27.300 30.495 -3.195 2
1 27 . 1 1 A 5 5 HIS N N 5 121.600 118.427 3.173 2
1 28 . 1 1 A 6 6 HIS HA H 6 4.640 4.673 -0.033 2
1 31 . 1 1 A 6 6 HIS C C 6 174.100 174.380 -0.280 2
1 32 . 1 1 A 6 6 HIS CA C 6 55.100 55.426 -0.326 2
1 33 . 1 1 A 6 6 HIS CB C 6 29.100 30.270 -1.170 2
1 34 . 1 1 A 7 7 HIS H H 7 8.690 8.517 0.173 2
1 35 . 1 1 A 7 7 HIS HA H 7 4.650 4.721 -0.071 2
1 38 . 1 1 A 7 7 HIS C C 7 174.200 174.158 0.042 2
1 39 . 1 1 A 7 7 HIS CA C 7 55.200 55.329 -0.129 2
1 40 . 1 1 A 7 7 HIS CB C 7 29.300 30.693 -1.393 2
1 41 . 1 1 A 7 7 HIS N N 7 121.400 121.107 0.293 2
1 42 . 1 1 A 8 8 HIS H H 8 8.660 8.416 0.244 2
1 43 . 1 1 A 8 8 HIS HA H 8 4.700 4.756 -0.057 2
1 46 . 1 1 A 8 8 HIS C C 8 174.200 174.381 -0.181 2
1 47 . 1 1 A 8 8 HIS CA C 8 55.000 55.164 -0.164 2
1 48 . 1 1 A 8 8 HIS CB C 8 29.300 30.876 -1.576 2
1 49 . 1 1 A 8 8 HIS N N 8 120.400 122.912 -2.512 2
1 50 . 1 1 A 9 9 SER H H 9 8.490 8.469 0.021 2
1 51 . 1 1 A 9 9 SER HA H 9 4.390 4.682 -0.292 2
1 54 . 1 1 A 9 9 SER C C 9 174.100 173.592 0.508 2
1 55 . 1 1 A 9 9 SER CA C 9 58.300 57.590 0.709 2
1 56 . 1 1 A 9 9 SER CB C 9 63.700 64.247 -0.547 2
1 57 . 1 1 A 9 9 SER N N 9 118.100 118.641 -0.541 2
1 58 . 1 1 A 10 10 HIS H H 10 8.710 8.652 0.058 2
1 59 . 1 1 A 10 10 HIS HA H 10 4.690 5.013 -0.323 2
1 63 . 1 1 A 10 10 HIS C C 10 174.200 173.780 0.420 2
1 64 . 1 1 A 10 10 HIS CA C 10 55.200 54.886 0.314 2
1 65 . 1 1 A 10 10 HIS CB C 10 28.800 31.732 -2.932 2
1 66 . 1 1 A 10 10 HIS N N 10 120.700 121.453 -0.752 2
1 67 . 1 1 A 11 11 MET H H 11 8.410 8.529 -0.119 2
1 68 . 1 1 A 11 11 MET HA H 11 4.420 4.599 -0.179 2
1 76 . 1 1 A 11 11 MET C C 11 175.800 175.938 -0.138 2
1 77 . 1 1 A 11 11 MET CA C 11 55.100 54.596 0.504 2
1 78 . 1 1 A 11 11 MET CB C 11 32.800 33.301 -0.501 2
1 81 . 1 1 A 11 11 MET N N 11 122.300 123.024 -0.724 2
1 82 . 1 1 A 12 12 ALA H H 12 8.440 8.540 -0.100 2
1 83 . 1 1 A 12 12 ALA HA H 12 4.280 4.653 -0.373 2
1 87 . 1 1 A 12 12 ALA C C 12 177.400 177.073 0.327 2
1 88 . 1 1 A 12 12 ALA CA C 12 52.400 51.242 1.158 2
1 89 . 1 1 A 12 12 ALA CB C 12 18.800 20.304 -1.504 2
1 90 . 1 1 A 12 12 ALA N N 12 125.900 124.860 1.040 2
1 91 . 1 1 A 13 13 ASN H H 13 8.440 8.729 -0.289 2
1 92 . 1 1 A 13 13 ASN HA H 13 4.660 4.958 -0.298 2
1 97 . 1 1 A 13 13 ASN C C 13 175.900 175.323 0.577 2
1 98 . 1 1 A 13 13 ASN CA C 13 53.200 53.190 0.010 2
1 99 . 1 1 A 13 13 ASN CB C 13 38.800 39.259 -0.459 2
1 100 . 1 1 A 13 13 ASN N N 13 118.300 117.981 0.319 2
1 102 . 1 1 A 14 14 GLY H H 14 8.370 8.440 -0.070 2
1 103 . 1 1 A 14 14 GLY HA2 H 14 3.920 4.055 -0.135 2
1 104 . 1 1 A 14 14 GLY HA3 H 14 3.920 4.059 -0.139 2
1 105 . 1 1 A 14 14 GLY C C 14 174.000 173.699 0.301 2
1 106 . 1 1 A 14 14 GLY CA C 14 45.200 45.785 -0.585 2
1 107 . 1 1 A 14 14 GLY N N 14 109.600 109.158 0.442 2
1 108 . 1 1 A 15 15 ALA H H 15 8.140 8.137 0.003 2
1 109 . 1 1 A 15 15 ALA HA H 15 4.280 4.538 -0.258 2
1 113 . 1 1 A 15 15 ALA C C 15 177.300 176.836 0.464 2
1 114 . 1 1 A 15 15 ALA CA C 15 52.500 52.093 0.407 2
1 115 . 1 1 A 15 15 ALA CB C 15 19.100 19.969 -0.869 2
1 116 . 1 1 A 15 15 ALA N N 15 123.800 123.544 0.256 2
1 117 . 1 1 A 16 16 ALA H H 16 8.030 8.309 -0.279 2
1 118 . 1 1 A 16 16 ALA HA H 16 4.280 4.397 -0.117 2
1 122 . 1 1 A 16 16 ALA C C 16 178.400 177.963 0.437 2
1 123 . 1 1 A 16 16 ALA CA C 16 52.600 52.208 0.392 2
1 124 . 1 1 A 16 16 ALA CB C 16 19.100 19.326 -0.226 2
1 125 . 1 1 A 16 16 ALA N N 16 122.300 123.098 -0.798 2
1 126 . 1 1 A 17 17 GLY H H 17 8.320 8.627 -0.307 2
1 127 . 1 1 A 17 17 GLY HA2 H 17 3.960 3.945 0.015 2
1 128 . 1 1 A 17 17 GLY HA3 H 17 3.960 3.950 0.010 2
1 129 . 1 1 A 17 17 GLY C C 17 174.500 175.341 -0.841 2
1 130 . 1 1 A 17 17 GLY CA C 17 45.200 46.221 -1.021 2
1 131 . 1 1 A 17 17 GLY N N 17 107.800 109.675 -1.875 2
1 132 . 1 1 A 18 18 THR H H 18 7.970 7.936 0.034 2
1 133 . 1 1 A 18 18 THR HA H 18 4.290 4.008 0.282 2
1 138 . 1 1 A 18 18 THR C C 18 174.600 176.455 -1.855 2
1 139 . 1 1 A 18 18 THR CA C 18 62.000 66.171 -4.170 2
1 140 . 1 1 A 18 18 THR CB C 18 69.700 68.655 1.045 2
1 142 . 1 1 A 18 18 THR N N 18 113.800 115.221 -1.421 2
1 143 . 1 1 A 19 19 LYS H H 19 8.350 8.406 -0.056 2
1 144 . 1 1 A 19 19 LYS HA H 19 4.270 4.163 0.107 2
1 153 . 1 1 A 19 19 LYS C C 19 176.600 177.220 -0.620 2
1 154 . 1 1 A 19 19 LYS CA C 19 56.500 58.598 -2.098 2
1 155 . 1 1 A 19 19 LYS CB C 19 32.800 32.109 0.691 2
1 159 . 1 1 A 19 19 LYS N N 19 124.000 119.757 4.243 2
1 160 . 1 1 A 20 20 VAL H H 20 8.060 7.668 0.392 2
1 161 . 1 1 A 20 20 VAL HA H 20 3.990 4.268 -0.278 2
1 169 . 1 1 A 20 20 VAL C C 20 175.900 176.298 -0.398 2
1 170 . 1 1 A 20 20 VAL CA C 20 62.400 62.344 0.056 2
1 171 . 1 1 A 20 20 VAL CB C 20 32.600 31.870 0.730 2
1 174 . 1 1 A 20 20 VAL N N 20 121.700 119.204 2.496 2
1 175 . 1 1 A 21 21 ALA H H 21 8.310 8.032 0.278 2
1 176 . 1 1 A 21 21 ALA HA H 21 4.290 4.200 0.090 2
1 180 . 1 1 A 21 21 ALA C C 21 177.600 178.905 -1.305 2
1 181 . 1 1 A 21 21 ALA CA C 21 52.400 54.394 -1.994 2
1 182 . 1 1 A 21 21 ALA CB C 21 19.000 19.281 -0.281 2
1 183 . 1 1 A 21 21 ALA N N 21 127.700 126.162 1.538 2
1 184 . 1 1 A 22 22 LEU H H 22 8.150 7.806 0.344 2
1 185 . 1 1 A 22 22 LEU HA H 22 4.280 4.292 -0.012 2
1 195 . 1 1 A 22 22 LEU C C 22 177.400 176.595 0.805 2
1 196 . 1 1 A 22 22 LEU CA C 22 55.200 55.086 0.114 2
1 197 . 1 1 A 22 22 LEU CB C 22 42.200 41.730 0.470 2
1 201 . 1 1 A 22 22 LEU N N 22 121.800 117.097 4.703 2
1 202 . 1 1 A 23 23 ARG H H 23 8.240 7.893 0.347 2
1 203 . 1 1 A 23 23 ARG HA H 23 4.290 4.207 0.083 2
1 211 . 1 1 A 23 23 ARG C C 23 176.300 176.137 0.163 2
1 212 . 1 1 A 23 23 ARG CA C 23 56.000 56.477 -0.477 2
1 213 . 1 1 A 23 23 ARG CB C 23 30.600 28.927 1.673 2
1 216 . 1 1 A 23 23 ARG N N 23 122.000 118.644 3.356 2
1 218 . 1 1 A 24 24 LYS H H 24 8.370 8.207 0.163 2
1 219 . 1 1 A 24 24 LYS HA H 24 4.330 4.352 -0.022 2
1 228 . 1 1 A 24 24 LYS C C 24 176.800 176.504 0.296 2
1 229 . 1 1 A 24 24 LYS CA C 24 56.400 57.565 -1.165 2
1 230 . 1 1 A 24 24 LYS CB C 24 32.700 33.558 -0.858 2
1 234 . 1 1 A 24 24 LYS N N 24 122.900 121.516 1.384 2
1 235 . 1 1 A 25 25 THR H H 25 8.100 7.630 0.470 2
1 236 . 1 1 A 25 25 THR HA H 25 4.290 4.618 -0.328 2
1 241 . 1 1 A 25 25 THR C C 25 174.600 173.953 0.647 2
1 242 . 1 1 A 25 25 THR CA C 25 61.500 60.563 0.937 2
1 243 . 1 1 A 25 25 THR CB C 25 69.800 70.796 -0.996 2
1 245 . 1 1 A 25 25 THR N N 25 115.500 111.534 3.966 2
1 246 . 1 1 A 26 26 LYS H H 26 8.370 8.700 -0.330 2
1 247 . 1 1 A 26 26 LYS HA H 26 4.270 4.445 -0.175 2
1 256 . 1 1 A 26 26 LYS C C 26 176.600 176.899 -0.299 2
1 257 . 1 1 A 26 26 LYS CA C 26 56.600 55.732 0.868 2
1 258 . 1 1 A 26 26 LYS CB C 26 32.700 33.609 -0.909 2
1 262 . 1 1 A 26 26 LYS N N 26 123.700 124.055 -0.355 2
1 263 . 1 1 A 27 27 GLN H H 27 8.390 8.822 -0.432 2
1 264 . 1 1 A 27 27 GLN HA H 27 4.240 4.531 -0.291 2
1 271 . 1 1 A 27 27 GLN C C 27 175.900 175.847 0.053 2
1 272 . 1 1 A 27 27 GLN CA C 27 56.100 56.554 -0.454 2
1 273 . 1 1 A 27 27 GLN CB C 27 29.300 29.860 -0.560 2
1 275 . 1 1 A 27 27 GLN N N 27 121.700 119.102 2.598 2
1 277 . 1 1 A 28 28 ALA H H 28 8.330 7.776 0.554 2
1 278 . 1 1 A 28 28 ALA HA H 28 4.240 4.527 -0.288 2
1 282 . 1 1 A 28 28 ALA C C 28 177.700 177.395 0.305 2
1 283 . 1 1 A 28 28 ALA CA C 28 52.500 51.354 1.146 2
1 284 . 1 1 A 28 28 ALA CB C 28 19.100 22.208 -3.108 2
1 285 . 1 1 A 28 28 ALA N N 28 125.400 119.628 5.772 2
1 286 . 1 1 A 29 29 ALA H H 29 8.250 8.947 -0.697 2
1 287 . 1 1 A 29 29 ALA HA H 29 4.230 3.993 0.237 2
1 291 . 1 1 A 29 29 ALA C C 29 178.000 179.560 -1.560 2
1 292 . 1 1 A 29 29 ALA CA C 29 52.500 55.166 -2.666 2
1 293 . 1 1 A 29 29 ALA CB C 29 19.100 18.367 0.733 2
1 294 . 1 1 A 29 29 ALA N N 29 123.000 124.734 -1.734 2
1 295 . 1 1 A 30 30 GLU H H 30 8.260 8.286 -0.026 2
1 296 . 1 1 A 30 30 GLU HA H 30 4.220 4.097 0.123 2
1 301 . 1 1 A 30 30 GLU C C 30 176.500 177.629 -1.129 2
1 302 . 1 1 A 30 30 GLU CA C 30 56.400 59.164 -2.764 2
1 303 . 1 1 A 30 30 GLU CB C 30 29.500 29.357 0.143 2
1 305 . 1 1 A 30 30 GLU N N 30 119.700 117.983 1.717 2
1 306 . 1 1 A 31 31 LYS H H 31 8.230 7.951 0.279 2
1 307 . 1 1 A 31 31 LYS HA H 31 4.280 4.430 -0.150 2
1 316 . 1 1 A 31 31 LYS C C 31 176.500 176.721 -0.221 2
1 317 . 1 1 A 31 31 LYS CA C 31 56.400 56.786 -0.386 2
1 318 . 1 1 A 31 31 LYS CB C 31 32.800 33.736 -0.936 2
1 322 . 1 1 A 31 31 LYS N N 31 122.700 118.458 4.242 2
1 323 . 1 1 A 32 32 ILE H H 32 8.140 7.434 0.706 2
1 324 . 1 1 A 32 32 ILE HA H 32 4.110 4.162 -0.052 2
1 334 . 1 1 A 32 32 ILE C C 32 176.400 176.561 -0.161 2
1 335 . 1 1 A 32 32 ILE CA C 32 61.200 61.760 -0.560 2
1 336 . 1 1 A 32 32 ILE CB C 32 38.600 37.473 1.127 2
1 340 . 1 1 A 32 32 ILE N N 32 122.300 121.169 1.131 2
1 341 . 1 1 A 33 33 SER H H 33 8.230 8.842 -0.612 2
1 342 . 1 1 A 33 33 SER HA H 33 4.400 4.105 0.295 2
1 345 . 1 1 A 33 33 SER C C 33 174.800 176.469 -1.669 2
1 346 . 1 1 A 33 33 SER CA C 33 58.300 61.503 -3.203 2
1 347 . 1 1 A 33 33 SER CB C 33 63.700 62.824 0.876 2
1 348 . 1 1 A 33 33 SER N N 33 119.600 122.851 -3.251 2
1 349 . 1 1 A 34 34 ALA H H 34 8.430 8.291 0.139 2
1 350 . 1 1 A 34 34 ALA HA H 34 4.220 4.036 0.184 2
1 354 . 1 1 A 34 34 ALA C C 34 179.500 179.713 -0.213 2
1 355 . 1 1 A 34 34 ALA CA C 34 53.500 55.190 -1.690 2
1 356 . 1 1 A 34 34 ALA CB C 34 18.800 18.443 0.357 2
1 357 . 1 1 A 34 34 ALA N N 34 126.000 123.299 2.701 2
1 358 . 1 1 A 35 35 ASP H H 35 8.380 7.984 0.396 2
1 359 . 1 1 A 35 35 ASP HA H 35 4.520 4.373 0.147 2
1 362 . 1 1 A 35 35 ASP C C 35 176.500 178.519 -2.019 2
1 363 . 1 1 A 35 35 ASP CA C 35 54.800 56.683 -1.883 2
1 364 . 1 1 A 35 35 ASP CB C 35 40.200 40.708 -0.508 2
1 365 . 1 1 A 35 35 ASP N N 35 118.200 117.994 0.206 2
1 366 . 1 1 A 36 36 LYS H H 36 8.000 7.842 0.158 2
1 367 . 1 1 A 36 36 LYS HA H 36 4.270 4.075 0.195 2
1 376 . 1 1 A 36 36 LYS C C 36 177.000 177.198 -0.198 2
1 377 . 1 1 A 36 36 LYS CA C 36 56.800 58.736 -1.936 2
1 378 . 1 1 A 36 36 LYS CB C 36 32.900 32.013 0.887 2
1 382 . 1 1 A 36 36 LYS N N 36 120.900 118.571 2.329 2
1 383 . 1 1 A 37 37 ILE H H 37 7.970 7.375 0.596 2
1 384 . 1 1 A 37 37 ILE HA H 37 4.020 4.020 -0.000 2
1 394 . 1 1 A 37 37 ILE C C 37 176.100 175.303 0.797 2
1 395 . 1 1 A 37 37 ILE CA C 37 61.300 61.944 -0.644 2
1 396 . 1 1 A 37 37 ILE CB C 37 38.100 37.492 0.608 2
1 400 . 1 1 A 37 37 ILE N N 37 121.800 121.216 0.584 2
1 401 . 1 1 A 38 38 SER H H 38 7.980 8.713 -0.733 2
1 402 . 1 1 A 38 38 SER HA H 38 4.540 4.725 -0.185 2
1 405 . 1 1 A 38 38 SER C C 38 174.700 175.384 -0.684 2
1 406 . 1 1 A 38 38 SER CA C 38 58.200 57.806 0.394 2
1 407 . 1 1 A 38 38 SER CB C 38 64.400 64.871 -0.471 2
1 408 . 1 1 A 38 38 SER N N 38 119.000 123.893 -4.893 2
1 409 . 1 1 A 39 39 LYS H H 39 8.690 9.007 -0.317 2
1 410 . 1 1 A 39 39 LYS HA H 39 3.400 3.652 -0.252 2
1 419 . 1 1 A 39 39 LYS C C 39 177.400 178.068 -0.668 2
1 420 . 1 1 A 39 39 LYS CA C 39 59.800 60.406 -0.606 2
1 421 . 1 1 A 39 39 LYS CB C 39 32.400 32.302 0.098 2
1 425 . 1 1 A 39 39 LYS N N 39 124.200 125.008 -0.808 2
1 426 . 1 1 A 40 40 GLU H H 40 8.280 8.394 -0.114 2
1 427 . 1 1 A 40 40 GLU HA H 40 3.840 4.051 -0.211 2
1 432 . 1 1 A 40 40 GLU C C 40 178.400 178.828 -0.428 2
1 433 . 1 1 A 40 40 GLU CA C 40 59.400 59.260 0.140 2
1 434 . 1 1 A 40 40 GLU CB C 40 28.300 29.235 -0.935 2
1 436 . 1 1 A 40 40 GLU N N 40 116.300 117.388 -1.089 2
1 437 . 1 1 A 41 41 ALA H H 41 7.890 7.970 -0.080 2
1 438 . 1 1 A 41 41 ALA HA H 41 3.910 4.127 -0.217 2
1 442 . 1 1 A 41 41 ALA C C 41 179.900 179.773 0.127 2
1 443 . 1 1 A 41 41 ALA CA C 41 54.700 55.164 -0.464 2
1 444 . 1 1 A 41 41 ALA CB C 41 17.900 18.244 -0.344 2
1 445 . 1 1 A 41 41 ALA N N 41 122.300 122.466 -0.166 2
1 446 . 1 1 A 42 42 LEU H H 42 7.490 7.840 -0.350 2
1 447 . 1 1 A 42 42 LEU HA H 42 3.480 3.971 -0.491 2
1 457 . 1 1 A 42 42 LEU C C 42 178.900 178.557 0.343 2
1 458 . 1 1 A 42 42 LEU CA C 42 59.800 57.701 2.099 2
1 459 . 1 1 A 42 42 LEU CB C 42 42.300 41.497 0.803 2
1 463 . 1 1 A 42 42 LEU N N 42 121.000 119.513 1.487 2
1 464 . 1 1 A 43 43 LEU H H 43 8.290 8.046 0.244 2
1 465 . 1 1 A 43 43 LEU HA H 43 3.780 3.838 -0.058 2
1 475 . 1 1 A 43 43 LEU C C 43 179.400 179.166 0.234 2
1 476 . 1 1 A 43 43 LEU CA C 43 57.600 58.055 -0.455 2
1 477 . 1 1 A 43 43 LEU CB C 43 40.900 41.407 -0.507 2
1 481 . 1 1 A 43 43 LEU N N 43 119.200 118.287 0.913 2
1 482 . 1 1 A 44 44 GLU H H 44 8.330 8.352 -0.022 2
1 483 . 1 1 A 44 44 GLU HA H 44 4.050 3.951 0.099 2
1 488 . 1 1 A 44 44 GLU C C 44 178.600 179.084 -0.484 2
1 489 . 1 1 A 44 44 GLU CA C 44 58.900 59.311 -0.411 2
1 490 . 1 1 A 44 44 GLU CB C 44 28.300 29.325 -1.025 2
1 492 . 1 1 A 44 44 GLU N N 44 119.600 117.537 2.063 2
1 493 . 1 1 A 45 45 CYS H H 45 7.690 7.954 -0.264 2
1 494 . 1 1 A 45 45 CYS HA H 45 4.120 4.039 0.081 2
1 497 . 1 1 A 45 45 CYS C C 45 176.100 176.753 -0.653 2
1 498 . 1 1 A 45 45 CYS CA C 45 62.500 62.905 -0.405 2
1 499 . 1 1 A 45 45 CYS CB C 45 26.200 26.397 -0.197 2
1 500 . 1 1 A 45 45 CYS N N 45 120.900 118.746 2.154 2
1 501 . 1 1 A 46 46 ALA H H 46 8.540 7.960 0.580 2
1 502 . 1 1 A 46 46 ALA HA H 46 3.900 3.955 -0.055 2
1 506 . 1 1 A 46 46 ALA C C 46 179.200 179.025 0.175 2
1 507 . 1 1 A 46 46 ALA CA C 46 55.500 55.374 0.126 2
1 508 . 1 1 A 46 46 ALA CB C 46 16.800 18.131 -1.331 2
1 509 . 1 1 A 46 46 ALA N N 46 121.500 122.057 -0.557 2
1 510 . 1 1 A 47 47 ASP H H 47 8.460 8.234 0.226 2
1 511 . 1 1 A 47 47 ASP HA H 47 4.340 4.375 -0.035 2
1 514 . 1 1 A 47 47 ASP C C 47 178.800 178.601 0.199 2
1 515 . 1 1 A 47 47 ASP CA C 47 56.600 57.235 -0.635 2
1 516 . 1 1 A 47 47 ASP CB C 47 39.800 42.094 -2.295 2
1 517 . 1 1 A 47 47 ASP N N 47 119.000 118.531 0.469 2
1 518 . 1 1 A 48 48 LEU H H 48 8.040 7.823 0.217 2
1 519 . 1 1 A 48 48 LEU HA H 48 4.110 3.942 0.168 2
1 529 . 1 1 A 48 48 LEU C C 48 180.000 179.450 0.550 2
1 530 . 1 1 A 48 48 LEU CA C 48 58.000 58.147 -0.147 2
1 531 . 1 1 A 48 48 LEU CB C 48 41.700 41.537 0.163 2
1 535 . 1 1 A 48 48 LEU N N 48 123.000 119.757 3.243 2
1 536 . 1 1 A 49 49 LEU H H 49 8.300 7.847 0.453 2
1 537 . 1 1 A 49 49 LEU HA H 49 4.110 3.903 0.207 2
1 547 . 1 1 A 49 49 LEU C C 49 177.200 178.847 -1.647 2
1 548 . 1 1 A 49 49 LEU CA C 49 57.600 57.922 -0.322 2
1 549 . 1 1 A 49 49 LEU CB C 49 41.200 41.613 -0.413 2
1 553 . 1 1 A 49 49 LEU N N 49 120.900 119.409 1.491 2
1 554 . 1 1 A 50 50 SER H H 50 8.660 7.966 0.694 2
1 555 . 1 1 A 50 50 SER HA H 50 4.000 4.132 -0.132 2
1 558 . 1 1 A 50 50 SER C C 50 176.800 176.916 -0.116 2
1 559 . 1 1 A 50 50 SER CA C 50 62.500 61.652 0.848 2
1 560 . 1 1 A 50 50 SER CB C 50 62.600 62.594 0.006 2
1 561 . 1 1 A 50 50 SER N N 50 113.300 113.827 -0.527 2
1 562 . 1 1 A 51 51 SER H H 51 7.980 8.122 -0.142 2
1 563 . 1 1 A 51 51 SER HA H 51 4.220 4.126 0.094 2
1 566 . 1 1 A 51 51 SER C C 51 176.300 176.955 -0.655 2
1 567 . 1 1 A 51 51 SER CA C 51 61.200 61.588 -0.388 2
1 568 . 1 1 A 51 51 SER CB C 51 62.700 62.818 -0.118 2
1 569 . 1 1 A 51 51 SER N N 51 115.900 116.147 -0.247 2
1 570 . 1 1 A 52 52 ALA H H 52 8.030 8.159 -0.129 2
1 571 . 1 1 A 52 52 ALA HA H 52 4.130 4.172 -0.042 2
1 575 . 1 1 A 52 52 ALA C C 52 178.500 179.724 -1.224 2
1 576 . 1 1 A 52 52 ALA CA C 52 54.500 54.816 -0.316 2
1 577 . 1 1 A 52 52 ALA CB C 52 18.000 18.255 -0.255 2
1 578 . 1 1 A 52 52 ALA N N 52 125.400 123.301 2.099 2
1 579 . 1 1 A 53 53 LEU H H 53 7.710 8.021 -0.311 2
1 580 . 1 1 A 53 53 LEU HA H 53 4.180 4.149 0.031 2
1 590 . 1 1 A 53 53 LEU C C 53 177.700 178.209 -0.509 2
1 591 . 1 1 A 53 53 LEU CA C 53 56.500 56.737 -0.237 2
1 592 . 1 1 A 53 53 LEU CB C 53 42.400 41.766 0.634 2
1 596 . 1 1 A 53 53 LEU N N 53 113.800 118.241 -4.441 2
1 597 . 1 1 A 54 54 THR H H 54 7.550 7.449 0.101 2
1 598 . 1 1 A 54 54 THR HA H 54 4.420 4.384 0.036 2
1 603 . 1 1 A 54 54 THR C C 54 174.100 173.990 0.110 2
1 604 . 1 1 A 54 54 THR CA C 54 61.600 62.609 -1.009 2
1 605 . 1 1 A 54 54 THR CB C 54 69.300 69.494 -0.194 2
1 607 . 1 1 A 54 54 THR N N 54 107.700 107.336 0.364 2
1 608 . 1 1 A 55 55 GLU H H 55 7.750 7.566 0.184 2
1 609 . 1 1 A 55 55 GLU HA H 55 4.760 4.821 -0.061 2
1 614 . 1 1 A 55 55 GLU CA C 55 53.400 54.047 -0.647 2
1 615 . 1 1 A 55 55 GLU CB C 55 30.100 31.534 -1.434 2
1 617 . 1 1 A 55 55 GLU N N 55 122.800 119.434 3.366 2
1 618 . 1 1 A 56 56 PRO HA H 56 4.670 4.719 -0.049 2
1 625 . 1 1 A 56 56 PRO C C 56 176.200 176.423 -0.223 2
1 626 . 1 1 A 56 56 PRO CA C 56 62.900 62.949 -0.049 2
1 627 . 1 1 A 56 56 PRO CB C 56 29.200 31.724 -2.524 2
1 630 . 1 1 A 57 57 VAL H H 57 8.010 8.369 -0.359 2
1 631 . 1 1 A 57 57 VAL HA H 57 4.590 4.950 -0.360 2
1 639 . 1 1 A 57 57 VAL CA C 57 58.600 58.300 0.300 2
1 640 . 1 1 A 57 57 VAL CB C 57 32.800 34.848 -2.048 2
1 643 . 1 1 A 57 57 VAL N N 57 121.400 117.373 4.027 2
1 644 . 1 1 A 58 58 PRO HA H 58 4.450 4.828 -0.378 2
1 651 . 1 1 A 58 58 PRO C C 58 177.500 177.861 -0.361 2
1 652 . 1 1 A 58 58 PRO CA C 58 62.600 62.820 -0.220 2
1 653 . 1 1 A 58 58 PRO CB C 58 32.200 32.300 -0.100 2
1 656 . 1 1 A 59 59 ASN H H 59 8.890 8.928 -0.038 2
1 657 . 1 1 A 59 59 ASN HA H 59 4.330 4.408 -0.078 2
1 662 . 1 1 A 59 59 ASN C C 59 177.600 177.380 0.220 2
1 663 . 1 1 A 59 59 ASN CA C 59 56.300 56.266 0.034 2
1 664 . 1 1 A 59 59 ASN CB C 59 38.400 38.478 -0.078 2
1 665 . 1 1 A 59 59 ASN N N 59 122.200 122.453 -0.253 2
1 667 . 1 1 A 60 60 SER H H 60 8.660 8.121 0.539 2
1 668 . 1 1 A 60 60 SER HA H 60 4.010 4.100 -0.090 2
1 671 . 1 1 A 60 60 SER C C 60 176.200 176.656 -0.456 2
1 672 . 1 1 A 60 60 SER CA C 60 60.800 61.470 -0.670 2
1 673 . 1 1 A 60 60 SER CB C 60 61.500 62.835 -1.335 2
1 674 . 1 1 A 60 60 SER N N 60 113.200 115.331 -2.131 2
1 675 . 1 1 A 61 61 GLN H H 61 7.420 7.884 -0.464 2
1 676 . 1 1 A 61 61 GLN HA H 61 4.280 4.025 0.255 2
1 683 . 1 1 A 61 61 GLN C C 61 178.600 178.478 0.122 2
1 684 . 1 1 A 61 61 GLN CA C 61 57.900 58.865 -0.965 2
1 685 . 1 1 A 61 61 GLN CB C 61 28.600 28.121 0.479 2
1 687 . 1 1 A 61 61 GLN N N 61 122.200 120.850 1.350 2
1 689 . 1 1 A 62 62 LEU H H 62 7.430 7.861 -0.431 2
1 690 . 1 1 A 62 62 LEU HA H 62 3.850 4.024 -0.174 2
1 700 . 1 1 A 62 62 LEU C C 62 178.800 179.060 -0.260 2
1 701 . 1 1 A 62 62 LEU CA C 62 57.900 58.074 -0.174 2
1 702 . 1 1 A 62 62 LEU CB C 62 42.100 42.092 0.008 2
1 706 . 1 1 A 62 62 LEU N N 62 120.600 119.935 0.665 2
1 707 . 1 1 A 63 63 VAL H H 63 8.200 8.130 0.070 2
1 708 . 1 1 A 63 63 VAL HA H 63 3.370 3.414 -0.044 2
1 716 . 1 1 A 63 63 VAL C C 63 178.000 177.725 0.276 2
1 717 . 1 1 A 63 63 VAL CA C 63 66.600 66.946 -0.346 2
1 718 . 1 1 A 63 63 VAL CB C 63 31.700 31.220 0.480 2
1 721 . 1 1 A 63 63 VAL N N 63 118.200 117.647 0.553 2
1 722 . 1 1 A 64 64 ASP H H 64 7.960 8.272 -0.312 2
1 723 . 1 1 A 64 64 ASP HA H 64 4.460 4.343 0.117 2
1 726 . 1 1 A 64 64 ASP C C 64 178.100 178.555 -0.455 2
1 727 . 1 1 A 64 64 ASP CA C 64 57.700 57.365 0.335 2
1 728 . 1 1 A 64 64 ASP CB C 64 39.800 41.234 -1.434 2
1 729 . 1 1 A 64 64 ASP N N 64 120.200 120.190 0.010 2
1 730 . 1 1 A 65 65 THR H H 65 8.380 8.437 -0.057 2
1 731 . 1 1 A 65 65 THR HA H 65 3.970 3.991 -0.021 2
1 736 . 1 1 A 65 65 THR C C 65 176.500 177.195 -0.695 2
1 737 . 1 1 A 65 65 THR CA C 65 66.500 66.633 -0.133 2
1 738 . 1 1 A 65 65 THR CB C 65 67.800 67.964 -0.164 2
1 740 . 1 1 A 65 65 THR N N 65 118.100 115.575 2.525 2
1 741 . 1 1 A 66 66 GLY H H 66 8.900 8.390 0.509 2
1 742 . 1 1 A 66 66 GLY HA2 H 66 3.630 3.678 -0.048 2
1 743 . 1 1 A 66 66 GLY HA3 H 66 3.630 3.706 -0.076 2
1 744 . 1 1 A 66 66 GLY C C 66 174.200 176.093 -1.893 2
1 745 . 1 1 A 66 66 GLY CA C 66 47.500 47.145 0.354 2
1 746 . 1 1 A 66 66 GLY N N 66 110.500 107.614 2.886 2
1 747 . 1 1 A 67 67 HIS H H 67 8.650 7.946 0.704 2
1 748 . 1 1 A 67 67 HIS HA H 67 4.220 4.360 -0.140 2
1 752 . 1 1 A 67 67 HIS C C 67 176.900 177.635 -0.735 2
1 753 . 1 1 A 67 67 HIS CA C 67 59.000 58.762 0.238 2
1 754 . 1 1 A 67 67 HIS CB C 67 27.800 29.648 -1.847 2
1 756 . 1 1 A 67 67 HIS N N 67 120.100 121.225 -1.125 2
1 757 . 1 1 A 68 68 GLN H H 68 7.860 8.257 -0.397 2
1 758 . 1 1 A 68 68 GLN HA H 68 3.990 3.992 -0.002 2
1 765 . 1 1 A 68 68 GLN C C 68 177.800 178.013 -0.213 2
1 766 . 1 1 A 68 68 GLN CA C 68 58.800 58.530 0.270 2
1 767 . 1 1 A 68 68 GLN CB C 68 28.200 27.719 0.481 2
1 769 . 1 1 A 68 68 GLN N N 68 121.400 116.935 4.465 2
1 771 . 1 1 A 69 69 LEU H H 69 8.300 7.905 0.395 2
1 772 . 1 1 A 69 69 LEU HA H 69 4.330 4.069 0.261 2
1 782 . 1 1 A 69 69 LEU C C 69 179.300 179.671 -0.371 2
1 783 . 1 1 A 69 69 LEU CA C 69 58.200 58.126 0.075 2
1 784 . 1 1 A 69 69 LEU CB C 69 40.500 41.225 -0.725 2
1 788 . 1 1 A 69 69 LEU N N 69 120.300 121.750 -1.450 2
1 789 . 1 1 A 70 70 LEU H H 70 8.460 7.980 0.480 2
1 790 . 1 1 A 70 70 LEU HA H 70 3.880 3.965 -0.085 2
1 800 . 1 1 A 70 70 LEU C C 70 179.100 179.131 -0.031 2
1 801 . 1 1 A 70 70 LEU CA C 70 58.300 58.027 0.273 2
1 802 . 1 1 A 70 70 LEU CB C 70 41.500 40.840 0.660 2
1 806 . 1 1 A 70 70 LEU N N 70 121.200 119.649 1.551 2
1 807 . 1 1 A 71 71 ASP H H 71 8.140 8.027 0.113 2
1 808 . 1 1 A 71 71 ASP HA H 71 4.420 4.337 0.083 2
1 811 . 1 1 A 71 71 ASP C C 71 180.000 178.279 1.721 2
1 812 . 1 1 A 71 71 ASP CA C 71 57.300 57.317 -0.017 2
1 813 . 1 1 A 71 71 ASP CB C 71 39.300 41.249 -1.949 2
1 814 . 1 1 A 71 71 ASP N N 71 121.100 119.416 1.684 2
1 815 . 1 1 A 72 72 TYR H H 72 8.320 8.339 -0.019 2
1 816 . 1 1 A 72 72 TYR HA H 72 4.550 4.464 0.086 2
1 823 . 1 1 A 72 72 TYR C C 72 179.100 178.657 0.443 2
1 824 . 1 1 A 72 72 TYR CA C 72 60.500 60.773 -0.273 2
1 825 . 1 1 A 72 72 TYR CB C 72 37.600 38.056 -0.456 2
1 828 . 1 1 A 72 72 TYR N N 72 120.300 117.995 2.305 2
1 829 . 1 1 A 73 73 CYS H H 73 8.850 8.643 0.207 2
1 830 . 1 1 A 73 73 CYS HA H 73 4.380 4.593 -0.213 2
1 834 . 1 1 A 73 73 CYS C C 73 177.300 177.225 0.075 2
1 835 . 1 1 A 73 73 CYS CA C 73 64.400 63.545 0.855 2
1 836 . 1 1 A 73 73 CYS CB C 73 27.600 26.668 0.932 2
1 837 . 1 1 A 73 73 CYS N N 73 116.800 118.653 -1.853 2
1 838 . 1 1 A 74 74 SER H H 74 8.410 8.406 0.004 2
1 839 . 1 1 A 74 74 SER HA H 74 4.290 4.276 0.014 2
1 842 . 1 1 A 74 74 SER C C 74 176.300 177.000 -0.700 2
1 843 . 1 1 A 74 74 SER CA C 74 61.400 61.285 0.115 2
1 844 . 1 1 A 74 74 SER CB C 74 62.600 62.822 -0.222 2
1 845 . 1 1 A 74 74 SER N N 74 115.900 116.404 -0.504 2
1 846 . 1 1 A 75 75 GLY H H 75 7.790 8.171 -0.381 2
1 847 . 1 1 A 75 75 GLY HA2 H 75 4.320 3.722 0.598 2
1 848 . 1 1 A 75 75 GLY HA3 H 75 3.900 3.731 0.169 2
1 849 . 1 1 A 75 75 GLY C C 75 174.600 175.372 -0.772 2
1 850 . 1 1 A 75 75 GLY CA C 75 45.600 47.108 -1.508 2
1 851 . 1 1 A 75 75 GLY N N 75 107.500 108.273 -0.773 2
1 852 . 1 1 A 76 76 TYR H H 76 8.040 8.409 -0.369 2
1 853 . 1 1 A 76 76 TYR HA H 76 4.310 4.022 0.288 2
1 860 . 1 1 A 76 76 TYR C C 76 176.200 177.632 -1.432 2
1 861 . 1 1 A 76 76 TYR CA C 76 60.000 61.043 -1.043 2
1 862 . 1 1 A 76 76 TYR CB C 76 40.700 38.597 2.103 2
1 865 . 1 1 A 76 76 TYR N N 76 121.900 123.377 -1.477 2
1 866 . 1 1 A 77 77 VAL H H 77 7.540 8.384 -0.844 2
1 867 . 1 1 A 77 77 VAL HA H 77 3.450 3.422 0.028 2
1 875 . 1 1 A 77 77 VAL C C 77 175.500 177.209 -1.709 2
1 876 . 1 1 A 77 77 VAL CA C 77 65.500 64.543 0.957 2
1 877 . 1 1 A 77 77 VAL CB C 77 31.600 31.216 0.384 2
1 880 . 1 1 A 77 77 VAL N N 77 116.600 119.296 -2.696 2
1 881 . 1 1 A 78 78 ASP H H 78 7.580 7.979 -0.399 2
1 882 . 1 1 A 78 78 ASP HA H 78 4.380 4.372 0.008 2
1 885 . 1 1 A 78 78 ASP C C 78 177.000 177.510 -0.510 2
1 886 . 1 1 A 78 78 ASP CA C 78 55.800 56.877 -1.077 2
1 887 . 1 1 A 78 78 ASP CB C 78 39.900 41.075 -1.175 2
1 888 . 1 1 A 78 78 ASP N N 78 116.400 120.751 -4.351 2
1 889 . 1 1 A 79 79 CYS H H 79 8.040 7.593 0.447 2
1 890 . 1 1 A 79 79 CYS HA H 79 4.110 4.417 -0.307 2
1 893 . 1 1 A 79 79 CYS C C 79 174.200 174.396 -0.196 2
1 894 . 1 1 A 79 79 CYS CA C 79 58.600 58.830 -0.230 2
1 895 . 1 1 A 79 79 CYS CB C 79 27.200 27.755 -0.555 2
1 896 . 1 1 A 79 79 CYS N N 79 117.000 115.342 1.658 2
1 897 . 1 1 A 80 80 ILE H H 80 6.960 7.087 -0.127 2
1 898 . 1 1 A 80 80 ILE HA H 80 4.120 4.068 0.052 2
1 908 . 1 1 A 80 80 ILE CA C 80 58.700 59.181 -0.481 2
1 909 . 1 1 A 80 80 ILE CB C 80 38.500 37.727 0.773 2
1 913 . 1 1 A 80 80 ILE N N 80 123.200 122.636 0.564 2
1 914 . 1 1 A 81 81 PRO HA H 81 4.340 4.391 -0.051 2
1 921 . 1 1 A 81 81 PRO C C 81 178.000 176.437 1.563 2
1 922 . 1 1 A 81 81 PRO CA C 81 64.700 64.868 -0.168 2
1 923 . 1 1 A 81 81 PRO CB C 81 32.600 31.930 0.670 2
1 926 . 1 1 A 82 82 GLN H H 82 7.560 8.159 -0.599 2
1 927 . 1 1 A 82 82 GLN HA H 82 4.600 4.468 0.132 2
1 934 . 1 1 A 82 82 GLN C C 82 177.400 176.065 1.335 2
1 935 . 1 1 A 82 82 GLN CA C 82 55.600 55.498 0.102 2
1 936 . 1 1 A 82 82 GLN CB C 82 28.800 28.875 -0.075 2
1 938 . 1 1 A 82 82 GLN N N 82 115.900 117.909 -2.009 2
1 940 . 1 1 A 83 83 THR H H 83 8.880 8.399 0.481 2
1 941 . 1 1 A 83 83 THR HA H 83 3.750 3.921 -0.171 2
1 946 . 1 1 A 83 83 THR C C 83 176.300 176.364 -0.064 2
1 947 . 1 1 A 83 83 THR CA C 83 66.500 66.448 0.052 2
1 948 . 1 1 A 83 83 THR CB C 83 68.700 68.799 -0.099 2
1 950 . 1 1 A 83 83 THR N N 83 122.700 119.537 3.164 2
1 951 . 1 1 A 84 84 ARG H H 84 8.990 8.204 0.786 2
1 952 . 1 1 A 84 84 ARG HA H 84 4.250 4.043 0.208 2
1 960 . 1 1 A 84 84 ARG C C 84 178.900 179.075 -0.175 2
1 961 . 1 1 A 84 84 ARG CA C 84 59.100 59.671 -0.571 2
1 962 . 1 1 A 84 84 ARG CB C 84 29.300 30.192 -0.892 2
1 965 . 1 1 A 84 84 ARG N N 84 120.100 121.479 -1.379 2
1 967 . 1 1 A 85 85 ASN H H 85 7.270 8.297 -1.027 2
1 968 . 1 1 A 85 85 ASN HA H 85 4.810 4.642 0.168 2
1 973 . 1 1 A 85 85 ASN C C 85 176.800 177.781 -0.981 2
1 974 . 1 1 A 85 85 ASN CA C 85 54.800 56.275 -1.475 2
1 975 . 1 1 A 85 85 ASN CB C 85 37.600 38.063 -0.463 2
1 976 . 1 1 A 85 85 ASN N N 85 117.400 118.337 -0.936 2
1 978 . 1 1 A 86 86 LYS H H 86 8.340 8.195 0.145 2
1 979 . 1 1 A 86 86 LYS HA H 86 3.890 4.083 -0.193 2
1 988 . 1 1 A 86 86 LYS C C 86 178.600 178.963 -0.363 2
1 989 . 1 1 A 86 86 LYS CA C 86 60.800 59.066 1.734 2
1 990 . 1 1 A 86 86 LYS CB C 86 32.700 32.182 0.518 2
1 994 . 1 1 A 86 86 LYS N N 86 124.200 120.749 3.451 2
1 995 . 1 1 A 87 87 PHE H H 87 8.120 8.713 -0.593 2
1 996 . 1 1 A 87 87 PHE HA H 87 4.260 4.209 0.051 2
1 1004 . 1 1 A 87 87 PHE C C 87 178.100 177.490 0.610 2
1 1005 . 1 1 A 87 87 PHE CA C 87 61.300 61.737 -0.437 2
1 1006 . 1 1 A 87 87 PHE CB C 87 38.200 39.169 -0.969 2
1 1010 . 1 1 A 87 87 PHE N N 87 118.300 121.075 -2.775 2
1 1011 . 1 1 A 88 88 ALA H H 88 7.860 8.220 -0.360 2
1 1012 . 1 1 A 88 88 ALA HA H 88 4.200 4.146 0.054 2
1 1016 . 1 1 A 88 88 ALA C C 88 180.600 179.739 0.861 2
1 1017 . 1 1 A 88 88 ALA CA C 88 54.900 55.099 -0.199 2
1 1018 . 1 1 A 88 88 ALA CB C 88 18.100 17.987 0.113 2
1 1019 . 1 1 A 88 88 ALA N N 88 121.700 120.915 0.785 2
1 1020 . 1 1 A 89 89 PHE H H 89 8.690 8.515 0.175 2
1 1021 . 1 1 A 89 89 PHE HA H 89 4.080 4.131 -0.051 2
1 1029 . 1 1 A 89 89 PHE C C 89 176.300 177.719 -1.419 2
1 1030 . 1 1 A 89 89 PHE CA C 89 62.000 61.410 0.590 2
1 1031 . 1 1 A 89 89 PHE CB C 89 39.800 39.328 0.472 2
1 1035 . 1 1 A 89 89 PHE N N 89 120.100 120.030 0.070 2
1 1036 . 1 1 A 90 90 ARG H H 90 8.560 8.327 0.233 2
1 1037 . 1 1 A 90 90 ARG HA H 90 3.790 3.880 -0.090 2
1 1045 . 1 1 A 90 90 ARG C C 90 179.600 178.542 1.058 2
1 1046 . 1 1 A 90 90 ARG CA C 90 60.000 59.598 0.402 2
1 1047 . 1 1 A 90 90 ARG CB C 90 30.000 30.032 -0.032 2
1 1050 . 1 1 A 90 90 ARG N N 90 118.000 118.249 -0.249 2
1 1052 . 1 1 A 91 91 GLU H H 91 8.120 8.188 -0.068 2
1 1053 . 1 1 A 91 91 GLU HA H 91 3.980 3.927 0.053 2
1 1058 . 1 1 A 91 91 GLU C C 91 178.400 178.869 -0.469 2
1 1059 . 1 1 A 91 91 GLU CA C 91 58.900 59.257 -0.357 2
1 1060 . 1 1 A 91 91 GLU CB C 91 28.800 29.035 -0.235 2
1 1062 . 1 1 A 91 91 GLU N N 91 119.300 118.091 1.210 2
1 1063 . 1 1 A 92 92 ALA H H 92 7.820 7.780 0.040 2
1 1064 . 1 1 A 92 92 ALA HA H 92 4.050 3.974 0.075 2
1 1068 . 1 1 A 92 92 ALA C C 92 179.800 179.769 0.031 2
1 1069 . 1 1 A 92 92 ALA CA C 92 55.000 55.112 -0.112 2
1 1070 . 1 1 A 92 92 ALA CB C 92 18.000 18.257 -0.257 2
1 1071 . 1 1 A 92 92 ALA N N 92 123.400 122.275 1.125 2
1 1072 . 1 1 A 93 93 VAL H H 93 8.430 7.921 0.509 2
1 1073 . 1 1 A 93 93 VAL HA H 93 3.250 3.308 -0.058 2
1 1081 . 1 1 A 93 93 VAL C C 93 177.900 177.960 -0.060 2
1 1082 . 1 1 A 93 93 VAL CA C 93 66.800 66.682 0.118 2
1 1083 . 1 1 A 93 93 VAL CB C 93 31.300 31.235 0.065 2
1 1086 . 1 1 A 93 93 VAL N N 93 119.900 118.411 1.489 2
1 1087 . 1 1 A 94 94 SER H H 94 7.990 8.104 -0.114 2
1 1088 . 1 1 A 94 94 SER HA H 94 4.230 4.063 0.167 2
1 1091 . 1 1 A 94 94 SER C C 94 177.200 176.877 0.323 2
1 1092 . 1 1 A 94 94 SER CA C 94 61.600 61.734 -0.135 2
1 1093 . 1 1 A 94 94 SER CB C 94 62.700 62.870 -0.170 2
1 1094 . 1 1 A 94 94 SER N N 94 116.000 116.233 -0.233 2
1 1095 . 1 1 A 95 95 LYS H H 95 7.710 7.610 0.100 2
1 1096 . 1 1 A 95 95 LYS HA H 95 4.020 4.050 -0.030 2
1 1105 . 1 1 A 95 95 LYS C C 95 179.400 179.092 0.308 2
1 1106 . 1 1 A 95 95 LYS CA C 95 59.600 59.257 0.343 2
1 1107 . 1 1 A 95 95 LYS CB C 95 32.300 32.350 -0.050 2
1 1111 . 1 1 A 95 95 LYS N N 95 121.400 121.881 -0.481 2
1 1112 . 1 1 A 96 96 LEU H H 96 8.270 7.995 0.275 2
1 1113 . 1 1 A 96 96 LEU HA H 96 4.040 3.944 0.096 2
1 1123 . 1 1 A 96 96 LEU C C 96 177.700 178.274 -0.573 2
1 1124 . 1 1 A 96 96 LEU CA C 96 58.600 58.197 0.403 2
1 1125 . 1 1 A 96 96 LEU CB C 96 41.000 41.696 -0.696 2
1 1129 . 1 1 A 96 96 LEU N N 96 124.800 121.033 3.767 2
1 1130 . 1 1 A 97 97 GLU H H 97 8.500 8.381 0.119 2
1 1131 . 1 1 A 97 97 GLU HA H 97 3.760 4.069 -0.309 2
1 1136 . 1 1 A 97 97 GLU C C 97 179.100 179.249 -0.149 2
1 1137 . 1 1 A 97 97 GLU CA C 97 59.900 59.031 0.869 2
1 1138 . 1 1 A 97 97 GLU CB C 97 28.700 29.220 -0.520 2
1 1140 . 1 1 A 97 97 GLU N N 97 119.000 117.359 1.641 2
1 1141 . 1 1 A 98 98 LEU H H 98 7.740 8.155 -0.415 2
1 1142 . 1 1 A 98 98 LEU HA H 98 4.110 4.006 0.104 2
1 1152 . 1 1 A 98 98 LEU C C 98 179.700 179.137 0.563 2
1 1153 . 1 1 A 98 98 LEU CA C 98 57.900 57.872 0.028 2
1 1154 . 1 1 A 98 98 LEU CB C 98 41.800 41.557 0.243 2
1 1158 . 1 1 A 98 98 LEU N N 98 119.200 121.489 -2.289 2
1 1159 . 1 1 A 99 99 SER H H 99 8.290 8.122 0.168 2
1 1160 . 1 1 A 99 99 SER HA H 99 4.220 4.261 -0.041 2
1 1163 . 1 1 A 99 99 SER C C 99 176.600 177.055 -0.455 2
1 1164 . 1 1 A 99 99 SER CA C 99 62.400 61.739 0.661 2
1 1165 . 1 1 A 99 99 SER CB C 99 63.200 62.826 0.374 2
1 1166 . 1 1 A 99 99 SER N N 99 116.300 114.138 2.162 2
1 1167 . 1 1 A 100 100 LEU H H 100 8.490 8.285 0.205 2
1 1168 . 1 1 A 100 100 LEU HA H 100 3.960 3.975 -0.015 2
1 1178 . 1 1 A 100 100 LEU C C 100 179.300 179.565 -0.265 2
1 1179 . 1 1 A 100 100 LEU CA C 100 57.700 57.941 -0.241 2
1 1180 . 1 1 A 100 100 LEU CB C 100 41.300 41.222 0.078 2
1 1184 . 1 1 A 100 100 LEU N N 100 120.900 122.504 -1.604 2
1 1185 . 1 1 A 101 101 GLN H H 101 7.680 8.515 -0.836 2
1 1186 . 1 1 A 101 101 GLN HA H 101 4.100 3.996 0.104 2
1 1193 . 1 1 A 101 101 GLN C C 101 178.700 177.848 0.852 2
1 1194 . 1 1 A 101 101 GLN CA C 101 58.800 58.830 -0.030 2
1 1195 . 1 1 A 101 101 GLN CB C 101 27.900 27.844 0.056 2
1 1197 . 1 1 A 101 101 GLN N N 101 119.100 118.013 1.087 2
1 1199 . 1 1 A 102 102 GLU H H 102 7.850 8.108 -0.258 2
1 1200 . 1 1 A 102 102 GLU HA H 102 4.050 4.111 -0.061 2
1 1205 . 1 1 A 102 102 GLU C C 102 179.100 178.948 0.152 2
1 1206 . 1 1 A 102 102 GLU CA C 102 58.400 59.284 -0.884 2
1 1207 . 1 1 A 102 102 GLU CB C 102 28.600 29.062 -0.462 2
1 1209 . 1 1 A 102 102 GLU N N 102 118.400 118.999 -0.599 2
1 1210 . 1 1 A 103 103 LEU H H 103 8.080 8.104 -0.024 2
1 1211 . 1 1 A 103 103 LEU HA H 103 4.020 4.003 0.016 2
1 1221 . 1 1 A 103 103 LEU C C 103 178.200 178.296 -0.096 2
1 1222 . 1 1 A 103 103 LEU CA C 103 57.000 58.188 -1.188 2
1 1223 . 1 1 A 103 103 LEU CB C 103 41.900 41.782 0.118 2
1 1227 . 1 1 A 103 103 LEU N N 103 120.600 123.296 -2.696 2
1 1228 . 1 1 A 104 104 GLN H H 104 7.900 8.381 -0.481 2
1 1229 . 1 1 A 104 104 GLN HA H 104 4.090 4.128 -0.038 2
1 1236 . 1 1 A 104 104 GLN C C 104 177.300 177.149 0.151 2
1 1237 . 1 1 A 104 104 GLN CA C 104 58.100 58.160 -0.060 2
1 1238 . 1 1 A 104 104 GLN CB C 104 29.400 27.937 1.463 2
1 1240 . 1 1 A 104 104 GLN N N 104 117.700 116.708 0.992 2
1 1242 . 1 1 A 105 105 VAL H H 105 7.620 7.333 0.287 2
1 1243 . 1 1 A 105 105 VAL HA H 105 4.190 4.164 0.026 2
1 1251 . 1 1 A 105 105 VAL C C 105 176.800 176.735 0.065 2
1 1252 . 1 1 A 105 105 VAL CA C 105 62.600 63.209 -0.609 2
1 1253 . 1 1 A 105 105 VAL CB C 105 32.000 32.337 -0.337 2
1 1256 . 1 1 A 105 105 VAL N N 105 114.900 116.287 -1.387 2
1 1257 . 1 1 A 106 106 SER H H 106 7.900 7.815 0.085 2
1 1258 . 1 1 A 106 106 SER HA H 106 4.460 4.723 -0.263 2
1 1261 . 1 1 A 106 106 SER C C 106 175.000 175.434 -0.434 2
1 1262 . 1 1 A 106 106 SER CA C 106 58.900 58.019 0.881 2
1 1263 . 1 1 A 106 106 SER CB C 106 63.900 63.829 0.071 2
1 1264 . 1 1 A 106 106 SER N N 106 116.900 117.500 -0.600 2
1 1265 . 1 1 A 107 107 SER H H 107 8.230 7.796 0.434 2
1 1266 . 1 1 A 107 107 SER HA H 107 4.390 4.153 0.237 2
1 1269 . 1 1 A 107 107 SER C C 107 174.600 175.012 -0.412 2
1 1270 . 1 1 A 107 107 SER CA C 107 58.400 61.243 -2.843 2
1 1271 . 1 1 A 107 107 SER CB C 107 63.600 63.142 0.458 2
1 1272 . 1 1 A 107 107 SER N N 107 117.500 116.644 0.856 2
1 1273 . 1 1 A 108 108 ALA H H 108 8.080 7.815 0.265 2
1 1274 . 1 1 A 108 108 ALA HA H 108 4.280 3.918 0.362 2
1 1278 . 1 1 A 108 108 ALA C C 108 177.500 177.109 0.391 2
1 1279 . 1 1 A 108 108 ALA CA C 108 52.700 54.599 -1.899 2
1 1280 . 1 1 A 108 108 ALA CB C 108 19.200 17.649 1.551 2
1 1281 . 1 1 A 108 108 ALA N N 108 124.900 120.707 4.193 2
1 1282 . 1 1 A 109 109 ALA H H 109 8.080 8.085 -0.005 2
1 1283 . 1 1 A 109 109 ALA HA H 109 4.280 4.305 -0.025 2
1 1287 . 1 1 A 109 109 ALA C C 109 177.700 177.712 -0.012 2
1 1288 . 1 1 A 109 109 ALA CA C 109 52.400 52.439 -0.039 2
1 1289 . 1 1 A 109 109 ALA CB C 109 19.400 20.197 -0.797 2
1 1290 . 1 1 A 109 109 ALA N N 109 123.000 119.964 3.036 2
1 1291 . 1 1 A 110 110 ALA H H 110 8.300 8.321 -0.021 2
1 1292 . 1 1 A 110 110 ALA HA H 110 4.280 4.139 0.141 2
1 1296 . 1 1 A 110 110 ALA C C 110 178.200 177.904 0.296 2
1 1297 . 1 1 A 110 110 ALA CA C 110 52.700 54.293 -1.593 2
1 1298 . 1 1 A 110 110 ALA CB C 110 19.200 18.683 0.517 2
1 1299 . 1 1 A 110 110 ALA N N 110 123.200 121.414 1.786 2
1 1300 . 1 1 A 111 111 GLY H H 111 8.300 7.839 0.461 2
1 1301 . 1 1 A 111 111 GLY HA2 H 111 3.930 4.075 -0.145 2
1 1302 . 1 1 A 111 111 GLY HA3 H 111 3.940 4.076 -0.136 2
1 1303 . 1 1 A 111 111 GLY C C 111 173.700 173.041 0.659 2
1 1304 . 1 1 A 111 111 GLY CA C 111 45.100 45.800 -0.700 2
1 1305 . 1 1 A 111 111 GLY N N 111 108.000 103.481 4.519 2
1 1306 . 1 1 A 112 112 VAL H H 112 7.930 8.152 -0.222 2
1 1307 . 1 1 A 112 112 VAL HA H 112 4.420 4.469 -0.049 2
1 1315 . 1 1 A 112 112 VAL CA C 112 60.000 59.074 0.926 2
1 1316 . 1 1 A 112 112 VAL CB C 112 32.200 34.103 -1.903 2
1 1319 . 1 1 A 112 112 VAL N N 112 120.400 122.338 -1.938 2
1 1320 . 1 1 A 113 113 PRO HA H 113 4.370 4.384 -0.014 2
1 1327 . 1 1 A 113 113 PRO C C 113 177.300 177.960 -0.660 2
1 1328 . 1 1 A 113 113 PRO CA C 113 63.900 63.577 0.323 2
1 1329 . 1 1 A 113 113 PRO CB C 113 31.800 31.674 0.125 2
1 1332 . 1 1 A 114 114 GLY H H 114 8.570 8.801 -0.231 2
1 1333 . 1 1 A 114 114 GLY HA2 H 114 3.880 3.943 -0.063 2
1 1334 . 1 1 A 114 114 GLY HA3 H 114 4.120 3.944 0.176 2
1 1335 . 1 1 A 114 114 GLY C C 114 174.900 175.206 -0.306 2
1 1336 . 1 1 A 114 114 GLY CA C 114 45.200 45.762 -0.562 2
1 1337 . 1 1 A 114 114 GLY N N 114 109.000 112.417 -3.417 2
1 1338 . 1 1 A 115 115 THR H H 115 7.900 7.631 0.269 2
1 1339 . 1 1 A 115 115 THR HA H 115 4.400 4.001 0.399 2
1 1344 . 1 1 A 115 115 THR C C 115 174.300 173.842 0.458 2
1 1345 . 1 1 A 115 115 THR CA C 115 61.700 64.778 -3.078 2
1 1346 . 1 1 A 115 115 THR CB C 115 69.700 69.634 0.066 2
1 1348 . 1 1 A 115 115 THR N N 115 111.400 115.787 -4.387 2
1 1349 . 1 1 A 116 116 ASN H H 116 8.450 8.008 0.442 2
1 1350 . 1 1 A 116 116 ASN HA H 116 4.970 5.130 -0.160 2
1 1355 . 1 1 A 116 116 ASN CA C 116 51.500 49.710 1.790 2
1 1356 . 1 1 A 116 116 ASN CB C 116 38.900 40.075 -1.175 2
1 1357 . 1 1 A 116 116 ASN N N 116 123.100 116.211 6.889 2
1 1359 . 1 1 A 117 117 PRO HA H 117 4.370 4.349 0.021 2
1 1366 . 1 1 A 117 117 PRO C C 117 178.400 178.125 0.275 2
1 1367 . 1 1 A 117 117 PRO CA C 117 64.800 64.735 0.065 2
1 1368 . 1 1 A 117 117 PRO CB C 117 32.100 31.904 0.196 2
1 1371 . 1 1 A 118 118 VAL H H 118 7.750 7.558 0.192 2
1 1372 . 1 1 A 118 118 VAL HA H 118 3.810 3.748 0.062 2
1 1380 . 1 1 A 118 118 VAL C C 118 178.300 178.159 0.141 2
1 1381 . 1 1 A 118 118 VAL CA C 118 65.200 65.475 -0.275 2
1 1382 . 1 1 A 118 118 VAL CB C 118 31.500 31.486 0.014 2
1 1385 . 1 1 A 118 118 VAL N N 118 118.300 116.316 1.984 2
1 1386 . 1 1 A 119 119 LEU H H 119 7.540 8.068 -0.528 2
1 1387 . 1 1 A 119 119 LEU HA H 119 4.030 3.898 0.132 2
1 1397 . 1 1 A 119 119 LEU C C 119 178.900 179.468 -0.568 2
1 1398 . 1 1 A 119 119 LEU CA C 119 57.800 58.085 -0.285 2
1 1399 . 1 1 A 119 119 LEU CB C 119 40.700 41.047 -0.347 2
1 1403 . 1 1 A 119 119 LEU N N 119 119.700 120.216 -0.516 2
1 1404 . 1 1 A 120 120 ASN H H 120 8.080 8.179 -0.099 2
1 1405 . 1 1 A 120 120 ASN HA H 120 4.420 4.468 -0.048 2
1 1410 . 1 1 A 120 120 ASN C C 120 178.100 178.254 -0.154 2
1 1411 . 1 1 A 120 120 ASN CA C 120 56.100 56.408 -0.308 2
1 1412 . 1 1 A 120 120 ASN CB C 120 37.800 38.139 -0.339 2
1 1413 . 1 1 A 120 120 ASN N N 120 117.700 118.175 -0.475 2
1 1415 . 1 1 A 121 121 ASN H H 121 8.120 8.089 0.031 2
1 1416 . 1 1 A 121 121 ASN HA H 121 4.490 4.505 -0.015 2
1 1421 . 1 1 A 121 121 ASN C C 121 178.000 178.238 -0.238 2
1 1422 . 1 1 A 121 121 ASN CA C 121 56.100 56.478 -0.378 2
1 1423 . 1 1 A 121 121 ASN CB C 121 37.800 38.325 -0.525 2
1 1424 . 1 1 A 121 121 ASN N N 121 120.000 118.083 1.917 2
1 1426 . 1 1 A 122 122 LEU H H 122 8.180 8.284 -0.104 2
1 1427 . 1 1 A 122 122 LEU HA H 122 4.050 3.917 0.133 2
1 1437 . 1 1 A 122 122 LEU C C 122 173.800 178.922 -5.122 2
1 1438 . 1 1 A 122 122 LEU CA C 122 58.500 57.943 0.557 2
1 1439 . 1 1 A 122 122 LEU CB C 122 41.900 41.846 0.054 2
1 1443 . 1 1 A 122 122 LEU N N 122 122.600 120.780 1.820 2
1 1444 . 1 1 A 123 123 LEU H H 123 8.260 7.982 0.278 2
1 1445 . 1 1 A 123 123 LEU HA H 123 3.850 3.974 -0.124 2
1 1455 . 1 1 A 123 123 LEU C C 123 178.900 178.476 0.424 2
1 1456 . 1 1 A 123 123 LEU CA C 123 58.500 58.146 0.354 2
1 1457 . 1 1 A 123 123 LEU CB C 123 41.200 41.371 -0.171 2
1 1461 . 1 1 A 123 123 LEU N N 123 119.700 120.531 -0.831 2
1 1462 . 1 1 A 124 124 SER H H 124 7.950 8.204 -0.254 2
1 1463 . 1 1 A 124 124 SER HA H 124 4.240 4.077 0.163 2
1 1466 . 1 1 A 124 124 SER C C 124 177.500 177.189 0.311 2
1 1467 . 1 1 A 124 124 SER CA C 124 61.600 61.789 -0.189 2
1 1468 . 1 1 A 124 124 SER CB C 124 62.600 62.843 -0.243 2
1 1469 . 1 1 A 124 124 SER N N 124 113.400 114.017 -0.617 2
1 1470 . 1 1 A 125 125 CYS H H 125 8.040 8.349 -0.309 2
1 1471 . 1 1 A 125 125 CYS HA H 125 4.350 4.113 0.237 2
1 1474 . 1 1 A 125 125 CYS C C 125 176.800 176.979 -0.179 2
1 1475 . 1 1 A 125 125 CYS CA C 125 62.600 63.809 -1.209 2
1 1476 . 1 1 A 125 125 CYS CB C 125 27.100 26.705 0.395 2
1 1477 . 1 1 A 125 125 CYS N N 125 119.800 119.513 0.287 2
1 1478 . 1 1 A 126 126 VAL H H 126 8.290 8.504 -0.214 2
1 1479 . 1 1 A 126 126 VAL HA H 126 3.430 3.417 0.013 2
1 1487 . 1 1 A 126 126 VAL C C 126 177.800 177.806 -0.006 2
1 1488 . 1 1 A 126 126 VAL CA C 126 67.100 66.839 0.261 2
1 1489 . 1 1 A 126 126 VAL CB C 126 31.400 31.501 -0.101 2
1 1492 . 1 1 A 126 126 VAL N N 126 121.900 120.591 1.310 2
1 1493 . 1 1 A 127 127 GLN H H 127 8.200 8.190 0.010 2
1 1494 . 1 1 A 127 127 GLN HA H 127 3.970 3.973 -0.003 2
1 1501 . 1 1 A 127 127 GLN C C 127 178.200 178.441 -0.241 2
1 1502 . 1 1 A 127 127 GLN CA C 127 58.700 58.832 -0.132 2
1 1503 . 1 1 A 127 127 GLN CB C 127 27.800 28.353 -0.553 2
1 1505 . 1 1 A 127 127 GLN N N 127 119.700 118.024 1.676 2
1 1507 . 1 1 A 128 128 GLU H H 128 7.880 7.999 -0.119 2
1 1508 . 1 1 A 128 128 GLU HA H 128 4.200 4.070 0.130 2
1 1513 . 1 1 A 128 128 GLU C C 128 178.400 178.726 -0.326 2
1 1514 . 1 1 A 128 128 GLU CA C 128 59.000 59.003 -0.003 2
1 1515 . 1 1 A 128 128 GLU CB C 128 28.400 29.473 -1.073 2
1 1517 . 1 1 A 128 128 GLU N N 128 119.800 119.416 0.384 2
1 1518 . 1 1 A 129 129 ILE H H 129 8.000 8.383 -0.383 2
1 1519 . 1 1 A 129 129 ILE HA H 129 3.460 3.557 -0.097 2
1 1529 . 1 1 A 129 129 ILE C C 129 176.800 178.056 -1.256 2
1 1530 . 1 1 A 129 129 ILE CA C 129 66.100 65.457 0.643 2
1 1531 . 1 1 A 129 129 ILE CB C 129 38.200 37.460 0.740 2
1 1535 . 1 1 A 129 129 ILE N N 129 119.500 120.264 -0.764 2
1 1536 . 1 1 A 130 130 SER H H 130 8.040 8.262 -0.222 2
1 1537 . 1 1 A 130 130 SER HA H 130 3.780 4.154 -0.374 2
1 1540 . 1 1 A 130 130 SER C C 130 176.200 176.381 -0.181 2
1 1541 . 1 1 A 130 130 SER CA C 130 62.100 61.569 0.530 2
1 1542 . 1 1 A 130 130 SER CB C 130 62.600 62.467 0.133 2
1 1543 . 1 1 A 130 130 SER N N 130 112.800 115.066 -2.266 2
1 1544 . 1 1 A 131 131 ASP H H 131 8.270 8.059 0.211 2
1 1545 . 1 1 A 131 131 ASP HA H 131 4.310 4.397 -0.087 2
1 1548 . 1 1 A 131 131 ASP C C 131 179.200 178.599 0.601 2
1 1549 . 1 1 A 131 131 ASP CA C 131 56.800 57.555 -0.755 2
1 1550 . 1 1 A 131 131 ASP CB C 131 40.900 41.388 -0.488 2
1 1551 . 1 1 A 131 131 ASP N N 131 119.600 121.789 -2.189 2
1 1552 . 1 1 A 132 132 VAL H H 132 8.470 8.278 0.192 2
1 1553 . 1 1 A 132 132 VAL HA H 132 3.520 3.733 -0.213 2
1 1561 . 1 1 A 132 132 VAL C C 132 178.700 178.556 0.144 2
1 1562 . 1 1 A 132 132 VAL CA C 132 66.500 66.356 0.144 2
1 1563 . 1 1 A 132 132 VAL CB C 132 31.500 31.758 -0.258 2
1 1566 . 1 1 A 132 132 VAL N N 132 118.100 119.419 -1.319 2
1 1567 . 1 1 A 133 133 VAL H H 133 8.140 7.994 0.146 2
1 1568 . 1 1 A 133 133 VAL HA H 133 3.770 3.756 0.014 2
1 1576 . 1 1 A 133 133 VAL C C 133 176.500 177.333 -0.833 2
1 1577 . 1 1 A 133 133 VAL CA C 133 65.100 66.627 -1.527 2
1 1578 . 1 1 A 133 133 VAL CB C 133 31.600 31.460 0.140 2
1 1581 . 1 1 A 133 133 VAL N N 133 117.000 120.643 -3.643 2
1 1582 . 1 1 A 134 134 GLN H H 134 7.490 7.850 -0.360 2
1 1583 . 1 1 A 134 134 GLN HA H 134 4.350 4.323 0.027 2
1 1590 . 1 1 A 134 134 GLN C C 134 175.400 176.700 -1.300 2
1 1591 . 1 1 A 134 134 GLN CA C 134 56.700 56.748 -0.048 2
1 1592 . 1 1 A 134 134 GLN CB C 134 30.500 28.770 1.730 2
1 1594 . 1 1 A 134 134 GLN N N 134 116.300 118.361 -2.061 2
stop_
save_