data_15437_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15437
_Entry.PDB_ID 2JUA
_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 10 . 1 1 1 A 2 2 TYR H H 2 8.688 7.373 1.315 1
1 11 . 1 1 1 A 2 2 TYR HA H 2 4.737 4.209 0.528 1
1 16 . 1 1 1 A 2 2 TYR C C 2 175.900 176.127 -0.227 1
1 17 . 1 1 1 A 2 2 TYR CA C 2 57.920 60.381 -2.461 1
1 18 . 1 1 1 A 2 2 TYR CB C 2 38.340 38.969 -0.629 1
1 19 . 1 1 1 A 2 2 TYR N N 2 122.100 123.379 -1.279 1
1 20 . 1 1 1 A 3 3 GLY H H 3 8.434 7.931 0.503 1
1 21 . 1 1 1 A 3 3 GLY HA2 H 3 3.909 3.968 -0.059 1
1 22 . 1 1 1 A 3 3 GLY HA3 H 3 3.841 3.992 -0.151 1
1 23 . 1 1 1 A 3 3 GLY C C 3 174.300 176.112 -1.812 1
1 24 . 1 1 1 A 3 3 GLY CA C 3 46.050 45.439 0.611 1
1 25 . 1 1 1 A 3 3 GLY N N 3 111.100 107.703 3.397 1
1 26 . 1 1 1 A 4 4 LYS H H 4 8.060 8.444 -0.384 1
1 27 . 1 1 1 A 4 4 LYS HA H 4 4.297 3.996 0.301 1
1 36 . 1 1 1 A 4 4 LYS C C 4 178.000 179.156 -1.156 1
1 37 . 1 1 1 A 4 4 LYS CA C 4 56.930 59.355 -2.425 1
1 38 . 1 1 1 A 4 4 LYS CB C 4 32.680 32.376 0.304 1
1 42 . 1 1 1 A 4 4 LYS N N 4 119.500 121.027 -1.527 1
1 43 . 1 1 1 A 5 5 LEU H H 5 8.243 8.239 0.004 1
1 44 . 1 1 1 A 5 5 LEU HA H 5 3.947 3.933 0.014 1
1 54 . 1 1 1 A 5 5 LEU C C 5 177.900 178.761 -0.861 1
1 55 . 1 1 1 A 5 5 LEU CA C 5 57.930 57.682 0.248 1
1 56 . 1 1 1 A 5 5 LEU CB C 5 41.620 41.666 -0.046 1
1 60 . 1 1 1 A 5 5 LEU N N 5 120.800 120.053 0.747 1
1 61 . 1 1 1 A 6 6 ASN H H 6 8.256 8.518 -0.262 1
1 62 . 1 1 1 A 6 6 ASN HA H 6 4.252 4.285 -0.033 1
1 67 . 1 1 1 A 6 6 ASN C C 6 177.300 177.707 -0.407 1
1 68 . 1 1 1 A 6 6 ASN CA C 6 56.900 56.509 0.391 1
1 69 . 1 1 1 A 6 6 ASN CB C 6 38.200 37.653 0.547 1
1 70 . 1 1 1 A 6 6 ASN N N 6 116.200 115.155 1.045 1
1 72 . 1 1 1 A 7 7 ASP H H 7 7.699 9.002 -1.303 1
1 73 . 1 1 1 A 7 7 ASP HA H 7 4.320 4.344 -0.024 1
1 76 . 1 1 1 A 7 7 ASP C C 7 178.000 178.602 -0.602 1
1 77 . 1 1 1 A 7 7 ASP CA C 7 56.980 57.572 -0.592 1
1 78 . 1 1 1 A 7 7 ASP CB C 7 39.870 41.385 -1.515 1
1 79 . 1 1 1 A 7 7 ASP N N 7 119.100 119.014 0.086 1
1 80 . 1 1 1 A 8 8 LEU H H 8 7.580 8.556 -0.976 1
1 81 . 1 1 1 A 8 8 LEU HA H 8 4.091 4.079 0.012 1
1 91 . 1 1 1 A 8 8 LEU C C 8 178.800 178.746 0.054 1
1 92 . 1 1 1 A 8 8 LEU CA C 8 57.790 57.890 -0.100 1
1 93 . 1 1 1 A 8 8 LEU CB C 8 41.880 41.667 0.213 1
1 97 . 1 1 1 A 8 8 LEU N N 8 120.400 119.912 0.488 1
1 98 . 1 1 1 A 9 9 LEU H H 9 8.125 8.993 -0.868 1
1 99 . 1 1 1 A 9 9 LEU HA H 9 3.891 3.917 -0.026 1
1 109 . 1 1 1 A 9 9 LEU C C 9 178.900 178.243 0.657 1
1 110 . 1 1 1 A 9 9 LEU CA C 9 58.350 58.553 -0.203 1
1 111 . 1 1 1 A 9 9 LEU CB C 9 41.510 41.858 -0.348 1
1 115 . 1 1 1 A 9 9 LEU N N 9 118.900 120.123 -1.223 1
1 116 . 1 1 1 A 10 10 GLU H H 10 8.011 9.004 -0.993 1
1 117 . 1 1 1 A 10 10 GLU HA H 10 4.072 3.909 0.163 1
1 122 . 1 1 1 A 10 10 GLU C C 10 179.000 179.259 -0.259 1
1 123 . 1 1 1 A 10 10 GLU CA C 10 59.090 59.831 -0.741 1
1 124 . 1 1 1 A 10 10 GLU CB C 10 27.910 29.186 -1.276 1
1 126 . 1 1 1 A 10 10 GLU N N 10 119.300 117.889 1.411 1
1 127 . 1 1 1 A 11 11 ASP H H 11 8.128 8.139 -0.011 1
1 128 . 1 1 1 A 11 11 ASP HA H 11 4.383 4.410 -0.027 1
1 131 . 1 1 1 A 11 11 ASP C C 11 178.500 178.923 -0.423 1
1 132 . 1 1 1 A 11 11 ASP CA C 11 56.580 56.840 -0.260 1
1 133 . 1 1 1 A 11 11 ASP CB C 11 38.600 40.131 -1.531 1
1 134 . 1 1 1 A 11 11 ASP N N 11 119.600 120.237 -0.637 1
1 135 . 1 1 1 A 12 12 LEU H H 12 8.394 7.903 0.491 1
1 136 . 1 1 1 A 12 12 LEU HA H 12 3.923 4.245 -0.322 1
1 146 . 1 1 1 A 12 12 LEU C C 12 178.200 178.710 -0.510 1
1 147 . 1 1 1 A 12 12 LEU CA C 12 57.880 57.325 0.555 1
1 148 . 1 1 1 A 12 12 LEU CB C 12 41.850 41.837 0.013 1
1 152 . 1 1 1 A 12 12 LEU N N 12 120.500 121.381 -0.881 1
1 153 . 1 1 1 A 13 13 GLN H H 13 8.371 8.585 -0.214 1
1 154 . 1 1 1 A 13 13 GLN HA H 13 3.879 4.010 -0.131 1
1 161 . 1 1 1 A 13 13 GLN C C 13 178.600 177.846 0.754 1
1 162 . 1 1 1 A 13 13 GLN CA C 13 59.570 58.226 1.344 1
1 163 . 1 1 1 A 13 13 GLN CB C 13 28.440 27.959 0.481 1
1 165 . 1 1 1 A 13 13 GLN N N 13 118.400 117.159 1.241 1
1 167 . 1 1 1 A 14 14 GLU H H 14 7.913 7.759 0.154 1
1 168 . 1 1 1 A 14 14 GLU HA H 14 4.021 4.046 -0.025 1
1 173 . 1 1 1 A 14 14 GLU C C 14 179.000 178.889 0.111 1
1 174 . 1 1 1 A 14 14 GLU CA C 14 59.030 59.090 -0.060 1
1 175 . 1 1 1 A 14 14 GLU CB C 14 28.720 29.502 -0.782 1
1 177 . 1 1 1 A 14 14 GLU N N 14 119.100 119.916 -0.816 1
1 178 . 1 1 1 A 15 15 VAL H H 15 7.991 7.586 0.405 1
1 179 . 1 1 1 A 15 15 VAL HA H 15 3.696 3.868 -0.172 1
1 187 . 1 1 1 A 15 15 VAL C C 15 178.300 177.931 0.369 1
1 188 . 1 1 1 A 15 15 VAL CA C 15 66.640 65.473 1.167 1
1 189 . 1 1 1 A 15 15 VAL CB C 15 31.470 31.561 -0.091 1
1 192 . 1 1 1 A 15 15 VAL N N 15 120.300 117.653 2.647 1
1 193 . 1 1 1 A 16 16 LEU H H 16 8.172 7.812 0.360 1
1 194 . 1 1 1 A 16 16 LEU HA H 16 3.876 4.218 -0.342 1
1 204 . 1 1 1 A 16 16 LEU C C 16 178.400 178.404 -0.004 1
1 205 . 1 1 1 A 16 16 LEU CA C 16 58.050 57.977 0.073 1
1 206 . 1 1 1 A 16 16 LEU CB C 16 41.420 41.636 -0.216 1
1 210 . 1 1 1 A 16 16 LEU N N 16 119.700 124.651 -4.951 1
1 211 . 1 1 1 A 17 17 LYS H H 17 7.755 8.729 -0.974 1
1 212 . 1 1 1 A 17 17 LYS HA H 17 3.951 4.057 -0.106 1
1 221 . 1 1 1 A 17 17 LYS C C 17 178.800 178.726 0.074 1
1 222 . 1 1 1 A 17 17 LYS CA C 17 59.470 58.887 0.583 1
1 223 . 1 1 1 A 17 17 LYS CB C 17 32.350 32.517 -0.167 1
1 227 . 1 1 1 A 17 17 LYS N N 17 117.800 119.774 -1.974 1
1 228 . 1 1 1 A 18 18 HIS H H 18 7.847 8.368 -0.521 1
1 229 . 1 1 1 A 18 18 HIS HA H 18 4.549 4.649 -0.100 1
1 233 . 1 1 1 A 18 18 HIS C C 18 177.200 176.279 0.921 1
1 234 . 1 1 1 A 18 18 HIS CA C 18 57.870 58.319 -0.449 1
1 235 . 1 1 1 A 18 18 HIS CB C 18 28.730 29.047 -0.317 1
1 236 . 1 1 1 A 18 18 HIS N N 18 116.200 117.459 -1.259 1
1 237 . 1 1 1 A 19 19 VAL H H 19 8.415 7.814 0.601 1
1 238 . 1 1 1 A 19 19 VAL HA H 19 3.746 4.048 -0.302 1
1 246 . 1 1 1 A 19 19 VAL CA C 19 65.850 65.012 0.838 1
1 247 . 1 1 1 A 19 19 VAL CB C 19 31.600 32.484 -0.884 1
1 250 . 1 1 1 A 20 20 ASN H H 20 8.041 8.413 -0.372 1
1 251 . 1 1 1 A 20 20 ASN HA H 20 4.545 4.632 -0.087 1
1 256 . 1 1 1 A 20 20 ASN C C 20 176.900 177.189 -0.289 1
1 257 . 1 1 1 A 20 20 ASN CA C 20 55.070 56.825 -1.755 1
1 258 . 1 1 1 A 20 20 ASN CB C 20 38.270 38.076 0.194 1
1 259 . 1 1 1 A 20 20 ASN N N 20 117.900 118.816 -0.916 1
1 261 . 1 1 1 A 21 21 GLN H H 21 7.887 8.046 -0.159 1
1 262 . 1 1 1 A 21 21 GLN HA H 21 4.096 4.249 -0.153 1
1 269 . 1 1 1 A 21 21 GLN C C 21 176.900 176.904 -0.004 1
1 270 . 1 1 1 A 21 21 GLN CA C 21 57.510 57.050 0.460 1
1 271 . 1 1 1 A 21 21 GLN CB C 21 29.100 29.545 -0.445 1
1 273 . 1 1 1 A 21 21 GLN N N 21 117.900 117.865 0.035 1
1 275 . 1 1 1 A 22 22 HIS H H 22 7.887 8.192 -0.305 1
1 276 . 1 1 1 A 22 22 HIS HA H 22 4.679 4.906 -0.227 1
1 280 . 1 1 1 A 22 22 HIS C C 22 174.300 174.849 -0.549 1
1 281 . 1 1 1 A 22 22 HIS CA C 22 55.770 55.514 0.256 1
1 282 . 1 1 1 A 22 22 HIS CB C 22 28.630 29.746 -1.116 1
1 283 . 1 1 1 A 22 22 HIS N N 22 116.100 114.818 1.282 1
1 284 . 1 1 1 A 23 23 TRP H H 23 7.929 7.941 -0.012 1
1 285 . 1 1 1 A 23 23 TRP HA H 23 4.542 4.768 -0.226 1
1 292 . 1 1 1 A 23 23 TRP C C 23 176.600 175.760 0.840 1
1 293 . 1 1 1 A 23 23 TRP CA C 23 58.020 58.051 -0.031 1
1 294 . 1 1 1 A 23 23 TRP CB C 23 29.700 30.728 -1.028 1
1 295 . 1 1 1 A 23 23 TRP N N 23 122.000 124.060 -2.060 1
1 297 . 1 1 1 A 24 24 GLN H H 24 8.258 8.192 0.066 1
1 298 . 1 1 1 A 24 24 GLN HA H 24 4.329 4.752 -0.423 1
1 305 . 1 1 1 A 24 24 GLN C C 24 176.200 175.266 0.934 1
1 306 . 1 1 1 A 24 24 GLN CA C 24 55.960 55.483 0.477 1
1 307 . 1 1 1 A 24 24 GLN CB C 24 29.440 31.961 -2.521 1
1 309 . 1 1 1 A 24 24 GLN N N 24 123.800 126.897 -3.097 1
1 311 . 1 1 1 A 25 25 GLY H H 25 7.470 8.861 -1.391 1
1 312 . 1 1 1 A 25 25 GLY HA2 H 25 3.939 3.974 -0.035 1
1 313 . 1 1 1 A 25 25 GLY HA3 H 25 3.800 3.990 -0.190 1
1 314 . 1 1 1 A 25 25 GLY C C 25 174.800 174.741 0.059 1
1 315 . 1 1 1 A 25 25 GLY CA C 25 45.470 45.900 -0.430 1
1 316 . 1 1 1 A 25 25 GLY N N 25 108.100 113.129 -5.029 1
1 317 . 1 1 1 A 26 26 GLY H H 26 8.332 8.525 -0.193 1
1 318 . 1 1 1 A 26 26 GLY HA2 H 26 4.105 4.183 -0.078 1
1 319 . 1 1 1 A 26 26 GLY HA3 H 26 3.974 4.264 -0.290 1
1 320 . 1 1 1 A 26 26 GLY C C 26 174.900 175.006 -0.106 1
1 321 . 1 1 1 A 26 26 GLY CA C 26 45.410 45.756 -0.346 1
1 322 . 1 1 1 A 26 26 GLY N N 26 108.700 107.467 1.233 1
1 323 . 1 1 1 A 27 27 GLN H H 27 8.474 8.574 -0.100 1
1 324 . 1 1 1 A 27 27 GLN HA H 27 4.106 3.944 0.162 1
1 331 . 1 1 1 A 27 27 GLN C C 27 177.100 176.879 0.221 1
1 332 . 1 1 1 A 27 27 GLN CA C 27 57.540 57.913 -0.373 1
1 333 . 1 1 1 A 27 27 GLN CB C 27 29.050 28.840 0.210 1
1 335 . 1 1 1 A 27 27 GLN N N 27 121.100 121.519 -0.419 1
1 337 . 1 1 1 A 28 28 LYS H H 28 8.448 8.109 0.339 1
1 338 . 1 1 1 A 28 28 LYS HA H 28 4.068 4.050 0.018 1
1 347 . 1 1 1 A 28 28 LYS C C 28 177.900 178.471 -0.571 1
1 348 . 1 1 1 A 28 28 LYS CA C 28 58.410 58.620 -0.210 1
1 349 . 1 1 1 A 28 28 LYS CB C 28 32.210 32.482 -0.272 1
1 353 . 1 1 1 A 28 28 LYS N N 28 120.500 117.569 2.931 1
1 354 . 1 1 1 A 29 29 ASN H H 29 8.273 8.363 -0.090 1
1 355 . 1 1 1 A 29 29 ASN HA H 29 4.584 4.408 0.176 1
1 360 . 1 1 1 A 29 29 ASN C C 29 176.200 177.153 -0.953 1
1 361 . 1 1 1 A 29 29 ASN CA C 29 54.400 56.041 -1.641 1
1 362 . 1 1 1 A 29 29 ASN CB C 29 38.280 38.405 -0.125 1
1 363 . 1 1 1 A 29 29 ASN N N 29 117.500 118.067 -0.567 1
1 365 . 1 1 1 A 30 30 MET H H 30 7.870 7.343 0.527 1
1 366 . 1 1 1 A 30 30 MET HA H 30 4.085 2.809 1.276 1
1 371 . 1 1 1 A 30 30 MET C C 30 177.000 177.482 -0.482 1
1 372 . 1 1 1 A 30 30 MET CA C 30 56.880 57.675 -0.795 1
1 373 . 1 1 1 A 30 30 MET CB C 30 32.340 31.753 0.587 1
1 375 . 1 1 1 A 30 30 MET N N 30 121.100 118.391 2.709 1
1 376 . 1 1 1 A 31 31 ASN H H 31 8.186 7.540 0.646 1
1 377 . 1 1 1 A 31 31 ASN HA H 31 4.311 4.474 -0.163 1
1 382 . 1 1 1 A 31 31 ASN C C 31 176.700 177.384 -0.684 1
1 383 . 1 1 1 A 31 31 ASN CA C 31 55.320 55.178 0.142 1
1 384 . 1 1 1 A 31 31 ASN CB C 31 38.410 38.362 0.048 1
1 385 . 1 1 1 A 31 31 ASN N N 31 117.900 115.566 2.334 1
1 387 . 1 1 1 A 32 32 LYS H H 32 7.792 7.248 0.544 1
1 388 . 1 1 1 A 32 32 LYS HA H 32 3.992 3.882 0.110 1
1 397 . 1 1 1 A 32 32 LYS C C 32 177.900 179.056 -1.156 1
1 398 . 1 1 1 A 32 32 LYS CA C 32 59.050 58.610 0.440 1
1 399 . 1 1 1 A 32 32 LYS CB C 32 32.460 32.441 0.019 1
1 403 . 1 1 1 A 32 32 LYS N N 32 120.400 118.786 1.614 1
1 404 . 1 1 1 A 33 33 VAL H H 33 7.689 8.152 -0.463 1
1 405 . 1 1 1 A 33 33 VAL HA H 33 3.791 3.717 0.074 1
1 413 . 1 1 1 A 33 33 VAL C C 33 177.100 177.621 -0.521 1
1 414 . 1 1 1 A 33 33 VAL CA C 33 65.360 64.899 0.461 1
1 415 . 1 1 1 A 33 33 VAL CB C 33 31.920 31.671 0.249 1
1 418 . 1 1 1 A 33 33 VAL N N 33 120.200 115.322 4.878 1
1 419 . 1 1 1 A 34 34 ASP H H 34 8.408 8.355 0.053 1
1 420 . 1 1 1 A 34 34 ASP HA H 34 4.303 4.306 -0.003 1
1 423 . 1 1 1 A 34 34 ASP C C 34 178.200 178.089 0.111 1
1 424 . 1 1 1 A 34 34 ASP CA C 34 55.880 57.059 -1.179 1
1 425 . 1 1 1 A 34 34 ASP CB C 34 38.710 41.595 -2.885 1
1 426 . 1 1 1 A 34 34 ASP N N 34 120.100 121.431 -1.331 1
1 427 . 1 1 1 A 35 35 HIS H H 35 8.204 7.698 0.506 1
1 428 . 1 1 1 A 35 35 HIS HA H 35 4.343 4.251 0.092 1
1 431 . 1 1 1 A 35 35 HIS C C 35 176.800 177.090 -0.290 1
1 432 . 1 1 1 A 35 35 HIS CA C 35 58.310 58.533 -0.223 1
1 433 . 1 1 1 A 35 35 HIS CB C 35 28.070 30.020 -1.950 1
1 434 . 1 1 1 A 35 35 HIS N N 35 118.200 119.372 -1.172 1
1 435 . 1 1 1 A 36 36 HIS H H 36 8.067 8.220 -0.153 1
1 436 . 1 1 1 A 36 36 HIS HA H 36 4.602 4.301 0.301 1
1 440 . 1 1 1 A 36 36 HIS C C 36 177.100 177.634 -0.534 1
1 441 . 1 1 1 A 36 36 HIS CA C 36 58.520 59.873 -1.353 1
1 442 . 1 1 1 A 36 36 HIS CB C 36 28.720 30.322 -1.602 1
1 443 . 1 1 1 A 36 36 HIS N N 36 117.100 117.159 -0.059 1
1 444 . 1 1 1 A 37 37 LEU H H 37 8.473 8.139 0.334 1
1 445 . 1 1 1 A 37 37 LEU HA H 37 3.894 3.724 0.170 1
1 455 . 1 1 1 A 37 37 LEU C C 37 178.200 178.559 -0.359 1
1 456 . 1 1 1 A 37 37 LEU CA C 37 58.520 57.859 0.661 1
1 457 . 1 1 1 A 37 37 LEU CB C 37 41.810 41.439 0.371 1
1 461 . 1 1 1 A 37 37 LEU N N 37 119.600 119.578 0.022 1
1 462 . 1 1 1 A 38 38 GLN H H 38 8.337 8.099 0.238 1
1 463 . 1 1 1 A 38 38 GLN HA H 38 3.882 3.907 -0.025 1
1 470 . 1 1 1 A 38 38 GLN C C 38 178.500 178.345 0.155 1
1 471 . 1 1 1 A 38 38 GLN CA C 38 59.200 59.214 -0.014 1
1 472 . 1 1 1 A 38 38 GLN CB C 38 27.850 28.230 -0.380 1
1 474 . 1 1 1 A 38 38 GLN N N 38 118.000 116.980 1.020 1
1 476 . 1 1 1 A 39 39 ASN H H 39 7.923 7.576 0.347 1
1 477 . 1 1 1 A 39 39 ASN HA H 39 4.390 4.396 -0.006 1
1 482 . 1 1 1 A 39 39 ASN C C 39 177.500 177.657 -0.157 1
1 483 . 1 1 1 A 39 39 ASN CA C 39 55.780 56.209 -0.429 1
1 484 . 1 1 1 A 39 39 ASN CB C 39 37.450 38.723 -1.273 1
1 485 . 1 1 1 A 39 39 ASN N N 39 118.700 117.698 1.002 1
1 487 . 1 1 1 A 40 40 VAL H H 40 7.907 8.200 -0.293 1
1 488 . 1 1 1 A 40 40 VAL HA H 40 3.629 3.491 0.138 1
1 496 . 1 1 1 A 40 40 VAL C C 40 177.500 177.776 -0.276 1
1 497 . 1 1 1 A 40 40 VAL CA C 40 67.080 66.201 0.879 1
1 498 . 1 1 1 A 40 40 VAL CB C 40 31.390 31.419 -0.029 1
1 501 . 1 1 1 A 40 40 VAL N N 40 120.400 118.770 1.630 1
1 502 . 1 1 1 A 41 41 ILE H H 41 8.103 8.171 -0.068 1
1 503 . 1 1 1 A 41 41 ILE HA H 41 3.401 3.643 -0.242 1
1 513 . 1 1 1 A 41 41 ILE C C 41 178.000 178.539 -0.539 1
1 514 . 1 1 1 A 41 41 ILE CA C 41 66.430 65.151 1.279 1
1 515 . 1 1 1 A 41 41 ILE CB C 41 38.050 37.656 0.394 1
1 519 . 1 1 1 A 41 41 ILE N N 41 120.600 119.413 1.187 1
1 520 . 1 1 1 A 42 42 GLU H H 42 8.150 7.648 0.502 1
1 521 . 1 1 1 A 42 42 GLU HA H 42 4.062 4.100 -0.038 1
1 526 . 1 1 1 A 42 42 GLU C C 42 178.500 178.344 0.156 1
1 527 . 1 1 1 A 42 42 GLU CA C 42 59.120 59.106 0.014 1
1 528 . 1 1 1 A 42 42 GLU CB C 42 28.160 29.166 -1.006 1
1 530 . 1 1 1 A 42 42 GLU N N 42 119.900 121.832 -1.932 1
1 531 . 1 1 1 A 43 43 ASP H H 43 8.453 9.109 -0.656 1
1 532 . 1 1 1 A 43 43 ASP HA H 43 4.445 4.379 0.066 1
1 535 . 1 1 1 A 43 43 ASP C C 43 178.400 178.576 -0.176 1
1 536 . 1 1 1 A 43 43 ASP CA C 43 56.490 57.883 -1.393 1
1 537 . 1 1 1 A 43 43 ASP CB C 43 37.820 41.757 -3.937 1
1 538 . 1 1 1 A 43 43 ASP N N 43 119.700 120.122 -0.422 1
1 539 . 1 1 1 A 44 44 ILE H H 44 8.544 7.865 0.679 1
1 540 . 1 1 1 A 44 44 ILE HA H 44 3.590 3.779 -0.189 1
1 550 . 1 1 1 A 44 44 ILE C C 44 177.800 177.933 -0.133 1
1 551 . 1 1 1 A 44 44 ILE CA C 44 66.320 65.320 1.000 1
1 552 . 1 1 1 A 44 44 ILE CB C 44 37.690 38.181 -0.491 1
1 556 . 1 1 1 A 44 44 ILE N N 44 121.500 119.594 1.906 1
1 557 . 1 1 1 A 45 45 HIS H H 45 8.261 8.195 0.066 1
1 558 . 1 1 1 A 45 45 HIS HA H 45 4.255 4.155 0.100 1
1 562 . 1 1 1 A 45 45 HIS C C 45 177.200 176.105 1.095 1
1 563 . 1 1 1 A 45 45 HIS CA C 45 59.580 59.895 -0.315 1
1 564 . 1 1 1 A 45 45 HIS CB C 45 27.790 30.027 -2.237 1
1 565 . 1 1 1 A 45 45 HIS N N 45 118.800 119.648 -0.848 1
1 566 . 1 1 1 A 46 46 ASP H H 46 8.680 8.477 0.203 1
1 567 . 1 1 1 A 46 46 ASP HA H 46 4.338 4.504 -0.166 1
1 570 . 1 1 1 A 46 46 ASP C C 46 178.700 177.353 1.347 1
1 571 . 1 1 1 A 46 46 ASP CA C 46 57.010 54.623 2.387 1
1 572 . 1 1 1 A 46 46 ASP CB C 46 39.400 41.046 -1.646 1
1 573 . 1 1 1 A 46 46 ASP N N 46 119.200 119.481 -0.281 1
1 574 . 1 1 1 A 47 47 PHE H H 47 8.380 9.403 -1.023 1
1 575 . 1 1 1 A 47 47 PHE HA H 47 4.070 4.524 -0.454 1
1 580 . 1 1 1 A 47 47 PHE C C 47 178.600 177.563 1.037 1
1 581 . 1 1 1 A 47 47 PHE CA C 47 61.250 60.117 1.133 1
1 582 . 1 1 1 A 47 47 PHE CB C 47 39.570 39.834 -0.264 1
1 583 . 1 1 1 A 47 47 PHE N N 47 121.800 121.161 0.639 1
1 584 . 1 1 1 A 48 48 MET H H 48 8.366 8.342 0.024 1
1 585 . 1 1 1 A 48 48 MET HA H 48 3.998 4.155 -0.157 1
1 590 . 1 1 1 A 48 48 MET C C 48 177.400 178.672 -1.272 1
1 591 . 1 1 1 A 48 48 MET CA C 48 58.470 58.390 0.080 1
1 592 . 1 1 1 A 48 48 MET CB C 48 33.170 32.666 0.504 1
1 594 . 1 1 1 A 48 48 MET N N 48 117.700 118.484 -0.784 1
1 595 . 1 1 1 A 49 49 GLN H H 49 7.659 8.014 -0.355 1
1 596 . 1 1 1 A 49 49 GLN HA H 49 4.258 3.899 0.359 1
1 603 . 1 1 1 A 49 49 GLN C C 49 176.700 178.087 -1.387 1
1 604 . 1 1 1 A 49 49 GLN CA C 49 56.380 58.697 -2.317 1
1 605 . 1 1 1 A 49 49 GLN CB C 49 28.980 28.340 0.640 1
1 607 . 1 1 1 A 49 49 GLN N N 49 116.700 120.256 -3.556 1
1 609 . 1 1 1 A 50 50 GLY H H 50 7.685 7.891 -0.206 1
1 610 . 1 1 1 A 50 50 GLY HA2 H 50 3.998 3.826 0.172 1
1 611 . 1 1 1 A 50 50 GLY HA3 H 50 3.998 3.863 0.135 1
1 612 . 1 1 1 A 50 50 GLY C C 50 174.900 174.753 0.147 1
1 613 . 1 1 1 A 50 50 GLY CA C 50 45.460 45.077 0.383 1
1 614 . 1 1 1 A 50 50 GLY N N 50 106.400 107.957 -1.557 1
1 615 . 1 1 1 A 51 51 GLY H H 51 8.031 7.810 0.221 1
1 616 . 1 1 1 A 51 51 GLY HA2 H 51 3.817 3.606 0.211 1
1 617 . 1 1 1 A 51 51 GLY HA3 H 51 3.817 3.664 0.153 1
1 618 . 1 1 1 A 51 51 GLY C C 51 174.500 174.427 0.073 1
1 619 . 1 1 1 A 51 51 GLY CA C 51 45.190 46.507 -1.317 1
1 620 . 1 1 1 A 51 51 GLY N N 51 108.900 108.861 0.039 1
1 621 . 1 1 1 A 52 52 GLY H H 52 8.126 7.402 0.724 1
1 622 . 1 1 1 A 52 52 GLY HA2 H 52 3.362 3.781 -0.419 1
1 623 . 1 1 1 A 52 52 GLY HA3 H 52 3.362 3.985 -0.623 1
1 624 . 1 1 1 A 52 52 GLY C C 52 173.300 174.063 -0.763 1
1 625 . 1 1 1 A 52 52 GLY CA C 52 45.120 45.406 -0.286 1
1 626 . 1 1 1 A 52 52 GLY N N 52 108.100 106.967 1.133 1
1 627 . 1 1 1 A 53 53 SER H H 53 7.594 7.320 0.274 1
1 628 . 1 1 1 A 53 53 SER HA H 53 4.530 4.649 -0.119 1
1 631 . 1 1 1 A 53 53 SER C C 53 175.300 175.271 0.029 1
1 632 . 1 1 1 A 53 53 SER CA C 53 57.770 58.185 -0.415 1
1 633 . 1 1 1 A 53 53 SER CB C 53 64.750 63.407 1.343 1
1 634 . 1 1 1 A 53 53 SER N N 53 114.100 114.716 -0.616 1
1 635 . 1 1 1 A 54 54 GLY H H 54 9.003 8.393 0.610 1
1 636 . 1 1 1 A 54 54 GLY HA2 H 54 4.037 4.050 -0.013 1
1 637 . 1 1 1 A 54 54 GLY HA3 H 54 3.911 4.113 -0.202 1
1 638 . 1 1 1 A 54 54 GLY C C 54 176.500 175.548 0.952 1
1 639 . 1 1 1 A 54 54 GLY CA C 54 47.040 47.228 -0.188 1
1 640 . 1 1 1 A 54 54 GLY N N 54 110.400 110.277 0.123 1
1 641 . 1 1 1 A 55 55 GLY H H 55 8.617 8.319 0.298 1
1 642 . 1 1 1 A 55 55 GLY HA2 H 55 3.946 3.927 0.019 1
1 643 . 1 1 1 A 55 55 GLY HA3 H 55 3.946 3.946 0.000 1
1 644 . 1 1 1 A 55 55 GLY C C 55 176.400 174.939 1.461 1
1 645 . 1 1 1 A 55 55 GLY CA C 55 46.630 46.719 -0.089 1
1 646 . 1 1 1 A 55 55 GLY N N 55 109.800 109.356 0.444 1
1 647 . 1 1 1 A 56 56 LYS H H 56 7.876 9.063 -1.187 1
1 648 . 1 1 1 A 56 56 LYS HA H 56 4.195 4.296 -0.101 1
1 657 . 1 1 1 A 56 56 LYS C C 56 178.600 178.861 -0.261 1
1 658 . 1 1 1 A 56 56 LYS CA C 56 57.960 57.597 0.363 1
1 659 . 1 1 1 A 56 56 LYS CB C 56 32.110 33.048 -0.938 1
1 663 . 1 1 1 A 56 56 LYS N N 56 121.800 121.734 0.066 1
1 664 . 1 1 1 A 57 57 LEU H H 57 8.153 8.251 -0.098 1
1 665 . 1 1 1 A 57 57 LEU HA H 57 3.992 4.229 -0.237 1
1 675 . 1 1 1 A 57 57 LEU C C 57 178.400 178.974 -0.574 1
1 676 . 1 1 1 A 57 57 LEU CA C 57 58.190 57.993 0.197 1
1 677 . 1 1 1 A 57 57 LEU CB C 57 41.360 42.044 -0.684 1
1 681 . 1 1 1 A 57 57 LEU N N 57 120.700 122.166 -1.466 1
1 682 . 1 1 1 A 58 58 GLN H H 58 8.019 8.511 -0.492 1
1 683 . 1 1 1 A 58 58 GLN HA H 58 3.942 4.133 -0.191 1
1 690 . 1 1 1 A 58 58 GLN C C 58 179.100 178.331 0.769 1
1 691 . 1 1 1 A 58 58 GLN CA C 58 59.360 58.432 0.928 1
1 692 . 1 1 1 A 58 58 GLN CB C 58 28.030 28.370 -0.340 1
1 694 . 1 1 1 A 58 58 GLN N N 58 117.400 117.506 -0.106 1
1 696 . 1 1 1 A 59 59 GLU H H 59 7.838 8.197 -0.359 1
1 697 . 1 1 1 A 59 59 GLU HA H 59 4.030 4.200 -0.170 1
1 702 . 1 1 1 A 59 59 GLU C C 59 178.600 179.182 -0.582 1
1 703 . 1 1 1 A 59 59 GLU CA C 59 59.250 59.082 0.168 1
1 704 . 1 1 1 A 59 59 GLU CB C 59 28.960 30.310 -1.350 1
1 706 . 1 1 1 A 59 59 GLU N N 59 119.900 119.259 0.641 1
1 707 . 1 1 1 A 60 60 MET H H 60 8.223 8.076 0.147 1
1 708 . 1 1 1 A 60 60 MET HA H 60 3.966 4.242 -0.276 1
1 713 . 1 1 1 A 60 60 MET C C 60 177.900 178.343 -0.443 1
1 714 . 1 1 1 A 60 60 MET CA C 60 59.350 57.499 1.851 1
1 715 . 1 1 1 A 60 60 MET CB C 60 33.210 32.297 0.913 1
1 717 . 1 1 1 A 60 60 MET N N 60 120.100 119.262 0.838 1
1 718 . 1 1 1 A 61 61 MET H H 61 8.134 8.239 -0.105 1
1 719 . 1 1 1 A 61 61 MET HA H 61 4.195 4.219 -0.024 1
1 724 . 1 1 1 A 61 61 MET C C 61 179.100 178.288 0.812 1
1 725 . 1 1 1 A 61 61 MET CA C 61 58.210 59.035 -0.825 1
1 726 . 1 1 1 A 61 61 MET CB C 61 31.340 32.089 -0.749 1
1 728 . 1 1 1 A 61 61 MET N N 61 117.000 119.990 -2.990 1
1 729 . 1 1 1 A 62 62 LYS H H 62 7.782 8.289 -0.507 1
1 730 . 1 1 1 A 62 62 LYS HA H 62 4.085 3.961 0.124 1
1 739 . 1 1 1 A 62 62 LYS C C 62 179.600 178.880 0.720 1
1 740 . 1 1 1 A 62 62 LYS CA C 62 59.610 60.118 -0.508 1
1 741 . 1 1 1 A 62 62 LYS CB C 62 32.180 32.353 -0.173 1
1 745 . 1 1 1 A 62 62 LYS N N 62 120.600 118.795 1.805 1
1 746 . 1 1 1 A 63 63 GLU H H 63 8.041 8.104 -0.063 1
1 747 . 1 1 1 A 63 63 GLU HA H 63 4.057 3.780 0.277 1
1 752 . 1 1 1 A 63 63 GLU C C 63 178.900 178.704 0.196 1
1 753 . 1 1 1 A 63 63 GLU CA C 63 59.170 59.232 -0.062 1
1 754 . 1 1 1 A 63 63 GLU CB C 63 29.000 29.079 -0.079 1
1 756 . 1 1 1 A 63 63 GLU N N 63 120.200 119.917 0.283 1
1 757 . 1 1 1 A 64 64 PHE H H 64 8.604 9.145 -0.541 1
1 758 . 1 1 1 A 64 64 PHE HA H 64 4.155 3.794 0.361 1
1 763 . 1 1 1 A 64 64 PHE C C 64 177.800 177.707 0.093 1
1 764 . 1 1 1 A 64 64 PHE CA C 64 59.820 60.720 -0.900 1
1 765 . 1 1 1 A 64 64 PHE CB C 64 38.470 38.143 0.327 1
1 766 . 1 1 1 A 64 64 PHE N N 64 119.700 120.336 -0.636 1
1 767 . 1 1 1 A 65 65 GLN H H 65 8.177 8.285 -0.108 1
1 768 . 1 1 1 A 65 65 GLN HA H 65 3.637 4.118 -0.481 1
1 775 . 1 1 1 A 65 65 GLN C C 65 177.800 177.901 -0.101 1
1 776 . 1 1 1 A 65 65 GLN CA C 65 58.970 58.237 0.733 1
1 777 . 1 1 1 A 65 65 GLN CB C 65 28.280 28.622 -0.342 1
1 779 . 1 1 1 A 65 65 GLN N N 65 118.500 118.466 0.034 1
1 781 . 1 1 1 A 66 66 GLN H H 66 7.622 7.592 0.030 1
1 782 . 1 1 1 A 66 66 GLN HA H 66 4.040 4.236 -0.196 1
1 789 . 1 1 1 A 66 66 GLN C C 66 178.600 177.968 0.632 1
1 790 . 1 1 1 A 66 66 GLN CA C 66 59.150 58.366 0.784 1
1 791 . 1 1 1 A 66 66 GLN CB C 66 28.230 28.245 -0.015 1
1 793 . 1 1 1 A 66 66 GLN N N 66 117.400 118.337 -0.937 1
1 795 . 1 1 1 A 67 67 VAL H H 67 7.744 7.626 0.118 1
1 796 . 1 1 1 A 67 67 VAL HA H 67 3.785 3.939 -0.154 1
1 804 . 1 1 1 A 67 67 VAL C C 67 177.500 177.803 -0.303 1
1 805 . 1 1 1 A 67 67 VAL CA C 67 66.220 66.134 0.086 1
1 806 . 1 1 1 A 67 67 VAL CB C 67 31.390 31.942 -0.552 1
1 809 . 1 1 1 A 67 67 VAL N N 67 119.500 120.733 -1.233 1
1 810 . 1 1 1 A 68 68 LEU H H 68 7.983 7.884 0.099 1
1 811 . 1 1 1 A 68 68 LEU HA H 68 3.825 4.061 -0.236 1
1 821 . 1 1 1 A 68 68 LEU C C 68 179.100 178.051 1.049 1
1 822 . 1 1 1 A 68 68 LEU CA C 68 58.740 58.197 0.543 1
1 823 . 1 1 1 A 68 68 LEU CB C 68 41.090 41.971 -0.881 1
1 827 . 1 1 1 A 68 68 LEU N N 68 120.400 120.223 0.177 1
1 828 . 1 1 1 A 69 69 ASP H H 69 8.179 7.865 0.314 1
1 829 . 1 1 1 A 69 69 ASP HA H 69 4.380 4.581 -0.201 1
1 832 . 1 1 1 A 69 69 ASP C C 69 178.900 178.416 0.484 1
1 833 . 1 1 1 A 69 69 ASP CA C 69 57.320 56.131 1.189 1
1 834 . 1 1 1 A 69 69 ASP CB C 69 40.040 40.972 -0.932 1
1 835 . 1 1 1 A 69 69 ASP N N 69 119.000 118.024 0.976 1
1 836 . 1 1 1 A 70 70 GLU H H 70 8.166 8.291 -0.125 1
1 837 . 1 1 1 A 70 70 GLU HA H 70 4.082 4.252 -0.170 1
1 842 . 1 1 1 A 70 70 GLU C C 70 179.600 178.935 0.665 1
1 843 . 1 1 1 A 70 70 GLU CA C 70 59.010 58.817 0.193 1
1 844 . 1 1 1 A 70 70 GLU CB C 70 28.900 30.274 -1.374 1
1 846 . 1 1 1 A 70 70 GLU N N 70 120.500 119.160 1.340 1
1 847 . 1 1 1 A 71 71 ILE H H 71 8.415 8.188 0.227 1
1 848 . 1 1 1 A 71 71 ILE HA H 71 3.790 3.410 0.380 1
1 858 . 1 1 1 A 71 71 ILE C C 71 177.400 177.739 -0.339 1
1 859 . 1 1 1 A 71 71 ILE CA C 71 64.890 65.394 -0.504 1
1 860 . 1 1 1 A 71 71 ILE CB C 71 37.680 37.628 0.052 1
1 864 . 1 1 1 A 71 71 ILE N N 71 119.200 119.896 -0.696 1
1 865 . 1 1 1 A 72 72 LYS H H 72 8.248 7.875 0.373 1
1 866 . 1 1 1 A 72 72 LYS HA H 72 3.625 3.452 0.173 1
1 873 . 1 1 1 A 72 72 LYS C C 72 178.400 178.678 -0.278 1
1 874 . 1 1 1 A 72 72 LYS CA C 72 59.850 59.588 0.262 1
1 875 . 1 1 1 A 72 72 LYS CB C 72 32.070 32.149 -0.079 1
1 879 . 1 1 1 A 72 72 LYS N N 72 120.800 121.346 -0.546 1
1 880 . 1 1 1 A 73 73 GLN H H 73 7.937 8.179 -0.242 1
1 881 . 1 1 1 A 73 73 GLN HA H 73 4.042 3.997 0.045 1
1 888 . 1 1 1 A 73 73 GLN C C 73 178.400 178.264 0.136 1
1 889 . 1 1 1 A 73 73 GLN CA C 73 58.510 58.925 -0.415 1
1 890 . 1 1 1 A 73 73 GLN CB C 73 28.430 28.433 -0.003 1
1 892 . 1 1 1 A 73 73 GLN N N 73 117.000 117.805 -0.805 1
1 894 . 1 1 1 A 74 74 GLN H H 74 7.712 8.191 -0.479 1
1 895 . 1 1 1 A 74 74 GLN HA H 74 4.080 3.999 0.081 1
1 902 . 1 1 1 A 74 74 GLN C C 74 177.800 178.497 -0.697 1
1 903 . 1 1 1 A 74 74 GLN CA C 74 57.270 58.089 -0.819 1
1 904 . 1 1 1 A 74 74 GLN CB C 74 28.700 28.014 0.686 1
1 906 . 1 1 1 A 74 74 GLN N N 74 118.200 118.175 0.025 1
1 908 . 1 1 1 A 75 75 LEU H H 75 7.956 7.380 0.576 1
1 909 . 1 1 1 A 75 75 LEU HA H 75 4.212 4.103 0.109 1
1 919 . 1 1 1 A 75 75 LEU CA C 75 56.660 56.481 0.179 1
1 920 . 1 1 1 A 75 75 LEU CB C 75 42.000 41.370 0.630 1
1 924 . 1 1 1 A 75 75 LEU N N 75 120.700 118.350 2.350 1
1 925 . 1 1 1 A 76 76 GLN H H 76 8.315 7.372 0.943 1
1 926 . 1 1 1 A 76 76 GLN HA H 76 4.113 4.360 -0.247 1
1 933 . 1 1 1 A 76 76 GLN C C 76 177.100 174.821 2.279 1
1 934 . 1 1 1 A 76 76 GLN CA C 76 57.400 55.112 2.288 1
1 935 . 1 1 1 A 76 76 GLN CB C 76 28.640 27.934 0.706 1
1 937 . 1 1 1 A 76 76 GLN N N 76 120.100 120.132 -0.032 1
1 939 . 1 1 1 A 77 77 GLY H H 77 8.021 7.917 0.104 1
1 940 . 1 1 1 A 77 77 GLY HA2 H 77 4.042 4.156 -0.114 1
1 941 . 1 1 1 A 77 77 GLY HA3 H 77 3.869 4.159 -0.290 1
1 942 . 1 1 1 A 77 77 GLY C C 77 174.600 174.375 0.225 1
1 943 . 1 1 1 A 77 77 GLY CA C 77 45.430 44.417 1.013 1
1 944 . 1 1 1 A 77 77 GLY N N 77 107.700 112.230 -4.530 1
1 945 . 1 1 1 A 78 78 GLY H H 78 7.819 9.768 -1.949 1
1 946 . 1 1 1 A 78 78 GLY HA2 H 78 4.208 3.851 0.357 1
1 947 . 1 1 1 A 78 78 GLY HA3 H 78 3.801 3.873 -0.072 1
1 948 . 1 1 1 A 78 78 GLY C C 78 173.900 174.383 -0.483 1
1 949 . 1 1 1 A 78 78 GLY CA C 78 45.140 45.800 -0.660 1
1 950 . 1 1 1 A 78 78 GLY N N 78 107.100 108.431 -1.331 1
1 951 . 1 1 1 A 79 79 ASP H H 79 7.912 8.749 -0.837 1
1 952 . 1 1 1 A 79 79 ASP HA H 79 4.722 4.860 -0.138 1
1 955 . 1 1 1 A 79 79 ASP C C 79 176.200 176.213 -0.013 1
1 956 . 1 1 1 A 79 79 ASP CA C 79 53.210 54.071 -0.861 1
1 957 . 1 1 1 A 79 79 ASP CB C 79 40.160 41.024 -0.864 1
1 958 . 1 1 1 A 79 79 ASP N N 79 119.800 119.275 0.525 1
1 959 . 1 1 1 A 80 80 ASN H H 80 8.450 8.254 0.196 1
1 960 . 1 1 1 A 80 80 ASN HA H 80 4.593 4.457 0.136 1
1 965 . 1 1 1 A 80 80 ASN C C 80 177.300 177.144 0.156 1
1 966 . 1 1 1 A 80 80 ASN CA C 80 54.680 55.357 -0.677 1
1 967 . 1 1 1 A 80 80 ASN CB C 80 38.790 38.107 0.683 1
1 968 . 1 1 1 A 80 80 ASN N N 80 121.700 118.715 2.985 1
1 970 . 1 1 1 A 81 81 SER H H 81 8.444 7.980 0.464 1
1 971 . 1 1 1 A 81 81 SER HA H 81 4.263 3.973 0.290 1
1 974 . 1 1 1 A 81 81 SER C C 81 176.100 176.333 -0.233 1
1 975 . 1 1 1 A 81 81 SER CA C 81 61.470 61.957 -0.487 1
1 976 . 1 1 1 A 81 81 SER CB C 81 61.470 62.596 -1.126 1
1 977 . 1 1 1 A 81 81 SER N N 81 117.100 116.098 1.002 1
1 978 . 1 1 1 A 82 82 LEU H H 82 7.929 8.196 -0.267 1
1 979 . 1 1 1 A 82 82 LEU HA H 82 4.332 3.965 0.367 1
1 989 . 1 1 1 A 82 82 LEU C C 82 177.400 179.097 -1.697 1
1 990 . 1 1 1 A 82 82 LEU CA C 82 55.060 57.830 -2.770 1
1 991 . 1 1 1 A 82 82 LEU CB C 82 41.940 41.726 0.214 1
1 995 . 1 1 1 A 82 82 LEU N N 82 120.400 120.874 -0.474 1
1 996 . 1 1 1 A 83 83 HIS H H 83 8.014 8.039 -0.025 1
1 997 . 1 1 1 A 83 83 HIS HA H 83 4.173 4.106 0.067 1
1 1000 . 1 1 1 A 83 83 HIS C C 83 176.100 176.865 -0.765 1
1 1001 . 1 1 1 A 83 83 HIS CA C 83 59.940 59.795 0.145 1
1 1002 . 1 1 1 A 83 83 HIS CB C 83 28.050 30.152 -2.102 1
1 1003 . 1 1 1 A 83 83 HIS N N 83 119.400 118.551 0.849 1
1 1004 . 1 1 1 A 84 84 ASN H H 84 8.598 8.164 0.434 1
1 1005 . 1 1 1 A 84 84 ASN HA H 84 4.735 4.577 0.158 1
1 1010 . 1 1 1 A 84 84 ASN C C 84 177.400 177.267 0.133 1
1 1011 . 1 1 1 A 84 84 ASN CA C 84 55.790 55.552 0.238 1
1 1012 . 1 1 1 A 84 84 ASN CB C 84 37.520 38.766 -1.246 1
1 1013 . 1 1 1 A 84 84 ASN N N 84 118.100 116.879 1.221 1
1 1015 . 1 1 1 A 85 85 VAL H H 85 7.933 7.823 0.110 1
1 1016 . 1 1 1 A 85 85 VAL HA H 85 3.849 3.821 0.028 1
1 1024 . 1 1 1 A 85 85 VAL C C 85 177.100 177.985 -0.885 1
1 1025 . 1 1 1 A 85 85 VAL CA C 85 65.490 65.320 0.170 1
1 1026 . 1 1 1 A 85 85 VAL CB C 85 31.760 32.042 -0.282 1
1 1029 . 1 1 1 A 85 85 VAL N N 85 120.500 119.904 0.596 1
1 1030 . 1 1 1 A 86 86 HIS H H 86 8.460 9.560 -1.100 1
1 1031 . 1 1 1 A 86 86 HIS HA H 86 4.054 4.096 -0.042 1
1 1035 . 1 1 1 A 86 86 HIS C C 86 176.300 177.128 -0.828 1
1 1036 . 1 1 1 A 86 86 HIS CA C 86 59.860 59.634 0.226 1
1 1037 . 1 1 1 A 86 86 HIS CB C 86 29.670 30.200 -0.530 1
1 1038 . 1 1 1 A 86 86 HIS N N 86 119.300 119.207 0.093 1
1 1039 . 1 1 1 A 87 87 GLU H H 87 7.897 8.316 -0.419 1
1 1040 . 1 1 1 A 87 87 GLU HA H 87 3.838 3.819 0.019 1
1 1045 . 1 1 1 A 87 87 GLU C C 87 178.300 179.287 -0.987 1
1 1046 . 1 1 1 A 87 87 GLU CA C 87 58.690 59.172 -0.482 1
1 1047 . 1 1 1 A 87 87 GLU CB C 87 28.460 28.773 -0.313 1
1 1049 . 1 1 1 A 87 87 GLU N N 87 117.100 119.436 -2.336 1
1 1050 . 1 1 1 A 88 88 ASN H H 88 8.103 8.644 -0.541 1
1 1051 . 1 1 1 A 88 88 ASN HA H 88 4.503 4.451 0.052 1
1 1056 . 1 1 1 A 88 88 ASN C C 88 177.700 177.725 -0.025 1
1 1057 . 1 1 1 A 88 88 ASN CA C 88 55.990 56.159 -0.169 1
1 1058 . 1 1 1 A 88 88 ASN CB C 88 39.010 38.272 0.738 1
1 1059 . 1 1 1 A 88 88 ASN N N 88 118.400 117.287 1.113 1
1 1061 . 1 1 1 A 89 89 ILE H H 89 8.501 8.140 0.361 1
1 1062 . 1 1 1 A 89 89 ILE HA H 89 3.670 3.798 -0.128 1
1 1072 . 1 1 1 A 89 89 ILE C C 89 177.000 177.871 -0.871 1
1 1073 . 1 1 1 A 89 89 ILE CA C 89 65.390 65.430 -0.040 1
1 1074 . 1 1 1 A 89 89 ILE CB C 89 37.440 37.718 -0.278 1
1 1078 . 1 1 1 A 89 89 ILE N N 89 118.700 119.422 -0.722 1
1 1079 . 1 1 1 A 90 90 LYS H H 90 8.017 7.987 0.030 1
1 1080 . 1 1 1 A 90 90 LYS HA H 90 3.775 3.881 -0.106 1
1 1089 . 1 1 1 A 90 90 LYS C C 90 178.800 179.046 -0.246 1
1 1090 . 1 1 1 A 90 90 LYS CA C 90 60.450 59.910 0.540 1
1 1091 . 1 1 1 A 90 90 LYS CB C 90 32.110 32.304 -0.194 1
1 1095 . 1 1 1 A 90 90 LYS N N 90 120.900 120.343 0.557 1
1 1096 . 1 1 1 A 91 91 GLU H H 91 7.732 7.866 -0.134 1
1 1097 . 1 1 1 A 91 91 GLU HA H 91 4.083 4.127 -0.044 1
1 1102 . 1 1 1 A 91 91 GLU C C 91 179.100 179.223 -0.123 1
1 1103 . 1 1 1 A 91 91 GLU CA C 91 59.120 59.088 0.032 1
1 1104 . 1 1 1 A 91 91 GLU CB C 91 28.810 30.050 -1.240 1
1 1106 . 1 1 1 A 91 91 GLU N N 91 119.300 117.657 1.643 1
1 1107 . 1 1 1 A 92 92 ILE H H 92 8.110 8.928 -0.818 1
1 1108 . 1 1 1 A 92 92 ILE HA H 92 3.685 3.732 -0.047 1
1 1118 . 1 1 1 A 92 92 ILE C C 92 178.000 178.213 -0.213 1
1 1119 . 1 1 1 A 92 92 ILE CA C 92 65.900 65.771 0.129 1
1 1120 . 1 1 1 A 92 92 ILE CB C 92 38.400 38.263 0.137 1
1 1124 . 1 1 1 A 92 92 ILE N N 92 121.100 121.053 0.047 1
1 1125 . 1 1 1 A 93 93 PHE H H 93 8.651 9.154 -0.503 1
1 1126 . 1 1 1 A 93 93 PHE HA H 93 3.873 3.198 0.675 1
1 1133 . 1 1 1 A 93 93 PHE C C 93 177.100 177.908 -0.808 1
1 1134 . 1 1 1 A 93 93 PHE CA C 93 61.020 61.049 -0.029 1
1 1135 . 1 1 1 A 93 93 PHE CB C 93 38.560 38.029 0.531 1
1 1138 . 1 1 1 A 93 93 PHE N N 93 119.400 121.130 -1.730 1
1 1139 . 1 1 1 A 94 94 HIS H H 94 8.126 7.762 0.364 1
1 1140 . 1 1 1 A 94 94 HIS HA H 94 4.368 4.014 0.354 1
1 1145 . 1 1 1 A 94 94 HIS C C 94 177.100 176.959 0.141 1
1 1146 . 1 1 1 A 94 94 HIS CA C 94 58.310 58.423 -0.113 1
1 1147 . 1 1 1 A 94 94 HIS CB C 94 27.910 28.883 -0.973 1
1 1148 . 1 1 1 A 94 94 HIS N N 94 116.400 115.740 0.660 1
1 1149 . 1 1 1 A 95 95 HIS H H 95 8.058 7.987 0.071 1
1 1150 . 1 1 1 A 95 95 HIS HA H 95 4.465 4.328 0.137 1
1 1154 . 1 1 1 A 95 95 HIS C C 95 177.300 177.651 -0.351 1
1 1155 . 1 1 1 A 95 95 HIS CA C 95 57.900 59.417 -1.517 1
1 1156 . 1 1 1 A 95 95 HIS CB C 95 28.490 30.736 -2.246 1
1 1157 . 1 1 1 A 95 95 HIS N N 95 117.000 118.537 -1.537 1
1 1158 . 1 1 1 A 96 96 LEU H H 96 8.525 8.031 0.494 1
1 1159 . 1 1 1 A 96 96 LEU HA H 96 3.865 3.789 0.076 1
1 1169 . 1 1 1 A 96 96 LEU C C 96 178.300 178.748 -0.448 1
1 1170 . 1 1 1 A 96 96 LEU CA C 96 58.250 58.384 -0.134 1
1 1171 . 1 1 1 A 96 96 LEU CB C 96 41.720 42.010 -0.290 1
1 1175 . 1 1 1 A 96 96 LEU N N 96 121.300 120.692 0.608 1
1 1176 . 1 1 1 A 97 97 GLU H H 97 8.076 8.309 -0.233 1
1 1177 . 1 1 1 A 97 97 GLU HA H 97 3.719 3.795 -0.076 1
1 1182 . 1 1 1 A 97 97 GLU C C 97 178.300 177.693 0.607 1
1 1183 . 1 1 1 A 97 97 GLU CA C 97 59.300 58.816 0.484 1
1 1184 . 1 1 1 A 97 97 GLU CB C 97 28.960 28.957 0.003 1
1 1186 . 1 1 1 A 97 97 GLU N N 97 117.100 117.219 -0.119 1
1 1187 . 1 1 1 A 98 98 GLU H H 98 7.329 7.810 -0.481 1
1 1188 . 1 1 1 A 98 98 GLU HA H 98 4.024 4.109 -0.085 1
1 1193 . 1 1 1 A 98 98 GLU C C 98 177.900 178.498 -0.598 1
1 1194 . 1 1 1 A 98 98 GLU CA C 98 58.190 58.697 -0.507 1
1 1195 . 1 1 1 A 98 98 GLU CB C 98 29.120 29.560 -0.440 1
1 1197 . 1 1 1 A 98 98 GLU N N 98 116.000 118.770 -2.770 1
1 1198 . 1 1 1 A 99 99 LEU H H 99 7.535 8.400 -0.865 1
1 1199 . 1 1 1 A 99 99 LEU HA H 99 4.183 4.185 -0.002 1
1 1209 . 1 1 1 A 99 99 LEU C C 99 178.100 177.625 0.475 1
1 1210 . 1 1 1 A 99 99 LEU CA C 99 56.440 56.508 -0.068 1
1 1211 . 1 1 1 A 99 99 LEU CB C 99 43.010 41.539 1.471 1
1 1215 . 1 1 1 A 99 99 LEU N N 99 118.200 119.792 -1.592 1
1 1216 . 1 1 1 A 100 100 VAL H H 100 7.561 6.713 0.848 1
1 1217 . 1 1 1 A 100 100 VAL HA H 100 4.033 4.584 -0.551 1
1 1225 . 1 1 1 A 100 100 VAL C C 100 175.400 177.330 -1.930 1
1 1226 . 1 1 1 A 100 100 VAL CA C 100 62.430 62.157 0.273 1
1 1227 . 1 1 1 A 100 100 VAL CB C 100 32.050 33.455 -1.405 1
1 1230 . 1 1 1 A 100 100 VAL N N 100 114.800 111.061 3.739 1
1 1231 . 1 1 1 A 101 101 HIS H H 101 7.827 7.887 -0.060 1
1 1232 . 1 1 1 A 101 101 HIS HA H 101 4.630 4.686 -0.056 1
1 1237 . 1 1 1 A 101 101 HIS C C 101 173.500 176.306 -2.806 1
1 1238 . 1 1 1 A 101 101 HIS CA C 101 55.410 57.190 -1.780 1
1 1239 . 1 1 1 A 101 101 HIS CB C 101 28.870 28.743 0.127 1
1 1240 . 1 1 1 A 101 101 HIS N N 101 120.300 119.961 0.339 1
1 10 . 2 1 1 A 2 2 TYR H H 2 8.688 7.405 1.283 1
1 11 . 2 1 1 A 2 2 TYR HA H 2 4.737 4.249 0.488 1
1 16 . 2 1 1 A 2 2 TYR C C 2 175.900 176.333 -0.433 1
1 17 . 2 1 1 A 2 2 TYR CA C 2 57.920 60.362 -2.442 1
1 18 . 2 1 1 A 2 2 TYR CB C 2 38.340 38.636 -0.296 1
1 19 . 2 1 1 A 2 2 TYR N N 2 122.100 120.717 1.383 1
1 20 . 2 1 1 A 3 3 GLY H H 3 8.434 8.249 0.185 1
1 21 . 2 1 1 A 3 3 GLY HA2 H 3 3.909 4.010 -0.101 1
1 22 . 2 1 1 A 3 3 GLY HA3 H 3 3.841 4.045 -0.204 1
1 23 . 2 1 1 A 3 3 GLY C C 3 174.300 175.657 -1.357 1
1 24 . 2 1 1 A 3 3 GLY CA C 3 46.050 45.527 0.523 1
1 25 . 2 1 1 A 3 3 GLY N N 3 111.100 108.154 2.946 1
1 26 . 2 1 1 A 4 4 LYS H H 4 8.060 8.484 -0.424 1
1 27 . 2 1 1 A 4 4 LYS HA H 4 4.297 4.181 0.116 1
1 36 . 2 1 1 A 4 4 LYS C C 4 178.000 179.008 -1.008 1
1 37 . 2 1 1 A 4 4 LYS CA C 4 56.930 59.344 -2.414 1
1 38 . 2 1 1 A 4 4 LYS CB C 4 32.680 31.925 0.755 1
1 42 . 2 1 1 A 4 4 LYS N N 4 119.500 121.415 -1.915 1
1 43 . 2 1 1 A 5 5 LEU H H 5 8.243 8.174 0.069 1
1 44 . 2 1 1 A 5 5 LEU HA H 5 3.947 3.853 0.094 1
1 54 . 2 1 1 A 5 5 LEU C C 5 177.900 178.849 -0.949 1
1 55 . 2 1 1 A 5 5 LEU CA C 5 57.930 57.910 0.020 1
1 56 . 2 1 1 A 5 5 LEU CB C 5 41.620 41.553 0.067 1
1 60 . 2 1 1 A 5 5 LEU N N 5 120.800 120.489 0.311 1
1 61 . 2 1 1 A 6 6 ASN H H 6 8.256 8.378 -0.122 1
1 62 . 2 1 1 A 6 6 ASN HA H 6 4.252 4.428 -0.176 1
1 67 . 2 1 1 A 6 6 ASN C C 6 177.300 177.406 -0.106 1
1 68 . 2 1 1 A 6 6 ASN CA C 6 56.900 55.987 0.913 1
1 69 . 2 1 1 A 6 6 ASN CB C 6 38.200 38.086 0.114 1
1 70 . 2 1 1 A 6 6 ASN N N 6 116.200 118.024 -1.824 1
1 72 . 2 1 1 A 7 7 ASP H H 7 7.699 9.398 -1.699 1
1 73 . 2 1 1 A 7 7 ASP HA H 7 4.320 4.383 -0.063 1
1 76 . 2 1 1 A 7 7 ASP C C 7 178.000 178.303 -0.303 1
1 77 . 2 1 1 A 7 7 ASP CA C 7 56.980 57.379 -0.399 1
1 78 . 2 1 1 A 7 7 ASP CB C 7 39.870 41.780 -1.910 1
1 79 . 2 1 1 A 7 7 ASP N N 7 119.100 119.779 -0.679 1
1 80 . 2 1 1 A 8 8 LEU H H 8 7.580 8.538 -0.958 1
1 81 . 2 1 1 A 8 8 LEU HA H 8 4.091 4.139 -0.048 1
1 91 . 2 1 1 A 8 8 LEU C C 8 178.800 178.928 -0.128 1
1 92 . 2 1 1 A 8 8 LEU CA C 8 57.790 57.730 0.060 1
1 93 . 2 1 1 A 8 8 LEU CB C 8 41.880 41.559 0.321 1
1 97 . 2 1 1 A 8 8 LEU N N 8 120.400 119.454 0.946 1
1 98 . 2 1 1 A 9 9 LEU H H 9 8.125 8.994 -0.869 1
1 99 . 2 1 1 A 9 9 LEU HA H 9 3.891 3.988 -0.097 1
1 109 . 2 1 1 A 9 9 LEU C C 9 178.900 178.522 0.378 1
1 110 . 2 1 1 A 9 9 LEU CA C 9 58.350 58.655 -0.305 1
1 111 . 2 1 1 A 9 9 LEU CB C 9 41.510 41.897 -0.387 1
1 115 . 2 1 1 A 9 9 LEU N N 9 118.900 120.059 -1.159 1
1 116 . 2 1 1 A 10 10 GLU H H 10 8.011 8.538 -0.527 1
1 117 . 2 1 1 A 10 10 GLU HA H 10 4.072 3.949 0.123 1
1 122 . 2 1 1 A 10 10 GLU C C 10 179.000 179.012 -0.012 1
1 123 . 2 1 1 A 10 10 GLU CA C 10 59.090 59.718 -0.628 1
1 124 . 2 1 1 A 10 10 GLU CB C 10 27.910 29.140 -1.230 1
1 126 . 2 1 1 A 10 10 GLU N N 10 119.300 117.966 1.334 1
1 127 . 2 1 1 A 11 11 ASP H H 11 8.128 7.914 0.214 1
1 128 . 2 1 1 A 11 11 ASP HA H 11 4.383 4.286 0.097 1
1 131 . 2 1 1 A 11 11 ASP C C 11 178.500 178.874 -0.374 1
1 132 . 2 1 1 A 11 11 ASP CA C 11 56.580 57.303 -0.723 1
1 133 . 2 1 1 A 11 11 ASP CB C 11 38.600 40.427 -1.827 1
1 134 . 2 1 1 A 11 11 ASP N N 11 119.600 120.508 -0.908 1
1 135 . 2 1 1 A 12 12 LEU H H 12 8.394 8.498 -0.104 1
1 136 . 2 1 1 A 12 12 LEU HA H 12 3.923 4.136 -0.213 1
1 146 . 2 1 1 A 12 12 LEU C C 12 178.200 178.465 -0.265 1
1 147 . 2 1 1 A 12 12 LEU CA C 12 57.880 58.458 -0.578 1
1 148 . 2 1 1 A 12 12 LEU CB C 12 41.850 41.660 0.190 1
1 152 . 2 1 1 A 12 12 LEU N N 12 120.500 121.432 -0.932 1
1 153 . 2 1 1 A 13 13 GLN H H 13 8.371 8.668 -0.297 1
1 154 . 2 1 1 A 13 13 GLN HA H 13 3.879 4.080 -0.201 1
1 161 . 2 1 1 A 13 13 GLN C C 13 178.600 177.755 0.845 1
1 162 . 2 1 1 A 13 13 GLN CA C 13 59.570 57.987 1.583 1
1 163 . 2 1 1 A 13 13 GLN CB C 13 28.440 27.347 1.093 1
1 165 . 2 1 1 A 13 13 GLN N N 13 118.400 117.770 0.630 1
1 167 . 2 1 1 A 14 14 GLU H H 14 7.913 8.236 -0.323 1
1 168 . 2 1 1 A 14 14 GLU HA H 14 4.021 4.144 -0.123 1
1 173 . 2 1 1 A 14 14 GLU C C 14 179.000 178.973 0.027 1
1 174 . 2 1 1 A 14 14 GLU CA C 14 59.030 58.796 0.234 1
1 175 . 2 1 1 A 14 14 GLU CB C 14 28.720 29.749 -1.029 1
1 177 . 2 1 1 A 14 14 GLU N N 14 119.100 120.538 -1.438 1
1 178 . 2 1 1 A 15 15 VAL H H 15 7.991 8.115 -0.124 1
1 179 . 2 1 1 A 15 15 VAL HA H 15 3.696 3.948 -0.252 1
1 187 . 2 1 1 A 15 15 VAL C C 15 178.300 177.919 0.381 1
1 188 . 2 1 1 A 15 15 VAL CA C 15 66.640 65.559 1.081 1
1 189 . 2 1 1 A 15 15 VAL CB C 15 31.470 31.418 0.052 1
1 192 . 2 1 1 A 15 15 VAL N N 15 120.300 119.081 1.219 1
1 193 . 2 1 1 A 16 16 LEU H H 16 8.172 7.535 0.637 1
1 194 . 2 1 1 A 16 16 LEU HA H 16 3.876 4.229 -0.353 1
1 204 . 2 1 1 A 16 16 LEU C C 16 178.400 178.342 0.058 1
1 205 . 2 1 1 A 16 16 LEU CA C 16 58.050 57.232 0.818 1
1 206 . 2 1 1 A 16 16 LEU CB C 16 41.420 42.056 -0.636 1
1 210 . 2 1 1 A 16 16 LEU N N 16 119.700 124.179 -4.479 1
1 211 . 2 1 1 A 17 17 LYS H H 17 7.755 8.793 -1.038 1
1 212 . 2 1 1 A 17 17 LYS HA H 17 3.951 4.042 -0.091 1
1 221 . 2 1 1 A 17 17 LYS C C 17 178.800 178.217 0.583 1
1 222 . 2 1 1 A 17 17 LYS CA C 17 59.470 58.869 0.601 1
1 223 . 2 1 1 A 17 17 LYS CB C 17 32.350 32.426 -0.076 1
1 227 . 2 1 1 A 17 17 LYS N N 17 117.800 119.721 -1.921 1
1 228 . 2 1 1 A 18 18 HIS H H 18 7.847 8.175 -0.328 1
1 229 . 2 1 1 A 18 18 HIS HA H 18 4.549 4.635 -0.086 1
1 233 . 2 1 1 A 18 18 HIS C C 18 177.200 176.107 1.093 1
1 234 . 2 1 1 A 18 18 HIS CA C 18 57.870 55.868 2.002 1
1 235 . 2 1 1 A 18 18 HIS CB C 18 28.730 29.494 -0.764 1
1 236 . 2 1 1 A 18 18 HIS N N 18 116.200 116.384 -0.184 1
1 237 . 2 1 1 A 19 19 VAL H H 19 8.415 7.903 0.512 1
1 238 . 2 1 1 A 19 19 VAL HA H 19 3.746 4.156 -0.410 1
1 246 . 2 1 1 A 19 19 VAL CA C 19 65.850 64.350 1.500 1
1 247 . 2 1 1 A 19 19 VAL CB C 19 31.600 32.616 -1.016 1
1 250 . 2 1 1 A 20 20 ASN H H 20 8.041 8.407 -0.366 1
1 251 . 2 1 1 A 20 20 ASN HA H 20 4.545 4.521 0.024 1
1 256 . 2 1 1 A 20 20 ASN C C 20 176.900 177.280 -0.380 1
1 257 . 2 1 1 A 20 20 ASN CA C 20 55.070 56.518 -1.448 1
1 258 . 2 1 1 A 20 20 ASN CB C 20 38.270 38.276 -0.006 1
1 259 . 2 1 1 A 20 20 ASN N N 20 117.900 119.210 -1.310 1
1 261 . 2 1 1 A 21 21 GLN H H 21 7.887 8.151 -0.264 1
1 262 . 2 1 1 A 21 21 GLN HA H 21 4.096 4.391 -0.295 1
1 269 . 2 1 1 A 21 21 GLN C C 21 176.900 177.309 -0.409 1
1 270 . 2 1 1 A 21 21 GLN CA C 21 57.510 57.342 0.168 1
1 271 . 2 1 1 A 21 21 GLN CB C 21 29.100 29.862 -0.762 1
1 273 . 2 1 1 A 21 21 GLN N N 21 117.900 116.772 1.128 1
1 275 . 2 1 1 A 22 22 HIS H H 22 7.887 8.429 -0.542 1
1 276 . 2 1 1 A 22 22 HIS HA H 22 4.679 4.852 -0.173 1
1 280 . 2 1 1 A 22 22 HIS C C 22 174.300 175.136 -0.836 1
1 281 . 2 1 1 A 22 22 HIS CA C 22 55.770 55.428 0.342 1
1 282 . 2 1 1 A 22 22 HIS CB C 22 28.630 29.398 -0.768 1
1 283 . 2 1 1 A 22 22 HIS N N 22 116.100 113.036 3.064 1
1 284 . 2 1 1 A 23 23 TRP H H 23 7.929 7.853 0.076 1
1 285 . 2 1 1 A 23 23 TRP HA H 23 4.542 4.749 -0.207 1
1 292 . 2 1 1 A 23 23 TRP C C 23 176.600 175.292 1.308 1
1 293 . 2 1 1 A 23 23 TRP CA C 23 58.020 58.387 -0.367 1
1 294 . 2 1 1 A 23 23 TRP CB C 23 29.700 30.619 -0.919 1
1 295 . 2 1 1 A 23 23 TRP N N 23 122.000 123.918 -1.918 1
1 297 . 2 1 1 A 24 24 GLN H H 24 8.258 8.286 -0.028 1
1 298 . 2 1 1 A 24 24 GLN HA H 24 4.329 4.835 -0.506 1
1 305 . 2 1 1 A 24 24 GLN C C 24 176.200 175.226 0.974 1
1 306 . 2 1 1 A 24 24 GLN CA C 24 55.960 54.774 1.186 1
1 307 . 2 1 1 A 24 24 GLN CB C 24 29.440 32.028 -2.588 1
1 309 . 2 1 1 A 24 24 GLN N N 24 123.800 125.796 -1.996 1
1 311 . 2 1 1 A 25 25 GLY H H 25 7.470 8.876 -1.406 1
1 312 . 2 1 1 A 25 25 GLY HA2 H 25 3.939 3.888 0.051 1
1 313 . 2 1 1 A 25 25 GLY HA3 H 25 3.800 3.900 -0.100 1
1 314 . 2 1 1 A 25 25 GLY C C 25 174.800 175.206 -0.406 1
1 315 . 2 1 1 A 25 25 GLY CA C 25 45.470 46.797 -1.327 1
1 316 . 2 1 1 A 25 25 GLY N N 25 108.100 110.041 -1.941 1
1 317 . 2 1 1 A 26 26 GLY H H 26 8.332 8.790 -0.458 1
1 318 . 2 1 1 A 26 26 GLY HA2 H 26 4.105 4.117 -0.012 1
1 319 . 2 1 1 A 26 26 GLY HA3 H 26 3.974 4.146 -0.172 1
1 320 . 2 1 1 A 26 26 GLY C C 26 174.900 174.943 -0.043 1
1 321 . 2 1 1 A 26 26 GLY CA C 26 45.410 45.504 -0.094 1
1 322 . 2 1 1 A 26 26 GLY N N 26 108.700 106.649 2.051 1
1 323 . 2 1 1 A 27 27 GLN H H 27 8.474 8.593 -0.119 1
1 324 . 2 1 1 A 27 27 GLN HA H 27 4.106 4.242 -0.136 1
1 331 . 2 1 1 A 27 27 GLN C C 27 177.100 176.462 0.638 1
1 332 . 2 1 1 A 27 27 GLN CA C 27 57.540 56.565 0.975 1
1 333 . 2 1 1 A 27 27 GLN CB C 27 29.050 28.535 0.515 1
1 335 . 2 1 1 A 27 27 GLN N N 27 121.100 122.258 -1.158 1
1 337 . 2 1 1 A 28 28 LYS H H 28 8.448 8.481 -0.033 1
1 338 . 2 1 1 A 28 28 LYS HA H 28 4.068 4.035 0.033 1
1 347 . 2 1 1 A 28 28 LYS C C 28 177.900 178.505 -0.605 1
1 348 . 2 1 1 A 28 28 LYS CA C 28 58.410 58.848 -0.438 1
1 349 . 2 1 1 A 28 28 LYS CB C 28 32.210 32.414 -0.204 1
1 353 . 2 1 1 A 28 28 LYS N N 28 120.500 118.226 2.274 1
1 354 . 2 1 1 A 29 29 ASN H H 29 8.273 7.524 0.749 1
1 355 . 2 1 1 A 29 29 ASN HA H 29 4.584 4.397 0.187 1
1 360 . 2 1 1 A 29 29 ASN C C 29 176.200 177.359 -1.159 1
1 361 . 2 1 1 A 29 29 ASN CA C 29 54.400 55.900 -1.500 1
1 362 . 2 1 1 A 29 29 ASN CB C 29 38.280 38.374 -0.094 1
1 363 . 2 1 1 A 29 29 ASN N N 29 117.500 118.090 -0.590 1
1 365 . 2 1 1 A 30 30 MET H H 30 7.870 7.561 0.309 1
1 366 . 2 1 1 A 30 30 MET HA H 30 4.085 3.099 0.986 1
1 371 . 2 1 1 A 30 30 MET C C 30 177.000 177.565 -0.565 1
1 372 . 2 1 1 A 30 30 MET CA C 30 56.880 57.990 -1.110 1
1 373 . 2 1 1 A 30 30 MET CB C 30 32.340 31.763 0.577 1
1 375 . 2 1 1 A 30 30 MET N N 30 121.100 118.606 2.494 1
1 376 . 2 1 1 A 31 31 ASN H H 31 8.186 7.518 0.668 1
1 377 . 2 1 1 A 31 31 ASN HA H 31 4.311 4.510 -0.199 1
1 382 . 2 1 1 A 31 31 ASN C C 31 176.700 177.691 -0.991 1
1 383 . 2 1 1 A 31 31 ASN CA C 31 55.320 55.360 -0.040 1
1 384 . 2 1 1 A 31 31 ASN CB C 31 38.410 38.675 -0.265 1
1 385 . 2 1 1 A 31 31 ASN N N 31 117.900 115.838 2.062 1
1 387 . 2 1 1 A 32 32 LYS H H 32 7.792 7.099 0.693 1
1 388 . 2 1 1 A 32 32 LYS HA H 32 3.992 4.026 -0.034 1
1 397 . 2 1 1 A 32 32 LYS C C 32 177.900 179.050 -1.150 1
1 398 . 2 1 1 A 32 32 LYS CA C 32 59.050 59.249 -0.199 1
1 399 . 2 1 1 A 32 32 LYS CB C 32 32.460 32.426 0.034 1
1 403 . 2 1 1 A 32 32 LYS N N 32 120.400 118.679 1.721 1
1 404 . 2 1 1 A 33 33 VAL H H 33 7.689 8.395 -0.706 1
1 405 . 2 1 1 A 33 33 VAL HA H 33 3.791 3.536 0.255 1
1 413 . 2 1 1 A 33 33 VAL C C 33 177.100 177.733 -0.633 1
1 414 . 2 1 1 A 33 33 VAL CA C 33 65.360 64.752 0.608 1
1 415 . 2 1 1 A 33 33 VAL CB C 33 31.920 31.540 0.380 1
1 418 . 2 1 1 A 33 33 VAL N N 33 120.200 115.746 4.454 1
1 419 . 2 1 1 A 34 34 ASP H H 34 8.408 8.016 0.392 1
1 420 . 2 1 1 A 34 34 ASP HA H 34 4.303 4.289 0.014 1
1 423 . 2 1 1 A 34 34 ASP C C 34 178.200 178.299 -0.099 1
1 424 . 2 1 1 A 34 34 ASP CA C 34 55.880 57.111 -1.231 1
1 425 . 2 1 1 A 34 34 ASP CB C 34 38.710 40.980 -2.270 1
1 426 . 2 1 1 A 34 34 ASP N N 34 120.100 121.762 -1.662 1
1 427 . 2 1 1 A 35 35 HIS H H 35 8.204 7.555 0.649 1
1 428 . 2 1 1 A 35 35 HIS HA H 35 4.343 4.329 0.014 1
1 431 . 2 1 1 A 35 35 HIS C C 35 176.800 177.259 -0.459 1
1 432 . 2 1 1 A 35 35 HIS CA C 35 58.310 58.998 -0.688 1
1 433 . 2 1 1 A 35 35 HIS CB C 35 28.070 29.768 -1.698 1
1 434 . 2 1 1 A 35 35 HIS N N 35 118.200 119.009 -0.809 1
1 435 . 2 1 1 A 36 36 HIS H H 36 8.067 8.490 -0.423 1
1 436 . 2 1 1 A 36 36 HIS HA H 36 4.602 4.505 0.097 1
1 440 . 2 1 1 A 36 36 HIS C C 36 177.100 177.607 -0.507 1
1 441 . 2 1 1 A 36 36 HIS CA C 36 58.520 59.524 -1.004 1
1 442 . 2 1 1 A 36 36 HIS CB C 36 28.720 30.117 -1.397 1
1 443 . 2 1 1 A 36 36 HIS N N 36 117.100 117.696 -0.596 1
1 444 . 2 1 1 A 37 37 LEU H H 37 8.473 8.181 0.292 1
1 445 . 2 1 1 A 37 37 LEU HA H 37 3.894 3.761 0.133 1
1 455 . 2 1 1 A 37 37 LEU C C 37 178.200 178.796 -0.596 1
1 456 . 2 1 1 A 37 37 LEU CA C 37 58.520 57.842 0.678 1
1 457 . 2 1 1 A 37 37 LEU CB C 37 41.810 41.391 0.419 1
1 461 . 2 1 1 A 37 37 LEU N N 37 119.600 119.616 -0.016 1
1 462 . 2 1 1 A 38 38 GLN H H 38 8.337 8.048 0.289 1
1 463 . 2 1 1 A 38 38 GLN HA H 38 3.882 3.872 0.010 1
1 470 . 2 1 1 A 38 38 GLN C C 38 178.500 178.286 0.214 1
1 471 . 2 1 1 A 38 38 GLN CA C 38 59.200 59.287 -0.087 1
1 472 . 2 1 1 A 38 38 GLN CB C 38 27.850 28.231 -0.381 1
1 474 . 2 1 1 A 38 38 GLN N N 38 118.000 116.800 1.200 1
1 476 . 2 1 1 A 39 39 ASN H H 39 7.923 7.395 0.528 1
1 477 . 2 1 1 A 39 39 ASN HA H 39 4.390 4.665 -0.275 1
1 482 . 2 1 1 A 39 39 ASN C C 39 177.500 178.032 -0.532 1
1 483 . 2 1 1 A 39 39 ASN CA C 39 55.780 56.170 -0.390 1
1 484 . 2 1 1 A 39 39 ASN CB C 39 37.450 38.348 -0.898 1
1 485 . 2 1 1 A 39 39 ASN N N 39 118.700 117.708 0.992 1
1 487 . 2 1 1 A 40 40 VAL H H 40 7.907 7.959 -0.052 1
1 488 . 2 1 1 A 40 40 VAL HA H 40 3.629 3.498 0.131 1
1 496 . 2 1 1 A 40 40 VAL C C 40 177.500 177.850 -0.350 1
1 497 . 2 1 1 A 40 40 VAL CA C 40 67.080 66.618 0.462 1
1 498 . 2 1 1 A 40 40 VAL CB C 40 31.390 31.335 0.055 1
1 501 . 2 1 1 A 40 40 VAL N N 40 120.400 119.972 0.428 1
1 502 . 2 1 1 A 41 41 ILE H H 41 8.103 7.899 0.204 1
1 503 . 2 1 1 A 41 41 ILE HA H 41 3.401 3.760 -0.359 1
1 513 . 2 1 1 A 41 41 ILE C C 41 178.000 178.175 -0.175 1
1 514 . 2 1 1 A 41 41 ILE CA C 41 66.430 64.453 1.977 1
1 515 . 2 1 1 A 41 41 ILE CB C 41 38.050 37.761 0.289 1
1 519 . 2 1 1 A 41 41 ILE N N 41 120.600 118.696 1.904 1
1 520 . 2 1 1 A 42 42 GLU H H 42 8.150 7.975 0.175 1
1 521 . 2 1 1 A 42 42 GLU HA H 42 4.062 4.341 -0.279 1
1 526 . 2 1 1 A 42 42 GLU C C 42 178.500 178.386 0.114 1
1 527 . 2 1 1 A 42 42 GLU CA C 42 59.120 59.521 -0.401 1
1 528 . 2 1 1 A 42 42 GLU CB C 42 28.160 29.216 -1.056 1
1 530 . 2 1 1 A 42 42 GLU N N 42 119.900 121.591 -1.691 1
1 531 . 2 1 1 A 43 43 ASP H H 43 8.453 8.987 -0.534 1
1 532 . 2 1 1 A 43 43 ASP HA H 43 4.445 4.470 -0.025 1
1 535 . 2 1 1 A 43 43 ASP C C 43 178.400 178.096 0.304 1
1 536 . 2 1 1 A 43 43 ASP CA C 43 56.490 55.861 0.629 1
1 537 . 2 1 1 A 43 43 ASP CB C 43 37.820 40.823 -3.003 1
1 538 . 2 1 1 A 43 43 ASP N N 43 119.700 119.942 -0.242 1
1 539 . 2 1 1 A 44 44 ILE H H 44 8.544 7.243 1.301 1
1 540 . 2 1 1 A 44 44 ILE HA H 44 3.590 4.031 -0.441 1
1 550 . 2 1 1 A 44 44 ILE C C 44 177.800 178.131 -0.331 1
1 551 . 2 1 1 A 44 44 ILE CA C 44 66.320 64.068 2.252 1
1 552 . 2 1 1 A 44 44 ILE CB C 44 37.690 38.177 -0.487 1
1 556 . 2 1 1 A 44 44 ILE N N 44 121.500 118.440 3.060 1
1 557 . 2 1 1 A 45 45 HIS H H 45 8.261 7.704 0.557 1
1 558 . 2 1 1 A 45 45 HIS HA H 45 4.255 4.333 -0.078 1
1 562 . 2 1 1 A 45 45 HIS C C 45 177.200 176.406 0.794 1
1 563 . 2 1 1 A 45 45 HIS CA C 45 59.580 58.835 0.745 1
1 564 . 2 1 1 A 45 45 HIS CB C 45 27.790 29.095 -1.305 1
1 565 . 2 1 1 A 45 45 HIS N N 45 118.800 119.604 -0.804 1
1 566 . 2 1 1 A 46 46 ASP H H 46 8.680 7.257 1.423 1
1 567 . 2 1 1 A 46 46 ASP HA H 46 4.338 4.036 0.302 1
1 570 . 2 1 1 A 46 46 ASP C C 46 178.700 177.771 0.929 1
1 571 . 2 1 1 A 46 46 ASP CA C 46 57.010 55.118 1.892 1
1 572 . 2 1 1 A 46 46 ASP CB C 46 39.400 40.455 -1.055 1
1 573 . 2 1 1 A 46 46 ASP N N 46 119.200 120.348 -1.148 1
1 574 . 2 1 1 A 47 47 PHE H H 47 8.380 9.251 -0.871 1
1 575 . 2 1 1 A 47 47 PHE HA H 47 4.070 4.156 -0.086 1
1 580 . 2 1 1 A 47 47 PHE C C 47 178.600 177.549 1.051 1
1 581 . 2 1 1 A 47 47 PHE CA C 47 61.250 60.112 1.138 1
1 582 . 2 1 1 A 47 47 PHE CB C 47 39.570 39.684 -0.114 1
1 583 . 2 1 1 A 47 47 PHE N N 47 121.800 120.737 1.063 1
1 584 . 2 1 1 A 48 48 MET H H 48 8.366 8.081 0.285 1
1 585 . 2 1 1 A 48 48 MET HA H 48 3.998 4.682 -0.684 1
1 590 . 2 1 1 A 48 48 MET C C 48 177.400 176.996 0.404 1
1 591 . 2 1 1 A 48 48 MET CA C 48 58.470 56.670 1.800 1
1 592 . 2 1 1 A 48 48 MET CB C 48 33.170 32.199 0.971 1
1 594 . 2 1 1 A 48 48 MET N N 48 117.700 116.838 0.862 1
1 595 . 2 1 1 A 49 49 GLN H H 49 7.659 8.141 -0.482 1
1 596 . 2 1 1 A 49 49 GLN HA H 49 4.258 4.587 -0.329 1
1 603 . 2 1 1 A 49 49 GLN C C 49 176.700 177.636 -0.936 1
1 604 . 2 1 1 A 49 49 GLN CA C 49 56.380 56.177 0.203 1
1 605 . 2 1 1 A 49 49 GLN CB C 49 28.980 30.695 -1.715 1
1 607 . 2 1 1 A 49 49 GLN N N 49 116.700 116.556 0.144 1
1 609 . 2 1 1 A 50 50 GLY H H 50 7.685 9.061 -1.376 1
1 610 . 2 1 1 A 50 50 GLY HA2 H 50 3.998 3.879 0.119 1
1 611 . 2 1 1 A 50 50 GLY HA3 H 50 3.998 3.908 0.090 1
1 612 . 2 1 1 A 50 50 GLY C C 50 174.900 174.992 -0.092 1
1 613 . 2 1 1 A 50 50 GLY CA C 50 45.460 45.556 -0.096 1
1 614 . 2 1 1 A 50 50 GLY N N 50 106.400 108.200 -1.800 1
1 615 . 2 1 1 A 51 51 GLY H H 51 8.031 9.181 -1.150 1
1 616 . 2 1 1 A 51 51 GLY HA2 H 51 3.817 3.899 -0.082 1
1 617 . 2 1 1 A 51 51 GLY HA3 H 51 3.817 3.931 -0.114 1
1 618 . 2 1 1 A 51 51 GLY C C 51 174.500 175.041 -0.541 1
1 619 . 2 1 1 A 51 51 GLY CA C 51 45.190 45.331 -0.141 1
1 620 . 2 1 1 A 51 51 GLY N N 51 108.900 108.433 0.467 1
1 621 . 2 1 1 A 52 52 GLY H H 52 8.126 8.232 -0.106 1
1 622 . 2 1 1 A 52 52 GLY HA2 H 52 3.362 2.430 0.932 1
1 623 . 2 1 1 A 52 52 GLY HA3 H 52 3.362 3.248 0.114 1
1 624 . 2 1 1 A 52 52 GLY C C 52 173.300 174.354 -1.054 1
1 625 . 2 1 1 A 52 52 GLY CA C 52 45.120 44.327 0.793 1
1 626 . 2 1 1 A 52 52 GLY N N 52 108.100 107.901 0.199 1
1 627 . 2 1 1 A 53 53 SER H H 53 7.594 7.906 -0.312 1
1 628 . 2 1 1 A 53 53 SER HA H 53 4.530 4.322 0.208 1
1 631 . 2 1 1 A 53 53 SER C C 53 175.300 176.507 -1.207 1
1 632 . 2 1 1 A 53 53 SER CA C 53 57.770 59.653 -1.883 1
1 633 . 2 1 1 A 53 53 SER CB C 53 64.750 63.841 0.909 1
1 634 . 2 1 1 A 53 53 SER N N 53 114.100 116.363 -2.263 1
1 635 . 2 1 1 A 54 54 GLY H H 54 9.003 8.788 0.215 1
1 636 . 2 1 1 A 54 54 GLY HA2 H 54 4.037 3.845 0.192 1
1 637 . 2 1 1 A 54 54 GLY HA3 H 54 3.911 3.884 0.027 1
1 638 . 2 1 1 A 54 54 GLY C C 54 176.500 175.549 0.951 1
1 639 . 2 1 1 A 54 54 GLY CA C 54 47.040 47.264 -0.224 1
1 640 . 2 1 1 A 54 54 GLY N N 54 110.400 112.543 -2.143 1
1 641 . 2 1 1 A 55 55 GLY H H 55 8.617 8.415 0.202 1
1 642 . 2 1 1 A 55 55 GLY HA2 H 55 3.946 3.887 0.059 1
1 643 . 2 1 1 A 55 55 GLY HA3 H 55 3.946 3.895 0.051 1
1 644 . 2 1 1 A 55 55 GLY C C 55 176.400 175.308 1.092 1
1 645 . 2 1 1 A 55 55 GLY CA C 55 46.630 46.217 0.413 1
1 646 . 2 1 1 A 55 55 GLY N N 55 109.800 109.572 0.228 1
1 647 . 2 1 1 A 56 56 LYS H H 56 7.876 8.282 -0.406 1
1 648 . 2 1 1 A 56 56 LYS HA H 56 4.195 4.153 0.042 1
1 657 . 2 1 1 A 56 56 LYS C C 56 178.600 178.552 0.048 1
1 658 . 2 1 1 A 56 56 LYS CA C 56 57.960 58.563 -0.603 1
1 659 . 2 1 1 A 56 56 LYS CB C 56 32.110 32.361 -0.251 1
1 663 . 2 1 1 A 56 56 LYS N N 56 121.800 121.330 0.470 1
1 664 . 2 1 1 A 57 57 LEU H H 57 8.153 7.938 0.215 1
1 665 . 2 1 1 A 57 57 LEU HA H 57 3.992 4.141 -0.149 1
1 675 . 2 1 1 A 57 57 LEU C C 57 178.400 178.575 -0.175 1
1 676 . 2 1 1 A 57 57 LEU CA C 57 58.190 58.456 -0.266 1
1 677 . 2 1 1 A 57 57 LEU CB C 57 41.360 41.745 -0.385 1
1 681 . 2 1 1 A 57 57 LEU N N 57 120.700 120.897 -0.197 1
1 682 . 2 1 1 A 58 58 GLN H H 58 8.019 7.966 0.053 1
1 683 . 2 1 1 A 58 58 GLN HA H 58 3.942 4.168 -0.226 1
1 690 . 2 1 1 A 58 58 GLN C C 58 179.100 178.536 0.564 1
1 691 . 2 1 1 A 58 58 GLN CA C 58 59.360 58.368 0.992 1
1 692 . 2 1 1 A 58 58 GLN CB C 58 28.030 28.602 -0.572 1
1 694 . 2 1 1 A 58 58 GLN N N 58 117.400 117.310 0.090 1
1 696 . 2 1 1 A 59 59 GLU H H 59 7.838 8.162 -0.324 1
1 697 . 2 1 1 A 59 59 GLU HA H 59 4.030 4.176 -0.146 1
1 702 . 2 1 1 A 59 59 GLU C C 59 178.600 178.458 0.142 1
1 703 . 2 1 1 A 59 59 GLU CA C 59 59.250 59.148 0.102 1
1 704 . 2 1 1 A 59 59 GLU CB C 59 28.960 29.381 -0.421 1
1 706 . 2 1 1 A 59 59 GLU N N 59 119.900 120.295 -0.395 1
1 707 . 2 1 1 A 60 60 MET H H 60 8.223 8.310 -0.087 1
1 708 . 2 1 1 A 60 60 MET HA H 60 3.966 4.254 -0.288 1
1 713 . 2 1 1 A 60 60 MET C C 60 177.900 178.752 -0.852 1
1 714 . 2 1 1 A 60 60 MET CA C 60 59.350 58.288 1.062 1
1 715 . 2 1 1 A 60 60 MET CB C 60 33.210 32.629 0.581 1
1 717 . 2 1 1 A 60 60 MET N N 60 120.100 118.074 2.026 1
1 718 . 2 1 1 A 61 61 MET H H 61 8.134 8.578 -0.444 1
1 719 . 2 1 1 A 61 61 MET HA H 61 4.195 4.593 -0.398 1
1 724 . 2 1 1 A 61 61 MET C C 61 179.100 178.596 0.504 1
1 725 . 2 1 1 A 61 61 MET CA C 61 58.210 58.391 -0.181 1
1 726 . 2 1 1 A 61 61 MET CB C 61 31.340 32.561 -1.221 1
1 728 . 2 1 1 A 61 61 MET N N 61 117.000 118.452 -1.452 1
1 729 . 2 1 1 A 62 62 LYS H H 62 7.782 8.181 -0.399 1
1 730 . 2 1 1 A 62 62 LYS HA H 62 4.085 3.968 0.117 1
1 739 . 2 1 1 A 62 62 LYS C C 62 179.600 179.050 0.550 1
1 740 . 2 1 1 A 62 62 LYS CA C 62 59.610 59.994 -0.384 1
1 741 . 2 1 1 A 62 62 LYS CB C 62 32.180 32.228 -0.048 1
1 745 . 2 1 1 A 62 62 LYS N N 62 120.600 121.688 -1.088 1
1 746 . 2 1 1 A 63 63 GLU H H 63 8.041 7.908 0.133 1
1 747 . 2 1 1 A 63 63 GLU HA H 63 4.057 3.930 0.127 1
1 752 . 2 1 1 A 63 63 GLU C C 63 178.900 178.927 -0.027 1
1 753 . 2 1 1 A 63 63 GLU CA C 63 59.170 58.773 0.397 1
1 754 . 2 1 1 A 63 63 GLU CB C 63 29.000 29.218 -0.218 1
1 756 . 2 1 1 A 63 63 GLU N N 63 120.200 119.195 1.005 1
1 757 . 2 1 1 A 64 64 PHE H H 64 8.604 8.758 -0.154 1
1 758 . 2 1 1 A 64 64 PHE HA H 64 4.155 4.040 0.115 1
1 763 . 2 1 1 A 64 64 PHE C C 64 177.800 177.446 0.354 1
1 764 . 2 1 1 A 64 64 PHE CA C 64 59.820 61.699 -1.879 1
1 765 . 2 1 1 A 64 64 PHE CB C 64 38.470 39.395 -0.925 1
1 766 . 2 1 1 A 64 64 PHE N N 64 119.700 120.776 -1.076 1
1 767 . 2 1 1 A 65 65 GLN H H 65 8.177 8.200 -0.023 1
1 768 . 2 1 1 A 65 65 GLN HA H 65 3.637 3.766 -0.129 1
1 775 . 2 1 1 A 65 65 GLN C C 65 177.800 177.960 -0.160 1
1 776 . 2 1 1 A 65 65 GLN CA C 65 58.970 58.031 0.939 1
1 777 . 2 1 1 A 65 65 GLN CB C 65 28.280 28.498 -0.218 1
1 779 . 2 1 1 A 65 65 GLN N N 65 118.500 118.137 0.363 1
1 781 . 2 1 1 A 66 66 GLN H H 66 7.622 7.847 -0.225 1
1 782 . 2 1 1 A 66 66 GLN HA H 66 4.040 4.252 -0.212 1
1 789 . 2 1 1 A 66 66 GLN C C 66 178.600 179.122 -0.522 1
1 790 . 2 1 1 A 66 66 GLN CA C 66 59.150 58.393 0.757 1
1 791 . 2 1 1 A 66 66 GLN CB C 66 28.230 28.552 -0.322 1
1 793 . 2 1 1 A 66 66 GLN N N 66 117.400 118.466 -1.066 1
1 795 . 2 1 1 A 67 67 VAL H H 67 7.744 7.935 -0.191 1
1 796 . 2 1 1 A 67 67 VAL HA H 67 3.785 3.691 0.094 1
1 804 . 2 1 1 A 67 67 VAL C C 67 177.500 177.769 -0.269 1
1 805 . 2 1 1 A 67 67 VAL CA C 67 66.220 66.329 -0.109 1
1 806 . 2 1 1 A 67 67 VAL CB C 67 31.390 31.548 -0.158 1
1 809 . 2 1 1 A 67 67 VAL N N 67 119.500 121.026 -1.526 1
1 810 . 2 1 1 A 68 68 LEU H H 68 7.983 7.897 0.086 1
1 811 . 2 1 1 A 68 68 LEU HA H 68 3.825 4.077 -0.252 1
1 821 . 2 1 1 A 68 68 LEU C C 68 179.100 177.994 1.106 1
1 822 . 2 1 1 A 68 68 LEU CA C 68 58.740 58.247 0.493 1
1 823 . 2 1 1 A 68 68 LEU CB C 68 41.090 41.737 -0.647 1
1 827 . 2 1 1 A 68 68 LEU N N 68 120.400 120.115 0.285 1
1 828 . 2 1 1 A 69 69 ASP H H 69 8.179 7.743 0.436 1
1 829 . 2 1 1 A 69 69 ASP HA H 69 4.380 4.532 -0.152 1
1 832 . 2 1 1 A 69 69 ASP C C 69 178.900 178.174 0.726 1
1 833 . 2 1 1 A 69 69 ASP CA C 69 57.320 55.629 1.691 1
1 834 . 2 1 1 A 69 69 ASP CB C 69 40.040 40.964 -0.924 1
1 835 . 2 1 1 A 69 69 ASP N N 69 119.000 118.155 0.845 1
1 836 . 2 1 1 A 70 70 GLU H H 70 8.166 7.992 0.174 1
1 837 . 2 1 1 A 70 70 GLU HA H 70 4.082 4.174 -0.092 1
1 842 . 2 1 1 A 70 70 GLU C C 70 179.600 178.941 0.659 1
1 843 . 2 1 1 A 70 70 GLU CA C 70 59.010 58.737 0.273 1
1 844 . 2 1 1 A 70 70 GLU CB C 70 28.900 30.114 -1.214 1
1 846 . 2 1 1 A 70 70 GLU N N 70 120.500 118.807 1.693 1
1 847 . 2 1 1 A 71 71 ILE H H 71 8.415 8.158 0.257 1
1 848 . 2 1 1 A 71 71 ILE HA H 71 3.790 3.385 0.405 1
1 858 . 2 1 1 A 71 71 ILE C C 71 177.400 177.481 -0.081 1
1 859 . 2 1 1 A 71 71 ILE CA C 71 64.890 65.223 -0.333 1
1 860 . 2 1 1 A 71 71 ILE CB C 71 37.680 37.598 0.082 1
1 864 . 2 1 1 A 71 71 ILE N N 71 119.200 119.771 -0.571 1
1 865 . 2 1 1 A 72 72 LYS H H 72 8.248 7.604 0.644 1
1 866 . 2 1 1 A 72 72 LYS HA H 72 3.625 3.158 0.467 1
1 873 . 2 1 1 A 72 72 LYS C C 72 178.400 178.612 -0.212 1
1 874 . 2 1 1 A 72 72 LYS CA C 72 59.850 59.439 0.411 1
1 875 . 2 1 1 A 72 72 LYS CB C 72 32.070 32.119 -0.049 1
1 879 . 2 1 1 A 72 72 LYS N N 72 120.800 120.892 -0.092 1
1 880 . 2 1 1 A 73 73 GLN H H 73 7.937 7.585 0.352 1
1 881 . 2 1 1 A 73 73 GLN HA H 73 4.042 4.026 0.016 1
1 888 . 2 1 1 A 73 73 GLN C C 73 178.400 178.800 -0.400 1
1 889 . 2 1 1 A 73 73 GLN CA C 73 58.510 59.073 -0.563 1
1 890 . 2 1 1 A 73 73 GLN CB C 73 28.430 28.052 0.378 1
1 892 . 2 1 1 A 73 73 GLN N N 73 117.000 118.148 -1.148 1
1 894 . 2 1 1 A 74 74 GLN H H 74 7.712 7.994 -0.282 1
1 895 . 2 1 1 A 74 74 GLN HA H 74 4.080 3.939 0.141 1
1 902 . 2 1 1 A 74 74 GLN C C 74 177.800 178.533 -0.733 1
1 903 . 2 1 1 A 74 74 GLN CA C 74 57.270 58.684 -1.414 1
1 904 . 2 1 1 A 74 74 GLN CB C 74 28.700 27.849 0.851 1
1 906 . 2 1 1 A 74 74 GLN N N 74 118.200 119.545 -1.345 1
1 908 . 2 1 1 A 75 75 LEU H H 75 7.956 7.818 0.138 1
1 909 . 2 1 1 A 75 75 LEU HA H 75 4.212 4.038 0.174 1
1 919 . 2 1 1 A 75 75 LEU CA C 75 56.660 57.648 -0.988 1
1 920 . 2 1 1 A 75 75 LEU CB C 75 42.000 41.301 0.699 1
1 924 . 2 1 1 A 75 75 LEU N N 75 120.700 120.489 0.211 1
1 925 . 2 1 1 A 76 76 GLN H H 76 8.315 7.989 0.326 1
1 926 . 2 1 1 A 76 76 GLN HA H 76 4.113 4.285 -0.172 1
1 933 . 2 1 1 A 76 76 GLN C C 76 177.100 176.021 1.079 1
1 934 . 2 1 1 A 76 76 GLN CA C 76 57.400 56.901 0.499 1
1 935 . 2 1 1 A 76 76 GLN CB C 76 28.640 28.364 0.276 1
1 937 . 2 1 1 A 76 76 GLN N N 76 120.100 116.314 3.786 1
1 939 . 2 1 1 A 77 77 GLY H H 77 8.021 7.994 0.027 1
1 940 . 2 1 1 A 77 77 GLY HA2 H 77 4.042 4.051 -0.009 1
1 941 . 2 1 1 A 77 77 GLY HA3 H 77 3.869 4.061 -0.192 1
1 942 . 2 1 1 A 77 77 GLY C C 77 174.600 174.424 0.176 1
1 943 . 2 1 1 A 77 77 GLY CA C 77 45.430 44.551 0.879 1
1 944 . 2 1 1 A 77 77 GLY N N 77 107.700 108.299 -0.599 1
1 945 . 2 1 1 A 78 78 GLY H H 78 7.819 8.578 -0.759 1
1 946 . 2 1 1 A 78 78 GLY HA2 H 78 4.208 3.985 0.223 1
1 947 . 2 1 1 A 78 78 GLY HA3 H 78 3.801 3.992 -0.191 1
1 948 . 2 1 1 A 78 78 GLY C C 78 173.900 174.325 -0.425 1
1 949 . 2 1 1 A 78 78 GLY CA C 78 45.140 44.990 0.150 1
1 950 . 2 1 1 A 78 78 GLY N N 78 107.100 110.502 -3.402 1
1 951 . 2 1 1 A 79 79 ASP H H 79 7.912 8.290 -0.378 1
1 952 . 2 1 1 A 79 79 ASP HA H 79 4.722 4.704 0.018 1
1 955 . 2 1 1 A 79 79 ASP C C 79 176.200 176.393 -0.193 1
1 956 . 2 1 1 A 79 79 ASP CA C 79 53.210 53.330 -0.120 1
1 957 . 2 1 1 A 79 79 ASP CB C 79 40.160 40.110 0.050 1
1 958 . 2 1 1 A 79 79 ASP N N 79 119.800 120.014 -0.214 1
1 959 . 2 1 1 A 80 80 ASN H H 80 8.450 7.870 0.580 1
1 960 . 2 1 1 A 80 80 ASN HA H 80 4.593 4.509 0.084 1
1 965 . 2 1 1 A 80 80 ASN C C 80 177.300 177.302 -0.002 1
1 966 . 2 1 1 A 80 80 ASN CA C 80 54.680 55.391 -0.711 1
1 967 . 2 1 1 A 80 80 ASN CB C 80 38.790 38.386 0.404 1
1 968 . 2 1 1 A 80 80 ASN N N 80 121.700 119.485 2.215 1
1 970 . 2 1 1 A 81 81 SER H H 81 8.444 7.974 0.470 1
1 971 . 2 1 1 A 81 81 SER HA H 81 4.263 4.294 -0.031 1
1 974 . 2 1 1 A 81 81 SER C C 81 176.100 177.158 -1.058 1
1 975 . 2 1 1 A 81 81 SER CA C 81 61.470 61.295 0.175 1
1 976 . 2 1 1 A 81 81 SER CB C 81 61.470 62.960 -1.490 1
1 977 . 2 1 1 A 81 81 SER N N 81 117.100 114.763 2.337 1
1 978 . 2 1 1 A 82 82 LEU H H 82 7.929 8.546 -0.617 1
1 979 . 2 1 1 A 82 82 LEU HA H 82 4.332 3.975 0.357 1
1 989 . 2 1 1 A 82 82 LEU C C 82 177.400 179.014 -1.614 1
1 990 . 2 1 1 A 82 82 LEU CA C 82 55.060 57.849 -2.789 1
1 991 . 2 1 1 A 82 82 LEU CB C 82 41.940 41.572 0.368 1
1 995 . 2 1 1 A 82 82 LEU N N 82 120.400 122.581 -2.181 1
1 996 . 2 1 1 A 83 83 HIS H H 83 8.014 7.927 0.087 1
1 997 . 2 1 1 A 83 83 HIS HA H 83 4.173 4.149 0.024 1
1 1000 . 2 1 1 A 83 83 HIS C C 83 176.100 176.867 -0.767 1
1 1001 . 2 1 1 A 83 83 HIS CA C 83 59.940 59.838 0.102 1
1 1002 . 2 1 1 A 83 83 HIS CB C 83 28.050 30.218 -2.168 1
1 1003 . 2 1 1 A 83 83 HIS N N 83 119.400 118.414 0.986 1
1 1004 . 2 1 1 A 84 84 ASN H H 84 8.598 8.314 0.284 1
1 1005 . 2 1 1 A 84 84 ASN HA H 84 4.735 4.768 -0.033 1
1 1010 . 2 1 1 A 84 84 ASN C C 84 177.400 177.213 0.187 1
1 1011 . 2 1 1 A 84 84 ASN CA C 84 55.790 55.478 0.312 1
1 1012 . 2 1 1 A 84 84 ASN CB C 84 37.520 39.015 -1.495 1
1 1013 . 2 1 1 A 84 84 ASN N N 84 118.100 117.355 0.745 1
1 1015 . 2 1 1 A 85 85 VAL H H 85 7.933 7.700 0.233 1
1 1016 . 2 1 1 A 85 85 VAL HA H 85 3.849 3.791 0.058 1
1 1024 . 2 1 1 A 85 85 VAL C C 85 177.100 177.929 -0.829 1
1 1025 . 2 1 1 A 85 85 VAL CA C 85 65.490 65.329 0.161 1
1 1026 . 2 1 1 A 85 85 VAL CB C 85 31.760 31.999 -0.239 1
1 1029 . 2 1 1 A 85 85 VAL N N 85 120.500 119.811 0.689 1
1 1030 . 2 1 1 A 86 86 HIS H H 86 8.460 9.514 -1.054 1
1 1031 . 2 1 1 A 86 86 HIS HA H 86 4.054 4.122 -0.068 1
1 1035 . 2 1 1 A 86 86 HIS C C 86 176.300 176.455 -0.155 1
1 1036 . 2 1 1 A 86 86 HIS CA C 86 59.860 59.399 0.461 1
1 1037 . 2 1 1 A 86 86 HIS CB C 86 29.670 30.095 -0.425 1
1 1038 . 2 1 1 A 86 86 HIS N N 86 119.300 119.322 -0.022 1
1 1039 . 2 1 1 A 87 87 GLU H H 87 7.897 8.201 -0.304 1
1 1040 . 2 1 1 A 87 87 GLU HA H 87 3.838 3.927 -0.089 1
1 1045 . 2 1 1 A 87 87 GLU C C 87 178.300 178.557 -0.257 1
1 1046 . 2 1 1 A 87 87 GLU CA C 87 58.690 57.955 0.735 1
1 1047 . 2 1 1 A 87 87 GLU CB C 87 28.460 29.135 -0.675 1
1 1049 . 2 1 1 A 87 87 GLU N N 87 117.100 118.335 -1.235 1
1 1050 . 2 1 1 A 88 88 ASN H H 88 8.103 9.038 -0.935 1
1 1051 . 2 1 1 A 88 88 ASN HA H 88 4.503 4.519 -0.016 1
1 1056 . 2 1 1 A 88 88 ASN C C 88 177.700 177.793 -0.093 1
1 1057 . 2 1 1 A 88 88 ASN CA C 88 55.990 55.783 0.207 1
1 1058 . 2 1 1 A 88 88 ASN CB C 88 39.010 38.621 0.389 1
1 1059 . 2 1 1 A 88 88 ASN N N 88 118.400 118.073 0.327 1
1 1061 . 2 1 1 A 89 89 ILE H H 89 8.501 8.094 0.407 1
1 1062 . 2 1 1 A 89 89 ILE HA H 89 3.670 3.807 -0.137 1
1 1072 . 2 1 1 A 89 89 ILE C C 89 177.000 177.877 -0.877 1
1 1073 . 2 1 1 A 89 89 ILE CA C 89 65.390 65.503 -0.113 1
1 1074 . 2 1 1 A 89 89 ILE CB C 89 37.440 37.750 -0.310 1
1 1078 . 2 1 1 A 89 89 ILE N N 89 118.700 119.625 -0.925 1
1 1079 . 2 1 1 A 90 90 LYS H H 90 8.017 8.008 0.009 1
1 1080 . 2 1 1 A 90 90 LYS HA H 90 3.775 3.930 -0.155 1
1 1089 . 2 1 1 A 90 90 LYS C C 90 178.800 178.735 0.065 1
1 1090 . 2 1 1 A 90 90 LYS CA C 90 60.450 59.877 0.573 1
1 1091 . 2 1 1 A 90 90 LYS CB C 90 32.110 32.415 -0.305 1
1 1095 . 2 1 1 A 90 90 LYS N N 90 120.900 120.145 0.755 1
1 1096 . 2 1 1 A 91 91 GLU H H 91 7.732 8.038 -0.306 1
1 1097 . 2 1 1 A 91 91 GLU HA H 91 4.083 4.266 -0.183 1
1 1102 . 2 1 1 A 91 91 GLU C C 91 179.100 179.002 0.098 1
1 1103 . 2 1 1 A 91 91 GLU CA C 91 59.120 58.919 0.201 1
1 1104 . 2 1 1 A 91 91 GLU CB C 91 28.810 29.649 -0.839 1
1 1106 . 2 1 1 A 91 91 GLU N N 91 119.300 118.310 0.990 1
1 1107 . 2 1 1 A 92 92 ILE H H 92 8.110 8.996 -0.886 1
1 1108 . 2 1 1 A 92 92 ILE HA H 92 3.685 3.620 0.065 1
1 1118 . 2 1 1 A 92 92 ILE C C 92 178.000 178.199 -0.199 1
1 1119 . 2 1 1 A 92 92 ILE CA C 92 65.900 65.387 0.513 1
1 1120 . 2 1 1 A 92 92 ILE CB C 92 38.400 38.011 0.389 1
1 1124 . 2 1 1 A 92 92 ILE N N 92 121.100 120.055 1.045 1
1 1125 . 2 1 1 A 93 93 PHE H H 93 8.651 9.167 -0.516 1
1 1126 . 2 1 1 A 93 93 PHE HA H 93 3.873 3.071 0.802 1
1 1133 . 2 1 1 A 93 93 PHE C C 93 177.100 177.970 -0.870 1
1 1134 . 2 1 1 A 93 93 PHE CA C 93 61.020 61.092 -0.072 1
1 1135 . 2 1 1 A 93 93 PHE CB C 93 38.560 38.232 0.328 1
1 1138 . 2 1 1 A 93 93 PHE N N 93 119.400 120.888 -1.488 1
1 1139 . 2 1 1 A 94 94 HIS H H 94 8.126 7.718 0.408 1
1 1140 . 2 1 1 A 94 94 HIS HA H 94 4.368 3.717 0.651 1
1 1145 . 2 1 1 A 94 94 HIS C C 94 177.100 176.909 0.191 1
1 1146 . 2 1 1 A 94 94 HIS CA C 94 58.310 57.459 0.851 1
1 1147 . 2 1 1 A 94 94 HIS CB C 94 27.910 30.114 -2.204 1
1 1148 . 2 1 1 A 94 94 HIS N N 94 116.400 118.001 -1.601 1
1 1149 . 2 1 1 A 95 95 HIS H H 95 8.058 8.423 -0.365 1
1 1150 . 2 1 1 A 95 95 HIS HA H 95 4.465 3.927 0.538 1
1 1154 . 2 1 1 A 95 95 HIS C C 95 177.300 177.353 -0.053 1
1 1155 . 2 1 1 A 95 95 HIS CA C 95 57.900 59.203 -1.303 1
1 1156 . 2 1 1 A 95 95 HIS CB C 95 28.490 29.703 -1.213 1
1 1157 . 2 1 1 A 95 95 HIS N N 95 117.000 118.082 -1.082 1
1 1158 . 2 1 1 A 96 96 LEU H H 96 8.525 7.928 0.597 1
1 1159 . 2 1 1 A 96 96 LEU HA H 96 3.865 3.537 0.328 1
1 1169 . 2 1 1 A 96 96 LEU C C 96 178.300 178.581 -0.281 1
1 1170 . 2 1 1 A 96 96 LEU CA C 96 58.250 58.228 0.022 1
1 1171 . 2 1 1 A 96 96 LEU CB C 96 41.720 41.829 -0.109 1
1 1175 . 2 1 1 A 96 96 LEU N N 96 121.300 120.197 1.103 1
1 1176 . 2 1 1 A 97 97 GLU H H 97 8.076 8.057 0.019 1
1 1177 . 2 1 1 A 97 97 GLU HA H 97 3.719 3.966 -0.247 1
1 1182 . 2 1 1 A 97 97 GLU C C 97 178.300 178.577 -0.277 1
1 1183 . 2 1 1 A 97 97 GLU CA C 97 59.300 58.532 0.768 1
1 1184 . 2 1 1 A 97 97 GLU CB C 97 28.960 29.609 -0.649 1
1 1186 . 2 1 1 A 97 97 GLU N N 97 117.100 117.897 -0.797 1
1 1187 . 2 1 1 A 98 98 GLU H H 98 7.329 7.604 -0.275 1
1 1188 . 2 1 1 A 98 98 GLU HA H 98 4.024 4.115 -0.091 1
1 1193 . 2 1 1 A 98 98 GLU C C 98 177.900 178.587 -0.687 1
1 1194 . 2 1 1 A 98 98 GLU CA C 98 58.190 58.323 -0.133 1
1 1195 . 2 1 1 A 98 98 GLU CB C 98 29.120 29.615 -0.495 1
1 1197 . 2 1 1 A 98 98 GLU N N 98 116.000 118.883 -2.883 1
1 1198 . 2 1 1 A 99 99 LEU H H 99 7.535 8.103 -0.568 1
1 1199 . 2 1 1 A 99 99 LEU HA H 99 4.183 4.136 0.047 1
1 1209 . 2 1 1 A 99 99 LEU C C 99 178.100 177.444 0.656 1
1 1210 . 2 1 1 A 99 99 LEU CA C 99 56.440 55.806 0.634 1
1 1211 . 2 1 1 A 99 99 LEU CB C 99 43.010 41.212 1.798 1
1 1215 . 2 1 1 A 99 99 LEU N N 99 118.200 118.794 -0.594 1
1 1216 . 2 1 1 A 100 100 VAL H H 100 7.561 7.304 0.257 1
1 1217 . 2 1 1 A 100 100 VAL HA H 100 4.033 4.529 -0.496 1
1 1225 . 2 1 1 A 100 100 VAL C C 100 175.400 177.914 -2.514 1
1 1226 . 2 1 1 A 100 100 VAL CA C 100 62.430 61.782 0.648 1
1 1227 . 2 1 1 A 100 100 VAL CB C 100 32.050 33.653 -1.603 1
1 1230 . 2 1 1 A 100 100 VAL N N 100 114.800 112.998 1.802 1
1 1231 . 2 1 1 A 101 101 HIS H H 101 7.827 7.880 -0.053 1
1 1232 . 2 1 1 A 101 101 HIS HA H 101 4.630 4.231 0.399 1
1 1237 . 2 1 1 A 101 101 HIS C C 101 173.500 176.001 -2.501 1
1 1238 . 2 1 1 A 101 101 HIS CA C 101 55.410 59.644 -4.234 1
1 1239 . 2 1 1 A 101 101 HIS CB C 101 28.870 29.936 -1.066 1
1 1240 . 2 1 1 A 101 101 HIS N N 101 120.300 122.808 -2.508 1
1 10 . 3 1 1 A 2 2 TYR H H 2 8.688 7.470 1.218 1
1 11 . 3 1 1 A 2 2 TYR HA H 2 4.737 4.189 0.548 1
1 16 . 3 1 1 A 2 2 TYR C C 2 175.900 176.283 -0.383 1
1 17 . 3 1 1 A 2 2 TYR CA C 2 57.920 60.494 -2.574 1
1 18 . 3 1 1 A 2 2 TYR CB C 2 38.340 38.708 -0.368 1
1 19 . 3 1 1 A 2 2 TYR N N 2 122.100 120.522 1.578 1
1 20 . 3 1 1 A 3 3 GLY H H 3 8.434 8.311 0.123 1
1 21 . 3 1 1 A 3 3 GLY HA2 H 3 3.909 4.038 -0.129 1
1 22 . 3 1 1 A 3 3 GLY HA3 H 3 3.841 4.071 -0.230 1
1 23 . 3 1 1 A 3 3 GLY C C 3 174.300 175.916 -1.616 1
1 24 . 3 1 1 A 3 3 GLY CA C 3 46.050 45.486 0.564 1
1 25 . 3 1 1 A 3 3 GLY N N 3 111.100 108.132 2.968 1
1 26 . 3 1 1 A 4 4 LYS H H 4 8.060 8.420 -0.360 1
1 27 . 3 1 1 A 4 4 LYS HA H 4 4.297 4.086 0.211 1
1 36 . 3 1 1 A 4 4 LYS C C 4 178.000 179.300 -1.300 1
1 37 . 3 1 1 A 4 4 LYS CA C 4 56.930 59.384 -2.454 1
1 38 . 3 1 1 A 4 4 LYS CB C 4 32.680 32.050 0.630 1
1 42 . 3 1 1 A 4 4 LYS N N 4 119.500 121.550 -2.050 1
1 43 . 3 1 1 A 5 5 LEU H H 5 8.243 8.221 0.022 1
1 44 . 3 1 1 A 5 5 LEU HA H 5 3.947 3.877 0.070 1
1 54 . 3 1 1 A 5 5 LEU C C 5 177.900 178.852 -0.952 1
1 55 . 3 1 1 A 5 5 LEU CA C 5 57.930 57.874 0.056 1
1 56 . 3 1 1 A 5 5 LEU CB C 5 41.620 41.617 0.003 1
1 60 . 3 1 1 A 5 5 LEU N N 5 120.800 119.853 0.947 1
1 61 . 3 1 1 A 6 6 ASN H H 6 8.256 7.904 0.352 1
1 62 . 3 1 1 A 6 6 ASN HA H 6 4.252 4.302 -0.050 1
1 67 . 3 1 1 A 6 6 ASN C C 6 177.300 177.343 -0.043 1
1 68 . 3 1 1 A 6 6 ASN CA C 6 56.900 56.693 0.207 1
1 69 . 3 1 1 A 6 6 ASN CB C 6 38.200 38.862 -0.662 1
1 70 . 3 1 1 A 6 6 ASN N N 6 116.200 116.509 -0.309 1
1 72 . 3 1 1 A 7 7 ASP H H 7 7.699 9.417 -1.718 1
1 73 . 3 1 1 A 7 7 ASP HA H 7 4.320 4.385 -0.065 1
1 76 . 3 1 1 A 7 7 ASP C C 7 178.000 178.067 -0.067 1
1 77 . 3 1 1 A 7 7 ASP CA C 7 56.980 57.358 -0.378 1
1 78 . 3 1 1 A 7 7 ASP CB C 7 39.870 41.500 -1.630 1
1 79 . 3 1 1 A 7 7 ASP N N 7 119.100 120.135 -1.035 1
1 80 . 3 1 1 A 8 8 LEU H H 8 7.580 8.514 -0.934 1
1 81 . 3 1 1 A 8 8 LEU HA H 8 4.091 4.154 -0.063 1
1 91 . 3 1 1 A 8 8 LEU C C 8 178.800 178.938 -0.138 1
1 92 . 3 1 1 A 8 8 LEU CA C 8 57.790 57.708 0.082 1
1 93 . 3 1 1 A 8 8 LEU CB C 8 41.880 42.025 -0.145 1
1 97 . 3 1 1 A 8 8 LEU N N 8 120.400 119.465 0.935 1
1 98 . 3 1 1 A 9 9 LEU H H 9 8.125 9.452 -1.327 1
1 99 . 3 1 1 A 9 9 LEU HA H 9 3.891 3.951 -0.060 1
1 109 . 3 1 1 A 9 9 LEU C C 9 178.900 178.567 0.333 1
1 110 . 3 1 1 A 9 9 LEU CA C 9 58.350 58.547 -0.197 1
1 111 . 3 1 1 A 9 9 LEU CB C 9 41.510 41.921 -0.411 1
1 115 . 3 1 1 A 9 9 LEU N N 9 118.900 119.997 -1.097 1
1 116 . 3 1 1 A 10 10 GLU H H 10 8.011 8.879 -0.868 1
1 117 . 3 1 1 A 10 10 GLU HA H 10 4.072 3.916 0.156 1
1 122 . 3 1 1 A 10 10 GLU C C 10 179.000 178.856 0.144 1
1 123 . 3 1 1 A 10 10 GLU CA C 10 59.090 59.931 -0.841 1
1 124 . 3 1 1 A 10 10 GLU CB C 10 27.910 29.350 -1.440 1
1 126 . 3 1 1 A 10 10 GLU N N 10 119.300 118.772 0.528 1
1 127 . 3 1 1 A 11 11 ASP H H 11 8.128 7.709 0.419 1
1 128 . 3 1 1 A 11 11 ASP HA H 11 4.383 4.481 -0.098 1
1 131 . 3 1 1 A 11 11 ASP C C 11 178.500 178.659 -0.159 1
1 132 . 3 1 1 A 11 11 ASP CA C 11 56.580 57.408 -0.828 1
1 133 . 3 1 1 A 11 11 ASP CB C 11 38.600 41.185 -2.585 1
1 134 . 3 1 1 A 11 11 ASP N N 11 119.600 120.520 -0.920 1
1 135 . 3 1 1 A 12 12 LEU H H 12 8.394 8.576 -0.182 1
1 136 . 3 1 1 A 12 12 LEU HA H 12 3.923 4.084 -0.161 1
1 146 . 3 1 1 A 12 12 LEU C C 12 178.200 178.539 -0.339 1
1 147 . 3 1 1 A 12 12 LEU CA C 12 57.880 57.984 -0.104 1
1 148 . 3 1 1 A 12 12 LEU CB C 12 41.850 41.411 0.439 1
1 152 . 3 1 1 A 12 12 LEU N N 12 120.500 121.538 -1.038 1
1 153 . 3 1 1 A 13 13 GLN H H 13 8.371 9.323 -0.952 1
1 154 . 3 1 1 A 13 13 GLN HA H 13 3.879 4.159 -0.280 1
1 161 . 3 1 1 A 13 13 GLN C C 13 178.600 177.988 0.612 1
1 162 . 3 1 1 A 13 13 GLN CA C 13 59.570 57.590 1.980 1
1 163 . 3 1 1 A 13 13 GLN CB C 13 28.440 27.219 1.221 1
1 165 . 3 1 1 A 13 13 GLN N N 13 118.400 116.675 1.725 1
1 167 . 3 1 1 A 14 14 GLU H H 14 7.913 8.030 -0.117 1
1 168 . 3 1 1 A 14 14 GLU HA H 14 4.021 4.139 -0.118 1
1 173 . 3 1 1 A 14 14 GLU C C 14 179.000 178.987 0.013 1
1 174 . 3 1 1 A 14 14 GLU CA C 14 59.030 58.707 0.323 1
1 175 . 3 1 1 A 14 14 GLU CB C 14 28.720 30.207 -1.487 1
1 177 . 3 1 1 A 14 14 GLU N N 14 119.100 119.182 -0.082 1
1 178 . 3 1 1 A 15 15 VAL H H 15 7.991 8.190 -0.199 1
1 179 . 3 1 1 A 15 15 VAL HA H 15 3.696 3.945 -0.249 1
1 187 . 3 1 1 A 15 15 VAL C C 15 178.300 177.713 0.587 1
1 188 . 3 1 1 A 15 15 VAL CA C 15 66.640 66.131 0.509 1
1 189 . 3 1 1 A 15 15 VAL CB C 15 31.470 31.482 -0.012 1
1 192 . 3 1 1 A 15 15 VAL N N 15 120.300 119.438 0.862 1
1 193 . 3 1 1 A 16 16 LEU H H 16 8.172 7.523 0.649 1
1 194 . 3 1 1 A 16 16 LEU HA H 16 3.876 4.103 -0.227 1
1 204 . 3 1 1 A 16 16 LEU C C 16 178.400 178.400 0.000 1
1 205 . 3 1 1 A 16 16 LEU CA C 16 58.050 58.181 -0.131 1
1 206 . 3 1 1 A 16 16 LEU CB C 16 41.420 41.846 -0.426 1
1 210 . 3 1 1 A 16 16 LEU N N 16 119.700 121.196 -1.496 1
1 211 . 3 1 1 A 17 17 LYS H H 17 7.755 8.810 -1.055 1
1 212 . 3 1 1 A 17 17 LYS HA H 17 3.951 4.041 -0.090 1
1 221 . 3 1 1 A 17 17 LYS C C 17 178.800 177.460 1.340 1
1 222 . 3 1 1 A 17 17 LYS CA C 17 59.470 58.610 0.860 1
1 223 . 3 1 1 A 17 17 LYS CB C 17 32.350 32.226 0.124 1
1 227 . 3 1 1 A 17 17 LYS N N 17 117.800 117.789 0.011 1
1 228 . 3 1 1 A 18 18 HIS H H 18 7.847 7.977 -0.130 1
1 229 . 3 1 1 A 18 18 HIS HA H 18 4.549 4.697 -0.148 1
1 233 . 3 1 1 A 18 18 HIS C C 18 177.200 175.919 1.281 1
1 234 . 3 1 1 A 18 18 HIS CA C 18 57.870 55.571 2.299 1
1 235 . 3 1 1 A 18 18 HIS CB C 18 28.730 30.576 -1.846 1
1 236 . 3 1 1 A 18 18 HIS N N 18 116.200 115.818 0.382 1
1 237 . 3 1 1 A 19 19 VAL H H 19 8.415 8.167 0.248 1
1 238 . 3 1 1 A 19 19 VAL HA H 19 3.746 4.202 -0.456 1
1 246 . 3 1 1 A 19 19 VAL CA C 19 65.850 63.814 2.036 1
1 247 . 3 1 1 A 19 19 VAL CB C 19 31.600 32.598 -0.998 1
1 250 . 3 1 1 A 20 20 ASN H H 20 8.041 7.769 0.272 1
1 251 . 3 1 1 A 20 20 ASN HA H 20 4.545 4.754 -0.209 1
1 256 . 3 1 1 A 20 20 ASN C C 20 176.900 177.670 -0.770 1
1 257 . 3 1 1 A 20 20 ASN CA C 20 55.070 55.337 -0.267 1
1 258 . 3 1 1 A 20 20 ASN CB C 20 38.270 38.736 -0.466 1
1 259 . 3 1 1 A 20 20 ASN N N 20 117.900 119.655 -1.755 1
1 261 . 3 1 1 A 21 21 GLN H H 21 7.887 8.333 -0.446 1
1 262 . 3 1 1 A 21 21 GLN HA H 21 4.096 4.198 -0.102 1
1 269 . 3 1 1 A 21 21 GLN C C 21 176.900 177.207 -0.307 1
1 270 . 3 1 1 A 21 21 GLN CA C 21 57.510 58.239 -0.729 1
1 271 . 3 1 1 A 21 21 GLN CB C 21 29.100 28.907 0.193 1
1 273 . 3 1 1 A 21 21 GLN N N 21 117.900 119.393 -1.493 1
1 275 . 3 1 1 A 22 22 HIS H H 22 7.887 8.326 -0.439 1
1 276 . 3 1 1 A 22 22 HIS HA H 22 4.679 4.851 -0.172 1
1 280 . 3 1 1 A 22 22 HIS C C 22 174.300 175.186 -0.886 1
1 281 . 3 1 1 A 22 22 HIS CA C 22 55.770 55.605 0.165 1
1 282 . 3 1 1 A 22 22 HIS CB C 22 28.630 29.904 -1.274 1
1 283 . 3 1 1 A 22 22 HIS N N 22 116.100 113.570 2.530 1
1 284 . 3 1 1 A 23 23 TRP H H 23 7.929 7.772 0.157 1
1 285 . 3 1 1 A 23 23 TRP HA H 23 4.542 4.619 -0.077 1
1 292 . 3 1 1 A 23 23 TRP C C 23 176.600 175.561 1.039 1
1 293 . 3 1 1 A 23 23 TRP CA C 23 58.020 58.727 -0.707 1
1 294 . 3 1 1 A 23 23 TRP CB C 23 29.700 30.354 -0.654 1
1 295 . 3 1 1 A 23 23 TRP N N 23 122.000 123.885 -1.885 1
1 297 . 3 1 1 A 24 24 GLN H H 24 8.258 8.408 -0.150 1
1 298 . 3 1 1 A 24 24 GLN HA H 24 4.329 4.752 -0.423 1
1 305 . 3 1 1 A 24 24 GLN C C 24 176.200 174.928 1.272 1
1 306 . 3 1 1 A 24 24 GLN CA C 24 55.960 55.250 0.710 1
1 307 . 3 1 1 A 24 24 GLN CB C 24 29.440 32.498 -3.058 1
1 309 . 3 1 1 A 24 24 GLN N N 24 123.800 127.056 -3.256 1
1 311 . 3 1 1 A 25 25 GLY H H 25 7.470 8.844 -1.374 1
1 312 . 3 1 1 A 25 25 GLY HA2 H 25 3.939 3.949 -0.010 1
1 313 . 3 1 1 A 25 25 GLY HA3 H 25 3.800 3.969 -0.169 1
1 314 . 3 1 1 A 25 25 GLY C C 25 174.800 175.200 -0.400 1
1 315 . 3 1 1 A 25 25 GLY CA C 25 45.470 46.288 -0.818 1
1 316 . 3 1 1 A 25 25 GLY N N 25 108.100 112.355 -4.255 1
1 317 . 3 1 1 A 26 26 GLY H H 26 8.332 8.649 -0.317 1
1 318 . 3 1 1 A 26 26 GLY HA2 H 26 4.105 4.171 -0.066 1
1 319 . 3 1 1 A 26 26 GLY HA3 H 26 3.974 4.221 -0.247 1
1 320 . 3 1 1 A 26 26 GLY C C 26 174.900 175.171 -0.271 1
1 321 . 3 1 1 A 26 26 GLY CA C 26 45.410 45.352 0.058 1
1 322 . 3 1 1 A 26 26 GLY N N 26 108.700 107.567 1.133 1
1 323 . 3 1 1 A 27 27 GLN H H 27 8.474 8.606 -0.132 1
1 324 . 3 1 1 A 27 27 GLN HA H 27 4.106 4.170 -0.064 1
1 331 . 3 1 1 A 27 27 GLN C C 27 177.100 176.526 0.574 1
1 332 . 3 1 1 A 27 27 GLN CA C 27 57.540 57.358 0.182 1
1 333 . 3 1 1 A 27 27 GLN CB C 27 29.050 28.734 0.316 1
1 335 . 3 1 1 A 27 27 GLN N N 27 121.100 122.793 -1.693 1
1 337 . 3 1 1 A 28 28 LYS H H 28 8.448 8.273 0.175 1
1 338 . 3 1 1 A 28 28 LYS HA H 28 4.068 4.029 0.039 1
1 347 . 3 1 1 A 28 28 LYS C C 28 177.900 178.555 -0.655 1
1 348 . 3 1 1 A 28 28 LYS CA C 28 58.410 58.946 -0.536 1
1 349 . 3 1 1 A 28 28 LYS CB C 28 32.210 32.368 -0.158 1
1 353 . 3 1 1 A 28 28 LYS N N 28 120.500 117.947 2.553 1
1 354 . 3 1 1 A 29 29 ASN H H 29 8.273 7.577 0.696 1
1 355 . 3 1 1 A 29 29 ASN HA H 29 4.584 4.411 0.173 1
1 360 . 3 1 1 A 29 29 ASN C C 29 176.200 177.421 -1.221 1
1 361 . 3 1 1 A 29 29 ASN CA C 29 54.400 56.219 -1.819 1
1 362 . 3 1 1 A 29 29 ASN CB C 29 38.280 38.413 -0.133 1
1 363 . 3 1 1 A 29 29 ASN N N 29 117.500 118.391 -0.891 1
1 365 . 3 1 1 A 30 30 MET H H 30 7.870 7.630 0.240 1
1 366 . 3 1 1 A 30 30 MET HA H 30 4.085 2.986 1.099 1
1 371 . 3 1 1 A 30 30 MET C C 30 177.000 176.774 0.226 1
1 372 . 3 1 1 A 30 30 MET CA C 30 56.880 57.627 -0.747 1
1 373 . 3 1 1 A 30 30 MET CB C 30 32.340 32.441 -0.101 1
1 375 . 3 1 1 A 30 30 MET N N 30 121.100 118.512 2.588 1
1 376 . 3 1 1 A 31 31 ASN H H 31 8.186 7.361 0.825 1
1 377 . 3 1 1 A 31 31 ASN HA H 31 4.311 4.669 -0.358 1
1 382 . 3 1 1 A 31 31 ASN C C 31 176.700 177.016 -0.316 1
1 383 . 3 1 1 A 31 31 ASN CA C 31 55.320 54.215 1.105 1
1 384 . 3 1 1 A 31 31 ASN CB C 31 38.410 39.501 -1.091 1
1 385 . 3 1 1 A 31 31 ASN N N 31 117.900 115.419 2.481 1
1 387 . 3 1 1 A 32 32 LYS H H 32 7.792 7.269 0.523 1
1 388 . 3 1 1 A 32 32 LYS HA H 32 3.992 4.062 -0.070 1
1 397 . 3 1 1 A 32 32 LYS C C 32 177.900 178.855 -0.955 1
1 398 . 3 1 1 A 32 32 LYS CA C 32 59.050 58.724 0.326 1
1 399 . 3 1 1 A 32 32 LYS CB C 32 32.460 31.742 0.718 1
1 403 . 3 1 1 A 32 32 LYS N N 32 120.400 121.235 -0.835 1
1 404 . 3 1 1 A 33 33 VAL H H 33 7.689 8.344 -0.655 1
1 405 . 3 1 1 A 33 33 VAL HA H 33 3.791 3.881 -0.090 1
1 413 . 3 1 1 A 33 33 VAL C C 33 177.100 177.420 -0.320 1
1 414 . 3 1 1 A 33 33 VAL CA C 33 65.360 65.147 0.213 1
1 415 . 3 1 1 A 33 33 VAL CB C 33 31.920 31.613 0.307 1
1 418 . 3 1 1 A 33 33 VAL N N 33 120.200 117.587 2.613 1
1 419 . 3 1 1 A 34 34 ASP H H 34 8.408 8.327 0.081 1
1 420 . 3 1 1 A 34 34 ASP HA H 34 4.303 4.265 0.038 1
1 423 . 3 1 1 A 34 34 ASP C C 34 178.200 178.267 -0.067 1
1 424 . 3 1 1 A 34 34 ASP CA C 34 55.880 57.017 -1.137 1
1 425 . 3 1 1 A 34 34 ASP CB C 34 38.710 41.364 -2.654 1
1 426 . 3 1 1 A 34 34 ASP N N 34 120.100 122.137 -2.037 1
1 427 . 3 1 1 A 35 35 HIS H H 35 8.204 7.933 0.271 1
1 428 . 3 1 1 A 35 35 HIS HA H 35 4.343 4.189 0.154 1
1 431 . 3 1 1 A 35 35 HIS C C 35 176.800 177.165 -0.365 1
1 432 . 3 1 1 A 35 35 HIS CA C 35 58.310 58.933 -0.623 1
1 433 . 3 1 1 A 35 35 HIS CB C 35 28.070 29.673 -1.603 1
1 434 . 3 1 1 A 35 35 HIS N N 35 118.200 119.074 -0.874 1
1 435 . 3 1 1 A 36 36 HIS H H 36 8.067 8.326 -0.259 1
1 436 . 3 1 1 A 36 36 HIS HA H 36 4.602 4.464 0.138 1
1 440 . 3 1 1 A 36 36 HIS C C 36 177.100 177.807 -0.707 1
1 441 . 3 1 1 A 36 36 HIS CA C 36 58.520 59.844 -1.324 1
1 442 . 3 1 1 A 36 36 HIS CB C 36 28.720 29.670 -0.950 1
1 443 . 3 1 1 A 36 36 HIS N N 36 117.100 117.280 -0.180 1
1 444 . 3 1 1 A 37 37 LEU H H 37 8.473 8.142 0.331 1
1 445 . 3 1 1 A 37 37 LEU HA H 37 3.894 3.737 0.157 1
1 455 . 3 1 1 A 37 37 LEU C C 37 178.200 178.658 -0.458 1
1 456 . 3 1 1 A 37 37 LEU CA C 37 58.520 58.117 0.403 1
1 457 . 3 1 1 A 37 37 LEU CB C 37 41.810 41.519 0.291 1
1 461 . 3 1 1 A 37 37 LEU N N 37 119.600 120.124 -0.524 1
1 462 . 3 1 1 A 38 38 GLN H H 38 8.337 7.925 0.412 1
1 463 . 3 1 1 A 38 38 GLN HA H 38 3.882 3.937 -0.055 1
1 470 . 3 1 1 A 38 38 GLN C C 38 178.500 178.587 -0.087 1
1 471 . 3 1 1 A 38 38 GLN CA C 38 59.200 59.377 -0.177 1
1 472 . 3 1 1 A 38 38 GLN CB C 38 27.850 28.139 -0.289 1
1 474 . 3 1 1 A 38 38 GLN N N 38 118.000 116.853 1.147 1
1 476 . 3 1 1 A 39 39 ASN H H 39 7.923 7.619 0.304 1
1 477 . 3 1 1 A 39 39 ASN HA H 39 4.390 4.647 -0.257 1
1 482 . 3 1 1 A 39 39 ASN C C 39 177.500 177.453 0.047 1
1 483 . 3 1 1 A 39 39 ASN CA C 39 55.780 56.112 -0.332 1
1 484 . 3 1 1 A 39 39 ASN CB C 39 37.450 38.366 -0.916 1
1 485 . 3 1 1 A 39 39 ASN N N 39 118.700 117.922 0.778 1
1 487 . 3 1 1 A 40 40 VAL H H 40 7.907 8.600 -0.693 1
1 488 . 3 1 1 A 40 40 VAL HA H 40 3.629 3.687 -0.058 1
1 496 . 3 1 1 A 40 40 VAL C C 40 177.500 178.052 -0.552 1
1 497 . 3 1 1 A 40 40 VAL CA C 40 67.080 66.275 0.805 1
1 498 . 3 1 1 A 40 40 VAL CB C 40 31.390 31.777 -0.387 1
1 501 . 3 1 1 A 40 40 VAL N N 40 120.400 120.197 0.203 1
1 502 . 3 1 1 A 41 41 ILE H H 41 8.103 8.184 -0.081 1
1 503 . 3 1 1 A 41 41 ILE HA H 41 3.401 3.668 -0.267 1
1 513 . 3 1 1 A 41 41 ILE C C 41 178.000 178.759 -0.759 1
1 514 . 3 1 1 A 41 41 ILE CA C 41 66.430 65.519 0.911 1
1 515 . 3 1 1 A 41 41 ILE CB C 41 38.050 37.796 0.254 1
1 519 . 3 1 1 A 41 41 ILE N N 41 120.600 119.718 0.882 1
1 520 . 3 1 1 A 42 42 GLU H H 42 8.150 7.741 0.409 1
1 521 . 3 1 1 A 42 42 GLU HA H 42 4.062 4.127 -0.065 1
1 526 . 3 1 1 A 42 42 GLU C C 42 178.500 178.829 -0.329 1
1 527 . 3 1 1 A 42 42 GLU CA C 42 59.120 59.107 0.013 1
1 528 . 3 1 1 A 42 42 GLU CB C 42 28.160 29.258 -1.098 1
1 530 . 3 1 1 A 42 42 GLU N N 42 119.900 121.220 -1.320 1
1 531 . 3 1 1 A 43 43 ASP H H 43 8.453 9.316 -0.863 1
1 532 . 3 1 1 A 43 43 ASP HA H 43 4.445 4.487 -0.042 1
1 535 . 3 1 1 A 43 43 ASP C C 43 178.400 177.912 0.488 1
1 536 . 3 1 1 A 43 43 ASP CA C 43 56.490 57.049 -0.559 1
1 537 . 3 1 1 A 43 43 ASP CB C 43 37.820 41.757 -3.937 1
1 538 . 3 1 1 A 43 43 ASP N N 43 119.700 120.238 -0.538 1
1 539 . 3 1 1 A 44 44 ILE H H 44 8.544 7.426 1.118 1
1 540 . 3 1 1 A 44 44 ILE HA H 44 3.590 3.966 -0.376 1
1 550 . 3 1 1 A 44 44 ILE C C 44 177.800 178.302 -0.502 1
1 551 . 3 1 1 A 44 44 ILE CA C 44 66.320 64.871 1.449 1
1 552 . 3 1 1 A 44 44 ILE CB C 44 37.690 37.878 -0.188 1
1 556 . 3 1 1 A 44 44 ILE N N 44 121.500 118.706 2.794 1
1 557 . 3 1 1 A 45 45 HIS H H 45 8.261 8.385 -0.124 1
1 558 . 3 1 1 A 45 45 HIS HA H 45 4.255 4.412 -0.157 1
1 562 . 3 1 1 A 45 45 HIS C C 45 177.200 176.652 0.548 1
1 563 . 3 1 1 A 45 45 HIS CA C 45 59.580 59.252 0.328 1
1 564 . 3 1 1 A 45 45 HIS CB C 45 27.790 29.621 -1.831 1
1 565 . 3 1 1 A 45 45 HIS N N 45 118.800 119.210 -0.410 1
1 566 . 3 1 1 A 46 46 ASP H H 46 8.680 8.130 0.550 1
1 567 . 3 1 1 A 46 46 ASP HA H 46 4.338 4.566 -0.228 1
1 570 . 3 1 1 A 46 46 ASP C C 46 178.700 178.351 0.349 1
1 571 . 3 1 1 A 46 46 ASP CA C 46 57.010 55.752 1.258 1
1 572 . 3 1 1 A 46 46 ASP CB C 46 39.400 40.671 -1.271 1
1 573 . 3 1 1 A 46 46 ASP N N 46 119.200 118.979 0.221 1
1 574 . 3 1 1 A 47 47 PHE H H 47 8.380 9.472 -1.092 1
1 575 . 3 1 1 A 47 47 PHE HA H 47 4.070 4.223 -0.153 1
1 580 . 3 1 1 A 47 47 PHE C C 47 178.600 177.831 0.769 1
1 581 . 3 1 1 A 47 47 PHE CA C 47 61.250 60.078 1.172 1
1 582 . 3 1 1 A 47 47 PHE CB C 47 39.570 39.894 -0.324 1
1 583 . 3 1 1 A 47 47 PHE N N 47 121.800 121.510 0.290 1
1 584 . 3 1 1 A 48 48 MET H H 48 8.366 8.260 0.106 1
1 585 . 3 1 1 A 48 48 MET HA H 48 3.998 4.330 -0.332 1
1 590 . 3 1 1 A 48 48 MET C C 48 177.400 177.882 -0.482 1
1 591 . 3 1 1 A 48 48 MET CA C 48 58.470 59.399 -0.929 1
1 592 . 3 1 1 A 48 48 MET CB C 48 33.170 33.641 -0.471 1
1 594 . 3 1 1 A 48 48 MET N N 48 117.700 118.036 -0.336 1
1 595 . 3 1 1 A 49 49 GLN H H 49 7.659 8.227 -0.568 1
1 596 . 3 1 1 A 49 49 GLN HA H 49 4.258 4.140 0.118 1
1 603 . 3 1 1 A 49 49 GLN C C 49 176.700 178.564 -1.864 1
1 604 . 3 1 1 A 49 49 GLN CA C 49 56.380 58.202 -1.822 1
1 605 . 3 1 1 A 49 49 GLN CB C 49 28.980 28.686 0.294 1
1 607 . 3 1 1 A 49 49 GLN N N 49 116.700 117.955 -1.255 1
1 609 . 3 1 1 A 50 50 GLY H H 50 7.685 8.629 -0.944 1
1 610 . 3 1 1 A 50 50 GLY HA2 H 50 3.998 3.826 0.172 1
1 611 . 3 1 1 A 50 50 GLY HA3 H 50 3.998 3.865 0.133 1
1 612 . 3 1 1 A 50 50 GLY C C 50 174.900 175.435 -0.535 1
1 613 . 3 1 1 A 50 50 GLY CA C 50 45.460 45.958 -0.498 1
1 614 . 3 1 1 A 50 50 GLY N N 50 106.400 108.882 -2.482 1
1 615 . 3 1 1 A 51 51 GLY H H 51 8.031 9.148 -1.117 1
1 616 . 3 1 1 A 51 51 GLY HA2 H 51 3.817 3.861 -0.044 1
1 617 . 3 1 1 A 51 51 GLY HA3 H 51 3.817 3.873 -0.056 1
1 618 . 3 1 1 A 51 51 GLY C C 51 174.500 174.137 0.363 1
1 619 . 3 1 1 A 51 51 GLY CA C 51 45.190 45.608 -0.418 1
1 620 . 3 1 1 A 51 51 GLY N N 51 108.900 109.097 -0.197 1
1 621 . 3 1 1 A 52 52 GLY H H 52 8.126 8.549 -0.423 1
1 622 . 3 1 1 A 52 52 GLY HA2 H 52 3.362 3.530 -0.168 1
1 623 . 3 1 1 A 52 52 GLY HA3 H 52 3.362 4.017 -0.655 1
1 624 . 3 1 1 A 52 52 GLY C C 52 173.300 174.058 -0.758 1
1 625 . 3 1 1 A 52 52 GLY CA C 52 45.120 45.238 -0.118 1
1 626 . 3 1 1 A 52 52 GLY N N 52 108.100 107.780 0.320 1
1 627 . 3 1 1 A 53 53 SER H H 53 7.594 7.929 -0.335 1
1 628 . 3 1 1 A 53 53 SER HA H 53 4.530 4.693 -0.163 1
1 631 . 3 1 1 A 53 53 SER C C 53 175.300 175.427 -0.127 1
1 632 . 3 1 1 A 53 53 SER CA C 53 57.770 57.249 0.521 1
1 633 . 3 1 1 A 53 53 SER CB C 53 64.750 61.405 3.345 1
1 634 . 3 1 1 A 53 53 SER N N 53 114.100 115.991 -1.891 1
1 635 . 3 1 1 A 54 54 GLY H H 54 9.003 8.394 0.609 1
1 636 . 3 1 1 A 54 54 GLY HA2 H 54 4.037 3.991 0.046 1
1 637 . 3 1 1 A 54 54 GLY HA3 H 54 3.911 4.086 -0.175 1
1 638 . 3 1 1 A 54 54 GLY C C 54 176.500 175.597 0.903 1
1 639 . 3 1 1 A 54 54 GLY CA C 54 47.040 46.994 0.046 1
1 640 . 3 1 1 A 54 54 GLY N N 54 110.400 111.394 -0.994 1
1 641 . 3 1 1 A 55 55 GLY H H 55 8.617 8.386 0.231 1
1 642 . 3 1 1 A 55 55 GLY HA2 H 55 3.946 3.874 0.072 1
1 643 . 3 1 1 A 55 55 GLY HA3 H 55 3.946 3.881 0.065 1
1 644 . 3 1 1 A 55 55 GLY C C 55 176.400 175.623 0.777 1
1 645 . 3 1 1 A 55 55 GLY CA C 55 46.630 46.968 -0.338 1
1 646 . 3 1 1 A 55 55 GLY N N 55 109.800 109.649 0.151 1
1 647 . 3 1 1 A 56 56 LYS H H 56 7.876 8.562 -0.686 1
1 648 . 3 1 1 A 56 56 LYS HA H 56 4.195 4.198 -0.003 1
1 657 . 3 1 1 A 56 56 LYS C C 56 178.600 178.659 -0.059 1
1 658 . 3 1 1 A 56 56 LYS CA C 56 57.960 58.656 -0.696 1
1 659 . 3 1 1 A 56 56 LYS CB C 56 32.110 32.179 -0.069 1
1 663 . 3 1 1 A 56 56 LYS N N 56 121.800 121.804 -0.004 1
1 664 . 3 1 1 A 57 57 LEU H H 57 8.153 7.925 0.228 1
1 665 . 3 1 1 A 57 57 LEU HA H 57 3.992 4.281 -0.289 1
1 675 . 3 1 1 A 57 57 LEU C C 57 178.400 178.566 -0.166 1
1 676 . 3 1 1 A 57 57 LEU CA C 57 58.190 58.630 -0.440 1
1 677 . 3 1 1 A 57 57 LEU CB C 57 41.360 41.995 -0.635 1
1 681 . 3 1 1 A 57 57 LEU N N 57 120.700 121.405 -0.705 1
1 682 . 3 1 1 A 58 58 GLN H H 58 8.019 7.973 0.046 1
1 683 . 3 1 1 A 58 58 GLN HA H 58 3.942 4.084 -0.142 1
1 690 . 3 1 1 A 58 58 GLN C C 58 179.100 178.343 0.757 1
1 691 . 3 1 1 A 58 58 GLN CA C 58 59.360 58.556 0.804 1
1 692 . 3 1 1 A 58 58 GLN CB C 58 28.030 28.226 -0.196 1
1 694 . 3 1 1 A 58 58 GLN N N 58 117.400 117.488 -0.088 1
1 696 . 3 1 1 A 59 59 GLU H H 59 7.838 7.980 -0.142 1
1 697 . 3 1 1 A 59 59 GLU HA H 59 4.030 4.108 -0.078 1
1 702 . 3 1 1 A 59 59 GLU C C 59 178.600 179.317 -0.717 1
1 703 . 3 1 1 A 59 59 GLU CA C 59 59.250 59.044 0.206 1
1 704 . 3 1 1 A 59 59 GLU CB C 59 28.960 29.684 -0.724 1
1 706 . 3 1 1 A 59 59 GLU N N 59 119.900 120.261 -0.361 1
1 707 . 3 1 1 A 60 60 MET H H 60 8.223 8.211 0.012 1
1 708 . 3 1 1 A 60 60 MET HA H 60 3.966 4.297 -0.331 1
1 713 . 3 1 1 A 60 60 MET C C 60 177.900 178.417 -0.517 1
1 714 . 3 1 1 A 60 60 MET CA C 60 59.350 57.706 1.644 1
1 715 . 3 1 1 A 60 60 MET CB C 60 33.210 32.315 0.895 1
1 717 . 3 1 1 A 60 60 MET N N 60 120.100 119.020 1.080 1
1 718 . 3 1 1 A 61 61 MET H H 61 8.134 8.260 -0.126 1
1 719 . 3 1 1 A 61 61 MET HA H 61 4.195 4.266 -0.071 1
1 724 . 3 1 1 A 61 61 MET C C 61 179.100 178.390 0.710 1
1 725 . 3 1 1 A 61 61 MET CA C 61 58.210 58.895 -0.685 1
1 726 . 3 1 1 A 61 61 MET CB C 61 31.340 32.438 -1.098 1
1 728 . 3 1 1 A 61 61 MET N N 61 117.000 119.396 -2.396 1
1 729 . 3 1 1 A 62 62 LYS H H 62 7.782 7.764 0.018 1
1 730 . 3 1 1 A 62 62 LYS HA H 62 4.085 4.066 0.019 1
1 739 . 3 1 1 A 62 62 LYS C C 62 179.600 179.536 0.064 1
1 740 . 3 1 1 A 62 62 LYS CA C 62 59.610 59.904 -0.294 1
1 741 . 3 1 1 A 62 62 LYS CB C 62 32.180 32.173 0.007 1
1 745 . 3 1 1 A 62 62 LYS N N 62 120.600 119.029 1.571 1
1 746 . 3 1 1 A 63 63 GLU H H 63 8.041 8.126 -0.085 1
1 747 . 3 1 1 A 63 63 GLU HA H 63 4.057 3.947 0.110 1
1 752 . 3 1 1 A 63 63 GLU C C 63 178.900 179.248 -0.348 1
1 753 . 3 1 1 A 63 63 GLU CA C 63 59.170 58.731 0.439 1
1 754 . 3 1 1 A 63 63 GLU CB C 63 29.000 29.824 -0.824 1
1 756 . 3 1 1 A 63 63 GLU N N 63 120.200 119.553 0.647 1
1 757 . 3 1 1 A 64 64 PHE H H 64 8.604 9.005 -0.401 1
1 758 . 3 1 1 A 64 64 PHE HA H 64 4.155 3.918 0.237 1
1 763 . 3 1 1 A 64 64 PHE C C 64 177.800 178.188 -0.388 1
1 764 . 3 1 1 A 64 64 PHE CA C 64 59.820 61.337 -1.517 1
1 765 . 3 1 1 A 64 64 PHE CB C 64 38.470 38.932 -0.462 1
1 766 . 3 1 1 A 64 64 PHE N N 64 119.700 121.329 -1.629 1
1 767 . 3 1 1 A 65 65 GLN H H 65 8.177 8.561 -0.384 1
1 768 . 3 1 1 A 65 65 GLN HA H 65 3.637 4.571 -0.934 1
1 775 . 3 1 1 A 65 65 GLN C C 65 177.800 178.076 -0.276 1
1 776 . 3 1 1 A 65 65 GLN CA C 65 58.970 58.310 0.660 1
1 777 . 3 1 1 A 65 65 GLN CB C 65 28.280 28.558 -0.278 1
1 779 . 3 1 1 A 65 65 GLN N N 65 118.500 118.697 -0.197 1
1 781 . 3 1 1 A 66 66 GLN H H 66 7.622 8.558 -0.936 1
1 782 . 3 1 1 A 66 66 GLN HA H 66 4.040 4.489 -0.449 1
1 789 . 3 1 1 A 66 66 GLN C C 66 178.600 178.597 0.003 1
1 790 . 3 1 1 A 66 66 GLN CA C 66 59.150 58.048 1.102 1
1 791 . 3 1 1 A 66 66 GLN CB C 66 28.230 28.803 -0.573 1
1 793 . 3 1 1 A 66 66 GLN N N 66 117.400 118.592 -1.192 1
1 795 . 3 1 1 A 67 67 VAL H H 67 7.744 7.489 0.255 1
1 796 . 3 1 1 A 67 67 VAL HA H 67 3.785 3.599 0.186 1
1 804 . 3 1 1 A 67 67 VAL C C 67 177.500 177.845 -0.345 1
1 805 . 3 1 1 A 67 67 VAL CA C 67 66.220 66.381 -0.161 1
1 806 . 3 1 1 A 67 67 VAL CB C 67 31.390 31.268 0.122 1
1 809 . 3 1 1 A 67 67 VAL N N 67 119.500 121.090 -1.590 1
1 810 . 3 1 1 A 68 68 LEU H H 68 7.983 7.723 0.260 1
1 811 . 3 1 1 A 68 68 LEU HA H 68 3.825 4.002 -0.177 1
1 821 . 3 1 1 A 68 68 LEU C C 68 179.100 178.391 0.709 1
1 822 . 3 1 1 A 68 68 LEU CA C 68 58.740 58.413 0.327 1
1 823 . 3 1 1 A 68 68 LEU CB C 68 41.090 41.950 -0.860 1
1 827 . 3 1 1 A 68 68 LEU N N 68 120.400 120.042 0.358 1
1 828 . 3 1 1 A 69 69 ASP H H 69 8.179 8.350 -0.171 1
1 829 . 3 1 1 A 69 69 ASP HA H 69 4.380 4.512 -0.132 1
1 832 . 3 1 1 A 69 69 ASP C C 69 178.900 178.468 0.432 1
1 833 . 3 1 1 A 69 69 ASP CA C 69 57.320 55.604 1.716 1
1 834 . 3 1 1 A 69 69 ASP CB C 69 40.040 39.077 0.963 1
1 835 . 3 1 1 A 69 69 ASP N N 69 119.000 116.239 2.761 1
1 836 . 3 1 1 A 70 70 GLU H H 70 8.166 8.000 0.166 1
1 837 . 3 1 1 A 70 70 GLU HA H 70 4.082 4.269 -0.187 1
1 842 . 3 1 1 A 70 70 GLU C C 70 179.600 178.720 0.880 1
1 843 . 3 1 1 A 70 70 GLU CA C 70 59.010 58.798 0.212 1
1 844 . 3 1 1 A 70 70 GLU CB C 70 28.900 30.197 -1.297 1
1 846 . 3 1 1 A 70 70 GLU N N 70 120.500 119.646 0.854 1
1 847 . 3 1 1 A 71 71 ILE H H 71 8.415 8.062 0.353 1
1 848 . 3 1 1 A 71 71 ILE HA H 71 3.790 3.532 0.258 1
1 858 . 3 1 1 A 71 71 ILE C C 71 177.400 177.762 -0.362 1
1 859 . 3 1 1 A 71 71 ILE CA C 71 64.890 64.244 0.646 1
1 860 . 3 1 1 A 71 71 ILE CB C 71 37.680 36.757 0.923 1
1 864 . 3 1 1 A 71 71 ILE N N 71 119.200 120.458 -1.258 1
1 865 . 3 1 1 A 72 72 LYS H H 72 8.248 8.082 0.166 1
1 866 . 3 1 1 A 72 72 LYS HA H 72 3.625 3.302 0.323 1
1 873 . 3 1 1 A 72 72 LYS C C 72 178.400 177.872 0.528 1
1 874 . 3 1 1 A 72 72 LYS CA C 72 59.850 59.167 0.683 1
1 875 . 3 1 1 A 72 72 LYS CB C 72 32.070 32.121 -0.051 1
1 879 . 3 1 1 A 72 72 LYS N N 72 120.800 122.014 -1.214 1
1 880 . 3 1 1 A 73 73 GLN H H 73 7.937 7.962 -0.025 1
1 881 . 3 1 1 A 73 73 GLN HA H 73 4.042 4.030 0.012 1
1 888 . 3 1 1 A 73 73 GLN C C 73 178.400 178.504 -0.104 1
1 889 . 3 1 1 A 73 73 GLN CA C 73 58.510 58.516 -0.006 1
1 890 . 3 1 1 A 73 73 GLN CB C 73 28.430 28.697 -0.267 1
1 892 . 3 1 1 A 73 73 GLN N N 73 117.000 117.951 -0.951 1
1 894 . 3 1 1 A 74 74 GLN H H 74 7.712 7.553 0.159 1
1 895 . 3 1 1 A 74 74 GLN HA H 74 4.080 3.934 0.146 1
1 902 . 3 1 1 A 74 74 GLN C C 74 177.800 178.135 -0.335 1
1 903 . 3 1 1 A 74 74 GLN CA C 74 57.270 58.256 -0.986 1
1 904 . 3 1 1 A 74 74 GLN CB C 74 28.700 27.893 0.807 1
1 906 . 3 1 1 A 74 74 GLN N N 74 118.200 119.289 -1.089 1
1 908 . 3 1 1 A 75 75 LEU H H 75 7.956 7.519 0.437 1
1 909 . 3 1 1 A 75 75 LEU HA H 75 4.212 4.051 0.161 1
1 919 . 3 1 1 A 75 75 LEU CA C 75 56.660 55.971 0.689 1
1 920 . 3 1 1 A 75 75 LEU CB C 75 42.000 40.924 1.076 1
1 924 . 3 1 1 A 75 75 LEU N N 75 120.700 118.219 2.481 1
1 925 . 3 1 1 A 76 76 GLN H H 76 8.315 8.064 0.251 1
1 926 . 3 1 1 A 76 76 GLN HA H 76 4.113 3.946 0.167 1
1 933 . 3 1 1 A 76 76 GLN C C 76 177.100 177.225 -0.125 1
1 934 . 3 1 1 A 76 76 GLN CA C 76 57.400 58.911 -1.511 1
1 935 . 3 1 1 A 76 76 GLN CB C 76 28.640 28.191 0.449 1
1 937 . 3 1 1 A 76 76 GLN N N 76 120.100 119.472 0.628 1
1 939 . 3 1 1 A 77 77 GLY H H 77 8.021 7.538 0.483 1
1 940 . 3 1 1 A 77 77 GLY HA2 H 77 4.042 4.031 0.011 1
1 941 . 3 1 1 A 77 77 GLY HA3 H 77 3.869 4.034 -0.165 1
1 942 . 3 1 1 A 77 77 GLY C C 77 174.600 174.961 -0.361 1
1 943 . 3 1 1 A 77 77 GLY CA C 77 45.430 44.762 0.668 1
1 944 . 3 1 1 A 77 77 GLY N N 77 107.700 108.003 -0.303 1
1 945 . 3 1 1 A 78 78 GLY H H 78 7.819 9.693 -1.874 1
1 946 . 3 1 1 A 78 78 GLY HA2 H 78 4.208 3.884 0.324 1
1 947 . 3 1 1 A 78 78 GLY HA3 H 78 3.801 3.899 -0.098 1
1 948 . 3 1 1 A 78 78 GLY C C 78 173.900 174.483 -0.583 1
1 949 . 3 1 1 A 78 78 GLY CA C 78 45.140 45.191 -0.051 1
1 950 . 3 1 1 A 78 78 GLY N N 78 107.100 108.461 -1.361 1
1 951 . 3 1 1 A 79 79 ASP H H 79 7.912 7.774 0.138 1
1 952 . 3 1 1 A 79 79 ASP HA H 79 4.722 4.760 -0.038 1
1 955 . 3 1 1 A 79 79 ASP C C 79 176.200 176.576 -0.376 1
1 956 . 3 1 1 A 79 79 ASP CA C 79 53.210 54.484 -1.274 1
1 957 . 3 1 1 A 79 79 ASP CB C 79 40.160 40.149 0.011 1
1 958 . 3 1 1 A 79 79 ASP N N 79 119.800 120.079 -0.279 1
1 959 . 3 1 1 A 80 80 ASN H H 80 8.450 9.289 -0.839 1
1 960 . 3 1 1 A 80 80 ASN HA H 80 4.593 4.497 0.096 1
1 965 . 3 1 1 A 80 80 ASN C C 80 177.300 176.866 0.434 1
1 966 . 3 1 1 A 80 80 ASN CA C 80 54.680 54.671 0.009 1
1 967 . 3 1 1 A 80 80 ASN CB C 80 38.790 37.277 1.513 1
1 968 . 3 1 1 A 80 80 ASN N N 80 121.700 118.385 3.315 1
1 970 . 3 1 1 A 81 81 SER H H 81 8.444 7.867 0.577 1
1 971 . 3 1 1 A 81 81 SER HA H 81 4.263 4.381 -0.118 1
1 974 . 3 1 1 A 81 81 SER C C 81 176.100 176.613 -0.513 1
1 975 . 3 1 1 A 81 81 SER CA C 81 61.470 61.420 0.050 1
1 976 . 3 1 1 A 81 81 SER CB C 81 61.470 62.863 -1.393 1
1 977 . 3 1 1 A 81 81 SER N N 81 117.100 116.344 0.756 1
1 978 . 3 1 1 A 82 82 LEU H H 82 7.929 8.109 -0.180 1
1 979 . 3 1 1 A 82 82 LEU HA H 82 4.332 3.994 0.338 1
1 989 . 3 1 1 A 82 82 LEU C C 82 177.400 179.051 -1.651 1
1 990 . 3 1 1 A 82 82 LEU CA C 82 55.060 57.879 -2.819 1
1 991 . 3 1 1 A 82 82 LEU CB C 82 41.940 41.515 0.425 1
1 995 . 3 1 1 A 82 82 LEU N N 82 120.400 121.816 -1.416 1
1 996 . 3 1 1 A 83 83 HIS H H 83 8.014 7.932 0.082 1
1 997 . 3 1 1 A 83 83 HIS HA H 83 4.173 4.119 0.054 1
1 1000 . 3 1 1 A 83 83 HIS C C 83 176.100 176.671 -0.571 1
1 1001 . 3 1 1 A 83 83 HIS CA C 83 59.940 59.843 0.097 1
1 1002 . 3 1 1 A 83 83 HIS CB C 83 28.050 30.187 -2.137 1
1 1003 . 3 1 1 A 83 83 HIS N N 83 119.400 118.469 0.931 1
1 1004 . 3 1 1 A 84 84 ASN H H 84 8.598 8.300 0.298 1
1 1005 . 3 1 1 A 84 84 ASN HA H 84 4.735 4.594 0.141 1
1 1010 . 3 1 1 A 84 84 ASN C C 84 177.400 177.418 -0.018 1
1 1011 . 3 1 1 A 84 84 ASN CA C 84 55.790 54.890 0.900 1
1 1012 . 3 1 1 A 84 84 ASN CB C 84 37.520 38.979 -1.459 1
1 1013 . 3 1 1 A 84 84 ASN N N 84 118.100 116.619 1.481 1
1 1015 . 3 1 1 A 85 85 VAL H H 85 7.933 7.808 0.125 1
1 1016 . 3 1 1 A 85 85 VAL HA H 85 3.849 3.794 0.055 1
1 1024 . 3 1 1 A 85 85 VAL C C 85 177.100 178.031 -0.931 1
1 1025 . 3 1 1 A 85 85 VAL CA C 85 65.490 65.915 -0.425 1
1 1026 . 3 1 1 A 85 85 VAL CB C 85 31.760 31.700 0.060 1
1 1029 . 3 1 1 A 85 85 VAL N N 85 120.500 119.900 0.600 1
1 1030 . 3 1 1 A 86 86 HIS H H 86 8.460 9.378 -0.918 1
1 1031 . 3 1 1 A 86 86 HIS HA H 86 4.054 4.128 -0.074 1
1 1035 . 3 1 1 A 86 86 HIS C C 86 176.300 177.653 -1.353 1
1 1036 . 3 1 1 A 86 86 HIS CA C 86 59.860 60.223 -0.363 1
1 1037 . 3 1 1 A 86 86 HIS CB C 86 29.670 29.943 -0.273 1
1 1038 . 3 1 1 A 86 86 HIS N N 86 119.300 119.041 0.259 1
1 1039 . 3 1 1 A 87 87 GLU H H 87 7.897 8.000 -0.103 1
1 1040 . 3 1 1 A 87 87 GLU HA H 87 3.838 3.811 0.027 1
1 1045 . 3 1 1 A 87 87 GLU C C 87 178.300 178.634 -0.334 1
1 1046 . 3 1 1 A 87 87 GLU CA C 87 58.690 59.171 -0.481 1
1 1047 . 3 1 1 A 87 87 GLU CB C 87 28.460 29.123 -0.663 1
1 1049 . 3 1 1 A 87 87 GLU N N 87 117.100 118.963 -1.863 1
1 1050 . 3 1 1 A 88 88 ASN H H 88 8.103 8.645 -0.542 1
1 1051 . 3 1 1 A 88 88 ASN HA H 88 4.503 4.424 0.079 1
1 1056 . 3 1 1 A 88 88 ASN C C 88 177.700 177.706 -0.006 1
1 1057 . 3 1 1 A 88 88 ASN CA C 88 55.990 56.044 -0.054 1
1 1058 . 3 1 1 A 88 88 ASN CB C 88 39.010 37.860 1.150 1
1 1059 . 3 1 1 A 88 88 ASN N N 88 118.400 116.806 1.594 1
1 1061 . 3 1 1 A 89 89 ILE H H 89 8.501 7.833 0.668 1
1 1062 . 3 1 1 A 89 89 ILE HA H 89 3.670 3.811 -0.141 1
1 1072 . 3 1 1 A 89 89 ILE C C 89 177.000 179.229 -2.229 1
1 1073 . 3 1 1 A 89 89 ILE CA C 89 65.390 64.920 0.470 1
1 1074 . 3 1 1 A 89 89 ILE CB C 89 37.440 37.588 -0.148 1
1 1078 . 3 1 1 A 89 89 ILE N N 89 118.700 119.921 -1.221 1
1 1079 . 3 1 1 A 90 90 LYS H H 90 8.017 7.977 0.040 1
1 1080 . 3 1 1 A 90 90 LYS HA H 90 3.775 4.117 -0.342 1
1 1089 . 3 1 1 A 90 90 LYS C C 90 178.800 179.163 -0.363 1
1 1090 . 3 1 1 A 90 90 LYS CA C 90 60.450 59.581 0.869 1
1 1091 . 3 1 1 A 90 90 LYS CB C 90 32.110 32.026 0.084 1
1 1095 . 3 1 1 A 90 90 LYS N N 90 120.900 121.925 -1.025 1
1 1096 . 3 1 1 A 91 91 GLU H H 91 7.732 7.789 -0.057 1
1 1097 . 3 1 1 A 91 91 GLU HA H 91 4.083 3.849 0.234 1
1 1102 . 3 1 1 A 91 91 GLU C C 91 179.100 179.258 -0.158 1
1 1103 . 3 1 1 A 91 91 GLU CA C 91 59.120 58.889 0.231 1
1 1104 . 3 1 1 A 91 91 GLU CB C 91 28.810 29.409 -0.599 1
1 1106 . 3 1 1 A 91 91 GLU N N 91 119.300 118.584 0.716 1
1 1107 . 3 1 1 A 92 92 ILE H H 92 8.110 8.951 -0.841 1
1 1108 . 3 1 1 A 92 92 ILE HA H 92 3.685 3.870 -0.185 1
1 1118 . 3 1 1 A 92 92 ILE C C 92 178.000 178.607 -0.607 1
1 1119 . 3 1 1 A 92 92 ILE CA C 92 65.900 64.366 1.534 1
1 1120 . 3 1 1 A 92 92 ILE CB C 92 38.400 37.267 1.133 1
1 1124 . 3 1 1 A 92 92 ILE N N 92 121.100 120.386 0.714 1
1 1125 . 3 1 1 A 93 93 PHE H H 93 8.651 7.910 0.741 1
1 1126 . 3 1 1 A 93 93 PHE HA H 93 3.873 3.357 0.516 1
1 1133 . 3 1 1 A 93 93 PHE C C 93 177.100 177.818 -0.718 1
1 1134 . 3 1 1 A 93 93 PHE CA C 93 61.020 60.858 0.162 1
1 1135 . 3 1 1 A 93 93 PHE CB C 93 38.560 38.760 -0.200 1
1 1138 . 3 1 1 A 93 93 PHE N N 93 119.400 122.835 -3.435 1
1 1139 . 3 1 1 A 94 94 HIS H H 94 8.126 7.554 0.572 1
1 1140 . 3 1 1 A 94 94 HIS HA H 94 4.368 4.409 -0.041 1
1 1145 . 3 1 1 A 94 94 HIS C C 94 177.100 176.509 0.591 1
1 1146 . 3 1 1 A 94 94 HIS CA C 94 58.310 58.016 0.294 1
1 1147 . 3 1 1 A 94 94 HIS CB C 94 27.910 29.354 -1.444 1
1 1148 . 3 1 1 A 94 94 HIS N N 94 116.400 118.385 -1.985 1
1 1149 . 3 1 1 A 95 95 HIS H H 95 8.058 7.785 0.273 1
1 1150 . 3 1 1 A 95 95 HIS HA H 95 4.465 4.438 0.027 1
1 1154 . 3 1 1 A 95 95 HIS C C 95 177.300 177.567 -0.267 1
1 1155 . 3 1 1 A 95 95 HIS CA C 95 57.900 59.375 -1.475 1
1 1156 . 3 1 1 A 95 95 HIS CB C 95 28.490 30.681 -2.191 1
1 1157 . 3 1 1 A 95 95 HIS N N 95 117.000 115.823 1.177 1
1 1158 . 3 1 1 A 96 96 LEU H H 96 8.525 8.202 0.323 1
1 1159 . 3 1 1 A 96 96 LEU HA H 96 3.865 3.969 -0.104 1
1 1169 . 3 1 1 A 96 96 LEU C C 96 178.300 179.164 -0.864 1
1 1170 . 3 1 1 A 96 96 LEU CA C 96 58.250 57.830 0.420 1
1 1171 . 3 1 1 A 96 96 LEU CB C 96 41.720 41.812 -0.092 1
1 1175 . 3 1 1 A 96 96 LEU N N 96 121.300 120.991 0.309 1
1 1176 . 3 1 1 A 97 97 GLU H H 97 8.076 8.075 0.001 1
1 1177 . 3 1 1 A 97 97 GLU HA H 97 3.719 4.065 -0.346 1
1 1182 . 3 1 1 A 97 97 GLU C C 97 178.300 178.411 -0.111 1
1 1183 . 3 1 1 A 97 97 GLU CA C 97 59.300 58.885 0.415 1
1 1184 . 3 1 1 A 97 97 GLU CB C 97 28.960 29.158 -0.198 1
1 1186 . 3 1 1 A 97 97 GLU N N 97 117.100 118.116 -1.016 1
1 1187 . 3 1 1 A 98 98 GLU H H 98 7.329 8.034 -0.705 1
1 1188 . 3 1 1 A 98 98 GLU HA H 98 4.024 4.323 -0.299 1
1 1193 . 3 1 1 A 98 98 GLU C C 98 177.900 178.554 -0.654 1
1 1194 . 3 1 1 A 98 98 GLU CA C 98 58.190 58.473 -0.283 1
1 1195 . 3 1 1 A 98 98 GLU CB C 98 29.120 30.255 -1.135 1
1 1197 . 3 1 1 A 98 98 GLU N N 98 116.000 119.212 -3.212 1
1 1198 . 3 1 1 A 99 99 LEU H H 99 7.535 7.896 -0.361 1
1 1199 . 3 1 1 A 99 99 LEU HA H 99 4.183 4.045 0.138 1
1 1209 . 3 1 1 A 99 99 LEU C C 99 178.100 177.529 0.571 1
1 1210 . 3 1 1 A 99 99 LEU CA C 99 56.440 56.500 -0.060 1
1 1211 . 3 1 1 A 99 99 LEU CB C 99 43.010 41.171 1.839 1
1 1215 . 3 1 1 A 99 99 LEU N N 99 118.200 119.547 -1.347 1
1 1216 . 3 1 1 A 100 100 VAL H H 100 7.561 6.820 0.741 1
1 1217 . 3 1 1 A 100 100 VAL HA H 100 4.033 4.536 -0.503 1
1 1225 . 3 1 1 A 100 100 VAL C C 100 175.400 177.765 -2.365 1
1 1226 . 3 1 1 A 100 100 VAL CA C 100 62.430 62.795 -0.365 1
1 1227 . 3 1 1 A 100 100 VAL CB C 100 32.050 33.209 -1.159 1
1 1230 . 3 1 1 A 100 100 VAL N N 100 114.800 112.013 2.787 1
1 1231 . 3 1 1 A 101 101 HIS H H 101 7.827 8.183 -0.356 1
1 1232 . 3 1 1 A 101 101 HIS HA H 101 4.630 4.131 0.499 1
1 1237 . 3 1 1 A 101 101 HIS C C 101 173.500 176.390 -2.890 1
1 1238 . 3 1 1 A 101 101 HIS CA C 101 55.410 59.633 -4.223 1
1 1239 . 3 1 1 A 101 101 HIS CB C 101 28.870 30.154 -1.284 1
1 1240 . 3 1 1 A 101 101 HIS N N 101 120.300 123.501 -3.201 1
1 10 . 4 1 1 A 2 2 TYR H H 2 8.688 7.030 1.658 1
1 11 . 4 1 1 A 2 2 TYR HA H 2 4.737 4.196 0.541 1
1 16 . 4 1 1 A 2 2 TYR C C 2 175.900 176.308 -0.408 1
1 17 . 4 1 1 A 2 2 TYR CA C 2 57.920 60.333 -2.413 1
1 18 . 4 1 1 A 2 2 TYR CB C 2 38.340 38.640 -0.300 1
1 19 . 4 1 1 A 2 2 TYR N N 2 122.100 123.657 -1.557 1
1 20 . 4 1 1 A 3 3 GLY H H 3 8.434 8.355 0.079 1
1 21 . 4 1 1 A 3 3 GLY HA2 H 3 3.909 4.049 -0.140 1
1 22 . 4 1 1 A 3 3 GLY HA3 H 3 3.841 4.079 -0.238 1
1 23 . 4 1 1 A 3 3 GLY C C 3 174.300 176.134 -1.834 1
1 24 . 4 1 1 A 3 3 GLY CA C 3 46.050 45.499 0.551 1
1 25 . 4 1 1 A 3 3 GLY N N 3 111.100 108.181 2.919 1
1 26 . 4 1 1 A 4 4 LYS H H 4 8.060 8.422 -0.362 1
1 27 . 4 1 1 A 4 4 LYS HA H 4 4.297 4.078 0.219 1
1 36 . 4 1 1 A 4 4 LYS C C 4 178.000 178.883 -0.883 1
1 37 . 4 1 1 A 4 4 LYS CA C 4 56.930 59.454 -2.524 1
1 38 . 4 1 1 A 4 4 LYS CB C 4 32.680 32.421 0.259 1
1 42 . 4 1 1 A 4 4 LYS N N 4 119.500 121.253 -1.753 1
1 43 . 4 1 1 A 5 5 LEU H H 5 8.243 8.281 -0.038 1
1 44 . 4 1 1 A 5 5 LEU HA H 5 3.947 3.943 0.004 1
1 54 . 4 1 1 A 5 5 LEU C C 5 177.900 178.680 -0.780 1
1 55 . 4 1 1 A 5 5 LEU CA C 5 57.930 57.875 0.055 1
1 56 . 4 1 1 A 5 5 LEU CB C 5 41.620 41.788 -0.168 1
1 60 . 4 1 1 A 5 5 LEU N N 5 120.800 120.766 0.034 1
1 61 . 4 1 1 A 6 6 ASN H H 6 8.256 8.519 -0.263 1
1 62 . 4 1 1 A 6 6 ASN HA H 6 4.252 4.340 -0.088 1
1 67 . 4 1 1 A 6 6 ASN C C 6 177.300 177.354 -0.054 1
1 68 . 4 1 1 A 6 6 ASN CA C 6 56.900 55.949 0.951 1
1 69 . 4 1 1 A 6 6 ASN CB C 6 38.200 37.775 0.425 1
1 70 . 4 1 1 A 6 6 ASN N N 6 116.200 117.845 -1.645 1
1 72 . 4 1 1 A 7 7 ASP H H 7 7.699 9.342 -1.643 1
1 73 . 4 1 1 A 7 7 ASP HA H 7 4.320 4.396 -0.076 1
1 76 . 4 1 1 A 7 7 ASP C C 7 178.000 178.602 -0.602 1
1 77 . 4 1 1 A 7 7 ASP CA C 7 56.980 57.522 -0.542 1
1 78 . 4 1 1 A 7 7 ASP CB C 7 39.870 41.100 -1.230 1
1 79 . 4 1 1 A 7 7 ASP N N 7 119.100 120.277 -1.177 1
1 80 . 4 1 1 A 8 8 LEU H H 8 7.580 8.589 -1.009 1
1 81 . 4 1 1 A 8 8 LEU HA H 8 4.091 4.104 -0.013 1
1 91 . 4 1 1 A 8 8 LEU C C 8 178.800 178.899 -0.099 1
1 92 . 4 1 1 A 8 8 LEU CA C 8 57.790 57.845 -0.055 1
1 93 . 4 1 1 A 8 8 LEU CB C 8 41.880 41.548 0.332 1
1 97 . 4 1 1 A 8 8 LEU N N 8 120.400 119.976 0.424 1
1 98 . 4 1 1 A 9 9 LEU H H 9 8.125 9.323 -1.198 1
1 99 . 4 1 1 A 9 9 LEU HA H 9 3.891 3.900 -0.009 1
1 109 . 4 1 1 A 9 9 LEU C C 9 178.900 178.503 0.397 1
1 110 . 4 1 1 A 9 9 LEU CA C 9 58.350 58.524 -0.174 1
1 111 . 4 1 1 A 9 9 LEU CB C 9 41.510 41.885 -0.375 1
1 115 . 4 1 1 A 9 9 LEU N N 9 118.900 120.191 -1.291 1
1 116 . 4 1 1 A 10 10 GLU H H 10 8.011 8.664 -0.653 1
1 117 . 4 1 1 A 10 10 GLU HA H 10 4.072 3.901 0.171 1
1 122 . 4 1 1 A 10 10 GLU C C 10 179.000 178.712 0.288 1
1 123 . 4 1 1 A 10 10 GLU CA C 10 59.090 59.999 -0.909 1
1 124 . 4 1 1 A 10 10 GLU CB C 10 27.910 29.563 -1.653 1
1 126 . 4 1 1 A 10 10 GLU N N 10 119.300 118.588 0.712 1
1 127 . 4 1 1 A 11 11 ASP H H 11 8.128 7.817 0.311 1
1 128 . 4 1 1 A 11 11 ASP HA H 11 4.383 4.350 0.033 1
1 131 . 4 1 1 A 11 11 ASP C C 11 178.500 178.788 -0.288 1
1 132 . 4 1 1 A 11 11 ASP CA C 11 56.580 57.317 -0.737 1
1 133 . 4 1 1 A 11 11 ASP CB C 11 38.600 40.644 -2.044 1
1 134 . 4 1 1 A 11 11 ASP N N 11 119.600 120.116 -0.516 1
1 135 . 4 1 1 A 12 12 LEU H H 12 8.394 8.344 0.050 1
1 136 . 4 1 1 A 12 12 LEU HA H 12 3.923 4.041 -0.118 1
1 146 . 4 1 1 A 12 12 LEU C C 12 178.200 178.418 -0.218 1
1 147 . 4 1 1 A 12 12 LEU CA C 12 57.880 58.357 -0.477 1
1 148 . 4 1 1 A 12 12 LEU CB C 12 41.850 41.689 0.161 1
1 152 . 4 1 1 A 12 12 LEU N N 12 120.500 121.441 -0.941 1
1 153 . 4 1 1 A 13 13 GLN H H 13 8.371 9.252 -0.881 1
1 154 . 4 1 1 A 13 13 GLN HA H 13 3.879 4.098 -0.219 1
1 161 . 4 1 1 A 13 13 GLN C C 13 178.600 177.829 0.771 1
1 162 . 4 1 1 A 13 13 GLN CA C 13 59.570 57.558 2.012 1
1 163 . 4 1 1 A 13 13 GLN CB C 13 28.440 27.035 1.405 1
1 165 . 4 1 1 A 13 13 GLN N N 13 118.400 116.910 1.490 1
1 167 . 4 1 1 A 14 14 GLU H H 14 7.913 7.663 0.250 1
1 168 . 4 1 1 A 14 14 GLU HA H 14 4.021 4.122 -0.101 1
1 173 . 4 1 1 A 14 14 GLU C C 14 179.000 178.697 0.303 1
1 174 . 4 1 1 A 14 14 GLU CA C 14 59.030 58.634 0.396 1
1 175 . 4 1 1 A 14 14 GLU CB C 14 28.720 30.015 -1.295 1
1 177 . 4 1 1 A 14 14 GLU N N 14 119.100 120.243 -1.143 1
1 178 . 4 1 1 A 15 15 VAL H H 15 7.991 8.186 -0.195 1
1 179 . 4 1 1 A 15 15 VAL HA H 15 3.696 3.892 -0.196 1
1 187 . 4 1 1 A 15 15 VAL C C 15 178.300 177.796 0.504 1
1 188 . 4 1 1 A 15 15 VAL CA C 15 66.640 65.462 1.178 1
1 189 . 4 1 1 A 15 15 VAL CB C 15 31.470 31.547 -0.077 1
1 192 . 4 1 1 A 15 15 VAL N N 15 120.300 118.897 1.403 1
1 193 . 4 1 1 A 16 16 LEU H H 16 8.172 7.851 0.321 1
1 194 . 4 1 1 A 16 16 LEU HA H 16 3.876 4.129 -0.253 1
1 204 . 4 1 1 A 16 16 LEU C C 16 178.400 178.553 -0.153 1
1 205 . 4 1 1 A 16 16 LEU CA C 16 58.050 58.294 -0.244 1
1 206 . 4 1 1 A 16 16 LEU CB C 16 41.420 41.587 -0.167 1
1 210 . 4 1 1 A 16 16 LEU N N 16 119.700 124.111 -4.411 1
1 211 . 4 1 1 A 17 17 LYS H H 17 7.755 9.073 -1.318 1
1 212 . 4 1 1 A 17 17 LYS HA H 17 3.951 3.944 0.007 1
1 221 . 4 1 1 A 17 17 LYS C C 17 178.800 178.785 0.015 1
1 222 . 4 1 1 A 17 17 LYS CA C 17 59.470 58.972 0.498 1
1 223 . 4 1 1 A 17 17 LYS CB C 17 32.350 32.310 0.040 1
1 227 . 4 1 1 A 17 17 LYS N N 17 117.800 119.551 -1.751 1
1 228 . 4 1 1 A 18 18 HIS H H 18 7.847 7.868 -0.021 1
1 229 . 4 1 1 A 18 18 HIS HA H 18 4.549 4.366 0.183 1
1 233 . 4 1 1 A 18 18 HIS C C 18 177.200 176.056 1.144 1
1 234 . 4 1 1 A 18 18 HIS CA C 18 57.870 57.550 0.320 1
1 235 . 4 1 1 A 18 18 HIS CB C 18 28.730 28.692 0.038 1
1 236 . 4 1 1 A 18 18 HIS N N 18 116.200 116.682 -0.482 1
1 237 . 4 1 1 A 19 19 VAL H H 19 8.415 7.555 0.860 1
1 238 . 4 1 1 A 19 19 VAL HA H 19 3.746 4.163 -0.417 1
1 246 . 4 1 1 A 19 19 VAL CA C 19 65.850 63.402 2.448 1
1 247 . 4 1 1 A 19 19 VAL CB C 19 31.600 33.368 -1.768 1
1 250 . 4 1 1 A 20 20 ASN H H 20 8.041 8.211 -0.170 1
1 251 . 4 1 1 A 20 20 ASN HA H 20 4.545 4.515 0.030 1
1 256 . 4 1 1 A 20 20 ASN C C 20 176.900 176.984 -0.084 1
1 257 . 4 1 1 A 20 20 ASN CA C 20 55.070 56.697 -1.627 1
1 258 . 4 1 1 A 20 20 ASN CB C 20 38.270 39.577 -1.307 1
1 259 . 4 1 1 A 20 20 ASN N N 20 117.900 119.674 -1.774 1
1 261 . 4 1 1 A 21 21 GLN H H 21 7.887 7.846 0.041 1
1 262 . 4 1 1 A 21 21 GLN HA H 21 4.096 4.487 -0.391 1
1 269 . 4 1 1 A 21 21 GLN C C 21 176.900 178.334 -1.434 1
1 270 . 4 1 1 A 21 21 GLN CA C 21 57.510 57.957 -0.447 1
1 271 . 4 1 1 A 21 21 GLN CB C 21 29.100 29.918 -0.818 1
1 273 . 4 1 1 A 21 21 GLN N N 21 117.900 117.225 0.675 1
1 275 . 4 1 1 A 22 22 HIS H H 22 7.887 8.095 -0.208 1
1 276 . 4 1 1 A 22 22 HIS HA H 22 4.679 4.674 0.005 1
1 280 . 4 1 1 A 22 22 HIS C C 22 174.300 175.545 -1.245 1
1 281 . 4 1 1 A 22 22 HIS CA C 22 55.770 57.657 -1.887 1
1 282 . 4 1 1 A 22 22 HIS CB C 22 28.630 29.099 -0.469 1
1 283 . 4 1 1 A 22 22 HIS N N 22 116.100 116.670 -0.570 1
1 284 . 4 1 1 A 23 23 TRP H H 23 7.929 7.735 0.194 1
1 285 . 4 1 1 A 23 23 TRP HA H 23 4.542 4.533 0.009 1
1 292 . 4 1 1 A 23 23 TRP C C 23 176.600 175.669 0.931 1
1 293 . 4 1 1 A 23 23 TRP CA C 23 58.020 58.655 -0.635 1
1 294 . 4 1 1 A 23 23 TRP CB C 23 29.700 30.370 -0.670 1
1 295 . 4 1 1 A 23 23 TRP N N 23 122.000 123.628 -1.628 1
1 297 . 4 1 1 A 24 24 GLN H H 24 8.258 8.445 -0.187 1
1 298 . 4 1 1 A 24 24 GLN HA H 24 4.329 4.689 -0.360 1
1 305 . 4 1 1 A 24 24 GLN C C 24 176.200 175.253 0.947 1
1 306 . 4 1 1 A 24 24 GLN CA C 24 55.960 54.635 1.325 1
1 307 . 4 1 1 A 24 24 GLN CB C 24 29.440 31.053 -1.613 1
1 309 . 4 1 1 A 24 24 GLN N N 24 123.800 125.320 -1.520 1
1 311 . 4 1 1 A 25 25 GLY H H 25 7.470 8.677 -1.207 1
1 312 . 4 1 1 A 25 25 GLY HA2 H 25 3.939 3.852 0.087 1
1 313 . 4 1 1 A 25 25 GLY HA3 H 25 3.800 3.853 -0.053 1
1 314 . 4 1 1 A 25 25 GLY C C 25 174.800 174.868 -0.068 1
1 315 . 4 1 1 A 25 25 GLY CA C 25 45.470 47.311 -1.841 1
1 316 . 4 1 1 A 25 25 GLY N N 25 108.100 108.966 -0.866 1
1 317 . 4 1 1 A 26 26 GLY H H 26 8.332 9.079 -0.747 1
1 318 . 4 1 1 A 26 26 GLY HA2 H 26 4.105 4.275 -0.170 1
1 319 . 4 1 1 A 26 26 GLY HA3 H 26 3.974 4.304 -0.330 1
1 320 . 4 1 1 A 26 26 GLY C C 26 174.900 174.297 0.603 1
1 321 . 4 1 1 A 26 26 GLY CA C 26 45.410 45.092 0.318 1
1 322 . 4 1 1 A 26 26 GLY N N 26 108.700 109.828 -1.128 1
1 323 . 4 1 1 A 27 27 GLN H H 27 8.474 8.873 -0.399 1
1 324 . 4 1 1 A 27 27 GLN HA H 27 4.106 4.160 -0.054 1
1 331 . 4 1 1 A 27 27 GLN C C 27 177.100 177.187 -0.087 1
1 332 . 4 1 1 A 27 27 GLN CA C 27 57.540 57.486 0.054 1
1 333 . 4 1 1 A 27 27 GLN CB C 27 29.050 28.839 0.211 1
1 335 . 4 1 1 A 27 27 GLN N N 27 121.100 124.877 -3.777 1
1 337 . 4 1 1 A 28 28 LYS H H 28 8.448 8.173 0.275 1
1 338 . 4 1 1 A 28 28 LYS HA H 28 4.068 3.979 0.089 1
1 347 . 4 1 1 A 28 28 LYS C C 28 177.900 178.775 -0.875 1
1 348 . 4 1 1 A 28 28 LYS CA C 28 58.410 59.168 -0.758 1
1 349 . 4 1 1 A 28 28 LYS CB C 28 32.210 32.270 -0.060 1
1 353 . 4 1 1 A 28 28 LYS N N 28 120.500 117.713 2.787 1
1 354 . 4 1 1 A 29 29 ASN H H 29 8.273 8.135 0.138 1
1 355 . 4 1 1 A 29 29 ASN HA H 29 4.584 4.315 0.269 1
1 360 . 4 1 1 A 29 29 ASN C C 29 176.200 177.536 -1.336 1
1 361 . 4 1 1 A 29 29 ASN CA C 29 54.400 56.274 -1.874 1
1 362 . 4 1 1 A 29 29 ASN CB C 29 38.280 37.864 0.416 1
1 363 . 4 1 1 A 29 29 ASN N N 29 117.500 118.407 -0.907 1
1 365 . 4 1 1 A 30 30 MET H H 30 7.870 7.567 0.303 1
1 366 . 4 1 1 A 30 30 MET HA H 30 4.085 2.940 1.145 1
1 371 . 4 1 1 A 30 30 MET C C 30 177.000 177.179 -0.179 1
1 372 . 4 1 1 A 30 30 MET CA C 30 56.880 57.559 -0.679 1
1 373 . 4 1 1 A 30 30 MET CB C 30 32.340 31.824 0.516 1
1 375 . 4 1 1 A 30 30 MET N N 30 121.100 119.060 2.040 1
1 376 . 4 1 1 A 31 31 ASN H H 31 8.186 7.736 0.450 1
1 377 . 4 1 1 A 31 31 ASN HA H 31 4.311 4.566 -0.255 1
1 382 . 4 1 1 A 31 31 ASN C C 31 176.700 177.236 -0.536 1
1 383 . 4 1 1 A 31 31 ASN CA C 31 55.320 54.597 0.723 1
1 384 . 4 1 1 A 31 31 ASN CB C 31 38.410 39.299 -0.889 1
1 385 . 4 1 1 A 31 31 ASN N N 31 117.900 115.654 2.246 1
1 387 . 4 1 1 A 32 32 LYS H H 32 7.792 7.429 0.363 1
1 388 . 4 1 1 A 32 32 LYS HA H 32 3.992 3.819 0.173 1
1 397 . 4 1 1 A 32 32 LYS C C 32 177.900 177.932 -0.032 1
1 398 . 4 1 1 A 32 32 LYS CA C 32 59.050 57.934 1.116 1
1 399 . 4 1 1 A 32 32 LYS CB C 32 32.460 31.904 0.556 1
1 403 . 4 1 1 A 32 32 LYS N N 32 120.400 119.079 1.321 1
1 404 . 4 1 1 A 33 33 VAL H H 33 7.689 8.264 -0.575 1
1 405 . 4 1 1 A 33 33 VAL HA H 33 3.791 3.658 0.133 1
1 413 . 4 1 1 A 33 33 VAL C C 33 177.100 177.436 -0.336 1
1 414 . 4 1 1 A 33 33 VAL CA C 33 65.360 64.457 0.903 1
1 415 . 4 1 1 A 33 33 VAL CB C 33 31.920 31.747 0.173 1
1 418 . 4 1 1 A 33 33 VAL N N 33 120.200 116.461 3.739 1
1 419 . 4 1 1 A 34 34 ASP H H 34 8.408 7.871 0.537 1
1 420 . 4 1 1 A 34 34 ASP HA H 34 4.303 4.268 0.035 1
1 423 . 4 1 1 A 34 34 ASP C C 34 178.200 178.592 -0.392 1
1 424 . 4 1 1 A 34 34 ASP CA C 34 55.880 57.105 -1.225 1
1 425 . 4 1 1 A 34 34 ASP CB C 34 38.710 41.612 -2.902 1
1 426 . 4 1 1 A 34 34 ASP N N 34 120.100 121.996 -1.896 1
1 427 . 4 1 1 A 35 35 HIS H H 35 8.204 7.619 0.585 1
1 428 . 4 1 1 A 35 35 HIS HA H 35 4.343 4.201 0.142 1
1 431 . 4 1 1 A 35 35 HIS C C 35 176.800 177.583 -0.783 1
1 432 . 4 1 1 A 35 35 HIS CA C 35 58.310 60.091 -1.781 1
1 433 . 4 1 1 A 35 35 HIS CB C 35 28.070 30.048 -1.978 1
1 434 . 4 1 1 A 35 35 HIS N N 35 118.200 118.047 0.153 1
1 435 . 4 1 1 A 36 36 HIS H H 36 8.067 8.081 -0.014 1
1 436 . 4 1 1 A 36 36 HIS HA H 36 4.602 4.137 0.465 1
1 440 . 4 1 1 A 36 36 HIS C C 36 177.100 177.688 -0.588 1
1 441 . 4 1 1 A 36 36 HIS CA C 36 58.520 59.478 -0.958 1
1 442 . 4 1 1 A 36 36 HIS CB C 36 28.720 30.149 -1.429 1
1 443 . 4 1 1 A 36 36 HIS N N 36 117.100 117.160 -0.060 1
1 444 . 4 1 1 A 37 37 LEU H H 37 8.473 8.505 -0.032 1
1 445 . 4 1 1 A 37 37 LEU HA H 37 3.894 3.696 0.198 1
1 455 . 4 1 1 A 37 37 LEU C C 37 178.200 178.721 -0.521 1
1 456 . 4 1 1 A 37 37 LEU CA C 37 58.520 58.239 0.281 1
1 457 . 4 1 1 A 37 37 LEU CB C 37 41.810 41.532 0.278 1
1 461 . 4 1 1 A 37 37 LEU N N 37 119.600 119.684 -0.084 1
1 462 . 4 1 1 A 38 38 GLN H H 38 8.337 8.581 -0.244 1
1 463 . 4 1 1 A 38 38 GLN HA H 38 3.882 3.990 -0.108 1
1 470 . 4 1 1 A 38 38 GLN C C 38 178.500 177.897 0.603 1
1 471 . 4 1 1 A 38 38 GLN CA C 38 59.200 59.293 -0.093 1
1 472 . 4 1 1 A 38 38 GLN CB C 38 27.850 28.197 -0.347 1
1 474 . 4 1 1 A 38 38 GLN N N 38 118.000 116.902 1.098 1
1 476 . 4 1 1 A 39 39 ASN H H 39 7.923 7.609 0.314 1
1 477 . 4 1 1 A 39 39 ASN HA H 39 4.390 4.506 -0.116 1
1 482 . 4 1 1 A 39 39 ASN C C 39 177.500 178.034 -0.534 1
1 483 . 4 1 1 A 39 39 ASN CA C 39 55.780 55.797 -0.017 1
1 484 . 4 1 1 A 39 39 ASN CB C 39 37.450 38.393 -0.943 1
1 485 . 4 1 1 A 39 39 ASN N N 39 118.700 117.607 1.093 1
1 487 . 4 1 1 A 40 40 VAL H H 40 7.907 8.427 -0.520 1
1 488 . 4 1 1 A 40 40 VAL HA H 40 3.629 3.604 0.025 1
1 496 . 4 1 1 A 40 40 VAL C C 40 177.500 177.859 -0.359 1
1 497 . 4 1 1 A 40 40 VAL CA C 40 67.080 66.504 0.576 1
1 498 . 4 1 1 A 40 40 VAL CB C 40 31.390 31.639 -0.249 1
1 501 . 4 1 1 A 40 40 VAL N N 40 120.400 119.483 0.917 1
1 502 . 4 1 1 A 41 41 ILE H H 41 8.103 7.856 0.247 1
1 503 . 4 1 1 A 41 41 ILE HA H 41 3.401 3.643 -0.242 1
1 513 . 4 1 1 A 41 41 ILE C C 41 178.000 178.505 -0.505 1
1 514 . 4 1 1 A 41 41 ILE CA C 41 66.430 65.396 1.034 1
1 515 . 4 1 1 A 41 41 ILE CB C 41 38.050 37.698 0.352 1
1 519 . 4 1 1 A 41 41 ILE N N 41 120.600 119.616 0.984 1
1 520 . 4 1 1 A 42 42 GLU H H 42 8.150 8.019 0.131 1
1 521 . 4 1 1 A 42 42 GLU HA H 42 4.062 4.115 -0.053 1
1 526 . 4 1 1 A 42 42 GLU C C 42 178.500 178.327 0.173 1
1 527 . 4 1 1 A 42 42 GLU CA C 42 59.120 59.309 -0.189 1
1 528 . 4 1 1 A 42 42 GLU CB C 42 28.160 29.139 -0.979 1
1 530 . 4 1 1 A 42 42 GLU N N 42 119.900 121.356 -1.456 1
1 531 . 4 1 1 A 43 43 ASP H H 43 8.453 9.276 -0.823 1
1 532 . 4 1 1 A 43 43 ASP HA H 43 4.445 4.430 0.015 1
1 535 . 4 1 1 A 43 43 ASP C C 43 178.400 178.730 -0.330 1
1 536 . 4 1 1 A 43 43 ASP CA C 43 56.490 58.072 -1.582 1
1 537 . 4 1 1 A 43 43 ASP CB C 43 37.820 41.746 -3.926 1
1 538 . 4 1 1 A 43 43 ASP N N 43 119.700 120.074 -0.374 1
1 539 . 4 1 1 A 44 44 ILE H H 44 8.544 7.637 0.907 1
1 540 . 4 1 1 A 44 44 ILE HA H 44 3.590 3.692 -0.102 1
1 550 . 4 1 1 A 44 44 ILE C C 44 177.800 178.384 -0.584 1
1 551 . 4 1 1 A 44 44 ILE CA C 44 66.320 65.524 0.796 1
1 552 . 4 1 1 A 44 44 ILE CB C 44 37.690 37.763 -0.073 1
1 556 . 4 1 1 A 44 44 ILE N N 44 121.500 119.724 1.776 1
1 557 . 4 1 1 A 45 45 HIS H H 45 8.261 8.343 -0.082 1
1 558 . 4 1 1 A 45 45 HIS HA H 45 4.255 4.483 -0.228 1
1 562 . 4 1 1 A 45 45 HIS C C 45 177.200 176.681 0.519 1
1 563 . 4 1 1 A 45 45 HIS CA C 45 59.580 58.824 0.756 1
1 564 . 4 1 1 A 45 45 HIS CB C 45 27.790 29.688 -1.898 1
1 565 . 4 1 1 A 45 45 HIS N N 45 118.800 118.883 -0.083 1
1 566 . 4 1 1 A 46 46 ASP H H 46 8.680 8.210 0.470 1
1 567 . 4 1 1 A 46 46 ASP HA H 46 4.338 4.526 -0.188 1
1 570 . 4 1 1 A 46 46 ASP C C 46 178.700 177.924 0.776 1
1 571 . 4 1 1 A 46 46 ASP CA C 46 57.010 55.224 1.786 1
1 572 . 4 1 1 A 46 46 ASP CB C 46 39.400 41.078 -1.678 1
1 573 . 4 1 1 A 46 46 ASP N N 46 119.200 119.086 0.114 1
1 574 . 4 1 1 A 47 47 PHE H H 47 8.380 9.546 -1.166 1
1 575 . 4 1 1 A 47 47 PHE HA H 47 4.070 4.218 -0.148 1
1 580 . 4 1 1 A 47 47 PHE C C 47 178.600 177.658 0.942 1
1 581 . 4 1 1 A 47 47 PHE CA C 47 61.250 60.056 1.194 1
1 582 . 4 1 1 A 47 47 PHE CB C 47 39.570 39.944 -0.374 1
1 583 . 4 1 1 A 47 47 PHE N N 47 121.800 121.721 0.079 1
1 584 . 4 1 1 A 48 48 MET H H 48 8.366 8.200 0.166 1
1 585 . 4 1 1 A 48 48 MET HA H 48 3.998 4.361 -0.363 1
1 590 . 4 1 1 A 48 48 MET C C 48 177.400 177.897 -0.497 1
1 591 . 4 1 1 A 48 48 MET CA C 48 58.470 59.220 -0.750 1
1 592 . 4 1 1 A 48 48 MET CB C 48 33.170 33.449 -0.279 1
1 594 . 4 1 1 A 48 48 MET N N 48 117.700 117.807 -0.107 1
1 595 . 4 1 1 A 49 49 GLN H H 49 7.659 8.278 -0.619 1
1 596 . 4 1 1 A 49 49 GLN HA H 49 4.258 4.047 0.211 1
1 603 . 4 1 1 A 49 49 GLN C C 49 176.700 178.333 -1.633 1
1 604 . 4 1 1 A 49 49 GLN CA C 49 56.380 58.502 -2.122 1
1 605 . 4 1 1 A 49 49 GLN CB C 49 28.980 28.300 0.680 1
1 607 . 4 1 1 A 49 49 GLN N N 49 116.700 117.720 -1.020 1
1 609 . 4 1 1 A 50 50 GLY H H 50 7.685 8.475 -0.790 1
1 610 . 4 1 1 A 50 50 GLY HA2 H 50 3.998 3.815 0.183 1
1 611 . 4 1 1 A 50 50 GLY HA3 H 50 3.998 3.838 0.160 1
1 612 . 4 1 1 A 50 50 GLY C C 50 174.900 175.362 -0.462 1
1 613 . 4 1 1 A 50 50 GLY CA C 50 45.460 46.080 -0.620 1
1 614 . 4 1 1 A 50 50 GLY N N 50 106.400 108.773 -2.373 1
1 615 . 4 1 1 A 51 51 GLY H H 51 8.031 8.943 -0.912 1
1 616 . 4 1 1 A 51 51 GLY HA2 H 51 3.817 3.758 0.059 1
1 617 . 4 1 1 A 51 51 GLY HA3 H 51 3.817 3.805 0.012 1
1 618 . 4 1 1 A 51 51 GLY C C 51 174.500 174.204 0.296 1
1 619 . 4 1 1 A 51 51 GLY CA C 51 45.190 45.445 -0.255 1
1 620 . 4 1 1 A 51 51 GLY N N 51 108.900 109.497 -0.597 1
1 621 . 4 1 1 A 52 52 GLY H H 52 8.126 8.689 -0.563 1
1 622 . 4 1 1 A 52 52 GLY HA2 H 52 3.362 3.654 -0.292 1
1 623 . 4 1 1 A 52 52 GLY HA3 H 52 3.362 4.009 -0.647 1
1 624 . 4 1 1 A 52 52 GLY C C 52 173.300 174.316 -1.016 1
1 625 . 4 1 1 A 52 52 GLY CA C 52 45.120 45.268 -0.148 1
1 626 . 4 1 1 A 52 52 GLY N N 52 108.100 107.643 0.457 1
1 627 . 4 1 1 A 53 53 SER H H 53 7.594 8.133 -0.539 1
1 628 . 4 1 1 A 53 53 SER HA H 53 4.530 4.671 -0.141 1
1 631 . 4 1 1 A 53 53 SER C C 53 175.300 175.436 -0.136 1
1 632 . 4 1 1 A 53 53 SER CA C 53 57.770 57.996 -0.226 1
1 633 . 4 1 1 A 53 53 SER CB C 53 64.750 61.906 2.844 1
1 634 . 4 1 1 A 53 53 SER N N 53 114.100 115.000 -0.900 1
1 635 . 4 1 1 A 54 54 GLY H H 54 9.003 8.686 0.317 1
1 636 . 4 1 1 A 54 54 GLY HA2 H 54 4.037 4.060 -0.023 1
1 637 . 4 1 1 A 54 54 GLY HA3 H 54 3.911 4.187 -0.276 1
1 638 . 4 1 1 A 54 54 GLY C C 54 176.500 175.450 1.050 1
1 639 . 4 1 1 A 54 54 GLY CA C 54 47.040 47.153 -0.113 1
1 640 . 4 1 1 A 54 54 GLY N N 54 110.400 110.538 -0.138 1
1 641 . 4 1 1 A 55 55 GLY H H 55 8.617 8.305 0.312 1
1 642 . 4 1 1 A 55 55 GLY HA2 H 55 3.946 3.939 0.007 1
1 643 . 4 1 1 A 55 55 GLY HA3 H 55 3.946 3.947 -0.001 1
1 644 . 4 1 1 A 55 55 GLY C C 55 176.400 175.601 0.799 1
1 645 . 4 1 1 A 55 55 GLY CA C 55 46.630 46.702 -0.072 1
1 646 . 4 1 1 A 55 55 GLY N N 55 109.800 109.463 0.337 1
1 647 . 4 1 1 A 56 56 LYS H H 56 7.876 8.956 -1.080 1
1 648 . 4 1 1 A 56 56 LYS HA H 56 4.195 4.229 -0.034 1
1 657 . 4 1 1 A 56 56 LYS C C 56 178.600 178.983 -0.383 1
1 658 . 4 1 1 A 56 56 LYS CA C 56 57.960 58.787 -0.827 1
1 659 . 4 1 1 A 56 56 LYS CB C 56 32.110 32.151 -0.041 1
1 663 . 4 1 1 A 56 56 LYS N N 56 121.800 122.095 -0.295 1
1 664 . 4 1 1 A 57 57 LEU H H 57 8.153 8.108 0.045 1
1 665 . 4 1 1 A 57 57 LEU HA H 57 3.992 4.111 -0.119 1
1 675 . 4 1 1 A 57 57 LEU C C 57 178.400 178.817 -0.417 1
1 676 . 4 1 1 A 57 57 LEU CA C 57 58.190 58.257 -0.067 1
1 677 . 4 1 1 A 57 57 LEU CB C 57 41.360 41.973 -0.613 1
1 681 . 4 1 1 A 57 57 LEU N N 57 120.700 122.440 -1.740 1
1 682 . 4 1 1 A 58 58 GLN H H 58 8.019 8.445 -0.426 1
1 683 . 4 1 1 A 58 58 GLN HA H 58 3.942 4.106 -0.164 1
1 690 . 4 1 1 A 58 58 GLN C C 58 179.100 178.296 0.804 1
1 691 . 4 1 1 A 58 58 GLN CA C 58 59.360 58.148 1.212 1
1 692 . 4 1 1 A 58 58 GLN CB C 58 28.030 28.427 -0.397 1
1 694 . 4 1 1 A 58 58 GLN N N 58 117.400 117.400 0.000 1
1 696 . 4 1 1 A 59 59 GLU H H 59 7.838 7.938 -0.100 1
1 697 . 4 1 1 A 59 59 GLU HA H 59 4.030 4.091 -0.061 1
1 702 . 4 1 1 A 59 59 GLU C C 59 178.600 178.906 -0.306 1
1 703 . 4 1 1 A 59 59 GLU CA C 59 59.250 58.933 0.317 1
1 704 . 4 1 1 A 59 59 GLU CB C 59 28.960 29.783 -0.823 1
1 706 . 4 1 1 A 59 59 GLU N N 59 119.900 120.265 -0.365 1
1 707 . 4 1 1 A 60 60 MET H H 60 8.223 8.161 0.062 1
1 708 . 4 1 1 A 60 60 MET HA H 60 3.966 4.223 -0.257 1
1 713 . 4 1 1 A 60 60 MET C C 60 177.900 178.436 -0.536 1
1 714 . 4 1 1 A 60 60 MET CA C 60 59.350 58.070 1.280 1
1 715 . 4 1 1 A 60 60 MET CB C 60 33.210 32.422 0.788 1
1 717 . 4 1 1 A 60 60 MET N N 60 120.100 118.781 1.319 1
1 718 . 4 1 1 A 61 61 MET H H 61 8.134 8.163 -0.029 1
1 719 . 4 1 1 A 61 61 MET HA H 61 4.195 4.145 0.050 1
1 724 . 4 1 1 A 61 61 MET C C 61 179.100 178.326 0.774 1
1 725 . 4 1 1 A 61 61 MET CA C 61 58.210 59.008 -0.798 1
1 726 . 4 1 1 A 61 61 MET CB C 61 31.340 32.158 -0.818 1
1 728 . 4 1 1 A 61 61 MET N N 61 117.000 119.236 -2.236 1
1 729 . 4 1 1 A 62 62 LYS H H 62 7.782 7.815 -0.033 1
1 730 . 4 1 1 A 62 62 LYS HA H 62 4.085 4.022 0.063 1
1 739 . 4 1 1 A 62 62 LYS C C 62 179.600 178.683 0.917 1
1 740 . 4 1 1 A 62 62 LYS CA C 62 59.610 60.117 -0.507 1
1 741 . 4 1 1 A 62 62 LYS CB C 62 32.180 32.501 -0.321 1
1 745 . 4 1 1 A 62 62 LYS N N 62 120.600 119.176 1.424 1
1 746 . 4 1 1 A 63 63 GLU H H 63 8.041 8.158 -0.117 1
1 747 . 4 1 1 A 63 63 GLU HA H 63 4.057 3.983 0.074 1
1 752 . 4 1 1 A 63 63 GLU C C 63 178.900 178.426 0.474 1
1 753 . 4 1 1 A 63 63 GLU CA C 63 59.170 59.569 -0.399 1
1 754 . 4 1 1 A 63 63 GLU CB C 63 29.000 29.405 -0.405 1
1 756 . 4 1 1 A 63 63 GLU N N 63 120.200 119.550 0.650 1
1 757 . 4 1 1 A 64 64 PHE H H 64 8.604 8.675 -0.071 1
1 758 . 4 1 1 A 64 64 PHE HA H 64 4.155 3.840 0.315 1
1 763 . 4 1 1 A 64 64 PHE C C 64 177.800 177.942 -0.142 1
1 764 . 4 1 1 A 64 64 PHE CA C 64 59.820 61.683 -1.863 1
1 765 . 4 1 1 A 64 64 PHE CB C 64 38.470 38.746 -0.276 1
1 766 . 4 1 1 A 64 64 PHE N N 64 119.700 121.066 -1.366 1
1 767 . 4 1 1 A 65 65 GLN H H 65 8.177 8.225 -0.048 1
1 768 . 4 1 1 A 65 65 GLN HA H 65 3.637 4.591 -0.954 1
1 775 . 4 1 1 A 65 65 GLN C C 65 177.800 178.236 -0.436 1
1 776 . 4 1 1 A 65 65 GLN CA C 65 58.970 58.420 0.550 1
1 777 . 4 1 1 A 65 65 GLN CB C 65 28.280 28.680 -0.400 1
1 779 . 4 1 1 A 65 65 GLN N N 65 118.500 119.538 -1.038 1
1 781 . 4 1 1 A 66 66 GLN H H 66 7.622 8.938 -1.316 1
1 782 . 4 1 1 A 66 66 GLN HA H 66 4.040 4.281 -0.241 1
1 789 . 4 1 1 A 66 66 GLN C C 66 178.600 178.303 0.297 1
1 790 . 4 1 1 A 66 66 GLN CA C 66 59.150 58.331 0.819 1
1 791 . 4 1 1 A 66 66 GLN CB C 66 28.230 28.350 -0.120 1
1 793 . 4 1 1 A 66 66 GLN N N 66 117.400 118.692 -1.292 1
1 795 . 4 1 1 A 67 67 VAL H H 67 7.744 7.569 0.175 1
1 796 . 4 1 1 A 67 67 VAL HA H 67 3.785 3.774 0.011 1
1 804 . 4 1 1 A 67 67 VAL C C 67 177.500 177.699 -0.199 1
1 805 . 4 1 1 A 67 67 VAL CA C 67 66.220 66.240 -0.020 1
1 806 . 4 1 1 A 67 67 VAL CB C 67 31.390 31.805 -0.415 1
1 809 . 4 1 1 A 67 67 VAL N N 67 119.500 121.022 -1.522 1
1 810 . 4 1 1 A 68 68 LEU H H 68 7.983 7.825 0.158 1
1 811 . 4 1 1 A 68 68 LEU HA H 68 3.825 4.073 -0.248 1
1 821 . 4 1 1 A 68 68 LEU C C 68 179.100 178.313 0.787 1
1 822 . 4 1 1 A 68 68 LEU CA C 68 58.740 58.287 0.453 1
1 823 . 4 1 1 A 68 68 LEU CB C 68 41.090 42.052 -0.962 1
1 827 . 4 1 1 A 68 68 LEU N N 68 120.400 120.347 0.053 1
1 828 . 4 1 1 A 69 69 ASP H H 69 8.179 8.422 -0.243 1
1 829 . 4 1 1 A 69 69 ASP HA H 69 4.380 4.333 0.047 1
1 832 . 4 1 1 A 69 69 ASP C C 69 178.900 178.531 0.369 1
1 833 . 4 1 1 A 69 69 ASP CA C 69 57.320 57.673 -0.353 1
1 834 . 4 1 1 A 69 69 ASP CB C 69 40.040 40.951 -0.911 1
1 835 . 4 1 1 A 69 69 ASP N N 69 119.000 118.490 0.510 1
1 836 . 4 1 1 A 70 70 GLU H H 70 8.166 8.083 0.083 1
1 837 . 4 1 1 A 70 70 GLU HA H 70 4.082 4.071 0.011 1
1 842 . 4 1 1 A 70 70 GLU C C 70 179.600 179.398 0.202 1
1 843 . 4 1 1 A 70 70 GLU CA C 70 59.010 59.238 -0.228 1
1 844 . 4 1 1 A 70 70 GLU CB C 70 28.900 29.586 -0.686 1
1 846 . 4 1 1 A 70 70 GLU N N 70 120.500 118.574 1.926 1
1 847 . 4 1 1 A 71 71 ILE H H 71 8.415 8.310 0.105 1
1 848 . 4 1 1 A 71 71 ILE HA H 71 3.790 3.436 0.354 1
1 858 . 4 1 1 A 71 71 ILE C C 71 177.400 177.442 -0.042 1
1 859 . 4 1 1 A 71 71 ILE CA C 71 64.890 65.081 -0.191 1
1 860 . 4 1 1 A 71 71 ILE CB C 71 37.680 37.155 0.525 1
1 864 . 4 1 1 A 71 71 ILE N N 71 119.200 121.074 -1.874 1
1 865 . 4 1 1 A 72 72 LYS H H 72 8.248 7.771 0.477 1
1 866 . 4 1 1 A 72 72 LYS HA H 72 3.625 3.374 0.251 1
1 873 . 4 1 1 A 72 72 LYS C C 72 178.400 179.296 -0.896 1
1 874 . 4 1 1 A 72 72 LYS CA C 72 59.850 59.510 0.340 1
1 875 . 4 1 1 A 72 72 LYS CB C 72 32.070 32.166 -0.096 1
1 879 . 4 1 1 A 72 72 LYS N N 72 120.800 121.435 -0.635 1
1 880 . 4 1 1 A 73 73 GLN H H 73 7.937 7.632 0.305 1
1 881 . 4 1 1 A 73 73 GLN HA H 73 4.042 4.027 0.015 1
1 888 . 4 1 1 A 73 73 GLN C C 73 178.400 178.848 -0.448 1
1 889 . 4 1 1 A 73 73 GLN CA C 73 58.510 58.684 -0.174 1
1 890 . 4 1 1 A 73 73 GLN CB C 73 28.430 28.641 -0.211 1
1 892 . 4 1 1 A 73 73 GLN N N 73 117.000 117.896 -0.896 1
1 894 . 4 1 1 A 74 74 GLN H H 74 7.712 7.573 0.139 1
1 895 . 4 1 1 A 74 74 GLN HA H 74 4.080 3.939 0.141 1
1 902 . 4 1 1 A 74 74 GLN C C 74 177.800 178.822 -1.022 1
1 903 . 4 1 1 A 74 74 GLN CA C 74 57.270 58.524 -1.254 1
1 904 . 4 1 1 A 74 74 GLN CB C 74 28.700 28.011 0.689 1
1 906 . 4 1 1 A 74 74 GLN N N 74 118.200 119.632 -1.432 1
1 908 . 4 1 1 A 75 75 LEU H H 75 7.956 7.676 0.280 1
1 909 . 4 1 1 A 75 75 LEU HA H 75 4.212 3.906 0.306 1
1 919 . 4 1 1 A 75 75 LEU CA C 75 56.660 56.861 -0.201 1
1 920 . 4 1 1 A 75 75 LEU CB C 75 42.000 41.481 0.519 1
1 924 . 4 1 1 A 75 75 LEU N N 75 120.700 120.020 0.680 1
1 925 . 4 1 1 A 76 76 GLN H H 76 8.315 7.608 0.707 1
1 926 . 4 1 1 A 76 76 GLN HA H 76 4.113 4.421 -0.308 1
1 933 . 4 1 1 A 76 76 GLN C C 76 177.100 175.194 1.906 1
1 934 . 4 1 1 A 76 76 GLN CA C 76 57.400 55.674 1.726 1
1 935 . 4 1 1 A 76 76 GLN CB C 76 28.640 26.842 1.798 1
1 937 . 4 1 1 A 76 76 GLN N N 76 120.100 116.531 3.569 1
1 939 . 4 1 1 A 77 77 GLY H H 77 8.021 7.622 0.399 1
1 940 . 4 1 1 A 77 77 GLY HA2 H 77 4.042 4.156 -0.114 1
1 941 . 4 1 1 A 77 77 GLY HA3 H 77 3.869 4.161 -0.292 1
1 942 . 4 1 1 A 77 77 GLY C C 77 174.600 173.551 1.049 1
1 943 . 4 1 1 A 77 77 GLY CA C 77 45.430 45.705 -0.275 1
1 944 . 4 1 1 A 77 77 GLY N N 77 107.700 109.025 -1.325 1
1 945 . 4 1 1 A 78 78 GLY H H 78 7.819 8.916 -1.097 1
1 946 . 4 1 1 A 78 78 GLY HA2 H 78 4.208 3.859 0.349 1
1 947 . 4 1 1 A 78 78 GLY HA3 H 78 3.801 3.861 -0.060 1
1 948 . 4 1 1 A 78 78 GLY C C 78 173.900 174.229 -0.329 1
1 949 . 4 1 1 A 78 78 GLY CA C 78 45.140 46.118 -0.978 1
1 950 . 4 1 1 A 78 78 GLY N N 78 107.100 109.458 -2.358 1
1 951 . 4 1 1 A 79 79 ASP H H 79 7.912 8.220 -0.308 1
1 952 . 4 1 1 A 79 79 ASP HA H 79 4.722 4.834 -0.112 1
1 955 . 4 1 1 A 79 79 ASP C C 79 176.200 176.772 -0.572 1
1 956 . 4 1 1 A 79 79 ASP CA C 79 53.210 54.073 -0.863 1
1 957 . 4 1 1 A 79 79 ASP CB C 79 40.160 41.237 -1.077 1
1 958 . 4 1 1 A 79 79 ASP N N 79 119.800 118.034 1.766 1
1 959 . 4 1 1 A 80 80 ASN H H 80 8.450 8.392 0.058 1
1 960 . 4 1 1 A 80 80 ASN HA H 80 4.593 4.538 0.055 1
1 965 . 4 1 1 A 80 80 ASN C C 80 177.300 177.100 0.200 1
1 966 . 4 1 1 A 80 80 ASN CA C 80 54.680 54.815 -0.135 1
1 967 . 4 1 1 A 80 80 ASN CB C 80 38.790 37.248 1.542 1
1 968 . 4 1 1 A 80 80 ASN N N 80 121.700 119.282 2.418 1
1 970 . 4 1 1 A 81 81 SER H H 81 8.444 8.006 0.438 1
1 971 . 4 1 1 A 81 81 SER HA H 81 4.263 4.326 -0.063 1
1 974 . 4 1 1 A 81 81 SER C C 81 176.100 176.520 -0.420 1
1 975 . 4 1 1 A 81 81 SER CA C 81 61.470 62.086 -0.616 1
1 976 . 4 1 1 A 81 81 SER CB C 81 61.470 63.347 -1.877 1
1 977 . 4 1 1 A 81 81 SER N N 81 117.100 117.114 -0.014 1
1 978 . 4 1 1 A 82 82 LEU H H 82 7.929 8.255 -0.326 1
1 979 . 4 1 1 A 82 82 LEU HA H 82 4.332 4.018 0.314 1
1 989 . 4 1 1 A 82 82 LEU C C 82 177.400 179.295 -1.895 1
1 990 . 4 1 1 A 82 82 LEU CA C 82 55.060 57.888 -2.828 1
1 991 . 4 1 1 A 82 82 LEU CB C 82 41.940 41.505 0.435 1
1 995 . 4 1 1 A 82 82 LEU N N 82 120.400 120.942 -0.542 1
1 996 . 4 1 1 A 83 83 HIS H H 83 8.014 7.894 0.120 1
1 997 . 4 1 1 A 83 83 HIS HA H 83 4.173 4.230 -0.057 1
1 1000 . 4 1 1 A 83 83 HIS C C 83 176.100 176.975 -0.875 1
1 1001 . 4 1 1 A 83 83 HIS CA C 83 59.940 59.855 0.085 1
1 1002 . 4 1 1 A 83 83 HIS CB C 83 28.050 30.091 -2.041 1
1 1003 . 4 1 1 A 83 83 HIS N N 83 119.400 118.407 0.993 1
1 1004 . 4 1 1 A 84 84 ASN H H 84 8.598 8.348 0.250 1
1 1005 . 4 1 1 A 84 84 ASN HA H 84 4.735 4.758 -0.023 1
1 1010 . 4 1 1 A 84 84 ASN C C 84 177.400 177.257 0.143 1
1 1011 . 4 1 1 A 84 84 ASN CA C 84 55.790 55.188 0.602 1
1 1012 . 4 1 1 A 84 84 ASN CB C 84 37.520 39.239 -1.719 1
1 1013 . 4 1 1 A 84 84 ASN N N 84 118.100 117.924 0.176 1
1 1015 . 4 1 1 A 85 85 VAL H H 85 7.933 7.617 0.316 1
1 1016 . 4 1 1 A 85 85 VAL HA H 85 3.849 3.847 0.002 1
1 1024 . 4 1 1 A 85 85 VAL C C 85 177.100 177.964 -0.864 1
1 1025 . 4 1 1 A 85 85 VAL CA C 85 65.490 65.383 0.107 1
1 1026 . 4 1 1 A 85 85 VAL CB C 85 31.760 32.058 -0.298 1
1 1029 . 4 1 1 A 85 85 VAL N N 85 120.500 119.848 0.652 1
1 1030 . 4 1 1 A 86 86 HIS H H 86 8.460 9.455 -0.995 1
1 1031 . 4 1 1 A 86 86 HIS HA H 86 4.054 4.041 0.013 1
1 1035 . 4 1 1 A 86 86 HIS C C 86 176.300 177.384 -1.084 1
1 1036 . 4 1 1 A 86 86 HIS CA C 86 59.860 59.494 0.366 1
1 1037 . 4 1 1 A 86 86 HIS CB C 86 29.670 30.038 -0.368 1
1 1038 . 4 1 1 A 86 86 HIS N N 86 119.300 119.265 0.035 1
1 1039 . 4 1 1 A 87 87 GLU H H 87 7.897 7.783 0.114 1
1 1040 . 4 1 1 A 87 87 GLU HA H 87 3.838 3.726 0.112 1
1 1045 . 4 1 1 A 87 87 GLU C C 87 178.300 179.152 -0.852 1
1 1046 . 4 1 1 A 87 87 GLU CA C 87 58.690 58.859 -0.169 1
1 1047 . 4 1 1 A 87 87 GLU CB C 87 28.460 29.276 -0.816 1
1 1049 . 4 1 1 A 87 87 GLU N N 87 117.100 118.796 -1.696 1
1 1050 . 4 1 1 A 88 88 ASN H H 88 8.103 8.709 -0.606 1
1 1051 . 4 1 1 A 88 88 ASN HA H 88 4.503 4.574 -0.071 1
1 1056 . 4 1 1 A 88 88 ASN C C 88 177.700 177.987 -0.287 1
1 1057 . 4 1 1 A 88 88 ASN CA C 88 55.990 56.019 -0.029 1
1 1058 . 4 1 1 A 88 88 ASN CB C 88 39.010 38.567 0.443 1
1 1059 . 4 1 1 A 88 88 ASN N N 88 118.400 117.144 1.256 1
1 1061 . 4 1 1 A 89 89 ILE H H 89 8.501 8.055 0.446 1
1 1062 . 4 1 1 A 89 89 ILE HA H 89 3.670 3.746 -0.076 1
1 1072 . 4 1 1 A 89 89 ILE C C 89 177.000 178.294 -1.294 1
1 1073 . 4 1 1 A 89 89 ILE CA C 89 65.390 65.472 -0.082 1
1 1074 . 4 1 1 A 89 89 ILE CB C 89 37.440 37.632 -0.192 1
1 1078 . 4 1 1 A 89 89 ILE N N 89 118.700 119.966 -1.266 1
1 1079 . 4 1 1 A 90 90 LYS H H 90 8.017 8.028 -0.011 1
1 1080 . 4 1 1 A 90 90 LYS HA H 90 3.775 4.095 -0.320 1
1 1089 . 4 1 1 A 90 90 LYS C C 90 178.800 179.085 -0.285 1
1 1090 . 4 1 1 A 90 90 LYS CA C 90 60.450 59.890 0.560 1
1 1091 . 4 1 1 A 90 90 LYS CB C 90 32.110 32.544 -0.434 1
1 1095 . 4 1 1 A 90 90 LYS N N 90 120.900 120.714 0.186 1
1 1096 . 4 1 1 A 91 91 GLU H H 91 7.732 7.731 0.001 1
1 1097 . 4 1 1 A 91 91 GLU HA H 91 4.083 3.913 0.170 1
1 1102 . 4 1 1 A 91 91 GLU C C 91 179.100 179.022 0.078 1
1 1103 . 4 1 1 A 91 91 GLU CA C 91 59.120 58.864 0.256 1
1 1104 . 4 1 1 A 91 91 GLU CB C 91 28.810 29.182 -0.372 1
1 1106 . 4 1 1 A 91 91 GLU N N 91 119.300 117.854 1.446 1
1 1107 . 4 1 1 A 92 92 ILE H H 92 8.110 9.200 -1.090 1
1 1108 . 4 1 1 A 92 92 ILE HA H 92 3.685 3.965 -0.280 1
1 1118 . 4 1 1 A 92 92 ILE C C 92 178.000 178.811 -0.811 1
1 1119 . 4 1 1 A 92 92 ILE CA C 92 65.900 64.427 1.473 1
1 1120 . 4 1 1 A 92 92 ILE CB C 92 38.400 37.663 0.737 1
1 1124 . 4 1 1 A 92 92 ILE N N 92 121.100 120.180 0.920 1
1 1125 . 4 1 1 A 93 93 PHE H H 93 8.651 8.168 0.483 1
1 1126 . 4 1 1 A 93 93 PHE HA H 93 3.873 3.307 0.566 1
1 1133 . 4 1 1 A 93 93 PHE C C 93 177.100 177.810 -0.710 1
1 1134 . 4 1 1 A 93 93 PHE CA C 93 61.020 61.206 -0.186 1
1 1135 . 4 1 1 A 93 93 PHE CB C 93 38.560 38.947 -0.387 1
1 1138 . 4 1 1 A 93 93 PHE N N 93 119.400 123.271 -3.871 1
1 1139 . 4 1 1 A 94 94 HIS H H 94 8.126 7.597 0.529 1
1 1140 . 4 1 1 A 94 94 HIS HA H 94 4.368 4.197 0.171 1
1 1145 . 4 1 1 A 94 94 HIS C C 94 177.100 176.317 0.783 1
1 1146 . 4 1 1 A 94 94 HIS CA C 94 58.310 57.877 0.433 1
1 1147 . 4 1 1 A 94 94 HIS CB C 94 27.910 29.317 -1.407 1
1 1148 . 4 1 1 A 94 94 HIS N N 94 116.400 118.303 -1.903 1
1 1149 . 4 1 1 A 95 95 HIS H H 95 8.058 7.789 0.269 1
1 1150 . 4 1 1 A 95 95 HIS HA H 95 4.465 4.420 0.045 1
1 1154 . 4 1 1 A 95 95 HIS C C 95 177.300 176.948 0.352 1
1 1155 . 4 1 1 A 95 95 HIS CA C 95 57.900 59.294 -1.394 1
1 1156 . 4 1 1 A 95 95 HIS CB C 95 28.490 30.609 -2.119 1
1 1157 . 4 1 1 A 95 95 HIS N N 95 117.000 115.876 1.124 1
1 1158 . 4 1 1 A 96 96 LEU H H 96 8.525 8.003 0.522 1
1 1159 . 4 1 1 A 96 96 LEU HA H 96 3.865 4.059 -0.194 1
1 1169 . 4 1 1 A 96 96 LEU C C 96 178.300 178.221 0.079 1
1 1170 . 4 1 1 A 96 96 LEU CA C 96 58.250 57.353 0.897 1
1 1171 . 4 1 1 A 96 96 LEU CB C 96 41.720 41.884 -0.164 1
1 1175 . 4 1 1 A 96 96 LEU N N 96 121.300 121.451 -0.151 1
1 1176 . 4 1 1 A 97 97 GLU H H 97 8.076 7.910 0.166 1
1 1177 . 4 1 1 A 97 97 GLU HA H 97 3.719 4.009 -0.290 1
1 1182 . 4 1 1 A 97 97 GLU C C 97 178.300 178.695 -0.395 1
1 1183 . 4 1 1 A 97 97 GLU CA C 97 59.300 58.549 0.751 1
1 1184 . 4 1 1 A 97 97 GLU CB C 97 28.960 29.528 -0.568 1
1 1186 . 4 1 1 A 97 97 GLU N N 97 117.100 119.124 -2.024 1
1 1187 . 4 1 1 A 98 98 GLU H H 98 7.329 7.843 -0.514 1
1 1188 . 4 1 1 A 98 98 GLU HA H 98 4.024 4.178 -0.154 1
1 1193 . 4 1 1 A 98 98 GLU C C 98 177.900 178.359 -0.459 1
1 1194 . 4 1 1 A 98 98 GLU CA C 98 58.190 58.673 -0.483 1
1 1195 . 4 1 1 A 98 98 GLU CB C 98 29.120 29.644 -0.524 1
1 1197 . 4 1 1 A 98 98 GLU N N 98 116.000 119.254 -3.254 1
1 1198 . 4 1 1 A 99 99 LEU H H 99 7.535 8.796 -1.261 1
1 1199 . 4 1 1 A 99 99 LEU HA H 99 4.183 4.227 -0.044 1
1 1209 . 4 1 1 A 99 99 LEU C C 99 178.100 177.602 0.498 1
1 1210 . 4 1 1 A 99 99 LEU CA C 99 56.440 55.258 1.182 1
1 1211 . 4 1 1 A 99 99 LEU CB C 99 43.010 41.611 1.399 1
1 1215 . 4 1 1 A 99 99 LEU N N 99 118.200 118.266 -0.066 1
1 1216 . 4 1 1 A 100 100 VAL H H 100 7.561 7.398 0.163 1
1 1217 . 4 1 1 A 100 100 VAL HA H 100 4.033 4.565 -0.532 1
1 1225 . 4 1 1 A 100 100 VAL C C 100 175.400 177.842 -2.442 1
1 1226 . 4 1 1 A 100 100 VAL CA C 100 62.430 62.422 0.008 1
1 1227 . 4 1 1 A 100 100 VAL CB C 100 32.050 33.289 -1.239 1
1 1230 . 4 1 1 A 100 100 VAL N N 100 114.800 114.367 0.433 1
1 1231 . 4 1 1 A 101 101 HIS H H 101 7.827 8.017 -0.190 1
1 1232 . 4 1 1 A 101 101 HIS HA H 101 4.630 4.168 0.462 1
1 1237 . 4 1 1 A 101 101 HIS C C 101 173.500 176.319 -2.819 1
1 1238 . 4 1 1 A 101 101 HIS CA C 101 55.410 59.311 -3.901 1
1 1239 . 4 1 1 A 101 101 HIS CB C 101 28.870 29.908 -1.038 1
1 1240 . 4 1 1 A 101 101 HIS N N 101 120.300 123.261 -2.961 1
1 10 . 5 1 1 A 2 2 TYR H H 2 8.688 7.463 1.225 1
1 11 . 5 1 1 A 2 2 TYR HA H 2 4.737 4.287 0.450 1
1 16 . 5 1 1 A 2 2 TYR C C 2 175.900 176.308 -0.408 1
1 17 . 5 1 1 A 2 2 TYR CA C 2 57.920 60.250 -2.330 1
1 18 . 5 1 1 A 2 2 TYR CB C 2 38.340 39.147 -0.807 1
1 19 . 5 1 1 A 2 2 TYR N N 2 122.100 125.364 -3.264 1
1 20 . 5 1 1 A 3 3 GLY H H 3 8.434 8.322 0.112 1
1 21 . 5 1 1 A 3 3 GLY HA2 H 3 3.909 4.006 -0.097 1
1 22 . 5 1 1 A 3 3 GLY HA3 H 3 3.841 4.029 -0.188 1
1 23 . 5 1 1 A 3 3 GLY C C 3 174.300 175.143 -0.843 1
1 24 . 5 1 1 A 3 3 GLY CA C 3 46.050 45.353 0.697 1
1 25 . 5 1 1 A 3 3 GLY N N 3 111.100 108.538 2.562 1
1 26 . 5 1 1 A 4 4 LYS H H 4 8.060 8.223 -0.163 1
1 27 . 5 1 1 A 4 4 LYS HA H 4 4.297 4.001 0.296 1
1 36 . 5 1 1 A 4 4 LYS C C 4 178.000 178.685 -0.685 1
1 37 . 5 1 1 A 4 4 LYS CA C 4 56.930 58.982 -2.052 1
1 38 . 5 1 1 A 4 4 LYS CB C 4 32.680 32.176 0.504 1
1 42 . 5 1 1 A 4 4 LYS N N 4 119.500 122.770 -3.270 1
1 43 . 5 1 1 A 5 5 LEU H H 5 8.243 8.156 0.087 1
1 44 . 5 1 1 A 5 5 LEU HA H 5 3.947 3.838 0.109 1
1 54 . 5 1 1 A 5 5 LEU C C 5 177.900 179.127 -1.227 1
1 55 . 5 1 1 A 5 5 LEU CA C 5 57.930 57.767 0.163 1
1 56 . 5 1 1 A 5 5 LEU CB C 5 41.620 41.611 0.009 1
1 60 . 5 1 1 A 5 5 LEU N N 5 120.800 119.988 0.812 1
1 61 . 5 1 1 A 6 6 ASN H H 6 8.256 8.007 0.249 1
1 62 . 5 1 1 A 6 6 ASN HA H 6 4.252 4.437 -0.185 1
1 67 . 5 1 1 A 6 6 ASN C C 6 177.300 177.736 -0.436 1
1 68 . 5 1 1 A 6 6 ASN CA C 6 56.900 56.534 0.366 1
1 69 . 5 1 1 A 6 6 ASN CB C 6 38.200 38.365 -0.165 1
1 70 . 5 1 1 A 6 6 ASN N N 6 116.200 117.615 -1.415 1
1 72 . 5 1 1 A 7 7 ASP H H 7 7.699 9.477 -1.778 1
1 73 . 5 1 1 A 7 7 ASP HA H 7 4.320 4.366 -0.046 1
1 76 . 5 1 1 A 7 7 ASP C C 7 178.000 177.851 0.149 1
1 77 . 5 1 1 A 7 7 ASP CA C 7 56.980 57.254 -0.274 1
1 78 . 5 1 1 A 7 7 ASP CB C 7 39.870 41.313 -1.443 1
1 79 . 5 1 1 A 7 7 ASP N N 7 119.100 119.299 -0.199 1
1 80 . 5 1 1 A 8 8 LEU H H 8 7.580 8.205 -0.625 1
1 81 . 5 1 1 A 8 8 LEU HA H 8 4.091 4.124 -0.033 1
1 91 . 5 1 1 A 8 8 LEU C C 8 178.800 179.111 -0.311 1
1 92 . 5 1 1 A 8 8 LEU CA C 8 57.790 57.597 0.193 1
1 93 . 5 1 1 A 8 8 LEU CB C 8 41.880 41.671 0.209 1
1 97 . 5 1 1 A 8 8 LEU N N 8 120.400 118.787 1.613 1
1 98 . 5 1 1 A 9 9 LEU H H 9 8.125 9.526 -1.401 1
1 99 . 5 1 1 A 9 9 LEU HA H 9 3.891 4.004 -0.113 1
1 109 . 5 1 1 A 9 9 LEU C C 9 178.900 178.384 0.516 1
1 110 . 5 1 1 A 9 9 LEU CA C 9 58.350 58.569 -0.219 1
1 111 . 5 1 1 A 9 9 LEU CB C 9 41.510 41.919 -0.409 1
1 115 . 5 1 1 A 9 9 LEU N N 9 118.900 120.071 -1.171 1
1 116 . 5 1 1 A 10 10 GLU H H 10 8.011 8.698 -0.687 1
1 117 . 5 1 1 A 10 10 GLU HA H 10 4.072 4.285 -0.213 1
1 122 . 5 1 1 A 10 10 GLU C C 10 179.000 178.216 0.784 1
1 123 . 5 1 1 A 10 10 GLU CA C 10 59.090 59.099 -0.009 1
1 124 . 5 1 1 A 10 10 GLU CB C 10 27.910 29.212 -1.302 1
1 126 . 5 1 1 A 10 10 GLU N N 10 119.300 117.531 1.769 1
1 127 . 5 1 1 A 11 11 ASP H H 11 8.128 7.552 0.576 1
1 128 . 5 1 1 A 11 11 ASP HA H 11 4.383 4.532 -0.149 1
1 131 . 5 1 1 A 11 11 ASP C C 11 178.500 178.659 -0.159 1
1 132 . 5 1 1 A 11 11 ASP CA C 11 56.580 57.406 -0.826 1
1 133 . 5 1 1 A 11 11 ASP CB C 11 38.600 40.818 -2.218 1
1 134 . 5 1 1 A 11 11 ASP N N 11 119.600 120.161 -0.561 1
1 135 . 5 1 1 A 12 12 LEU H H 12 8.394 8.767 -0.373 1
1 136 . 5 1 1 A 12 12 LEU HA H 12 3.923 4.202 -0.279 1
1 146 . 5 1 1 A 12 12 LEU C C 12 178.200 178.685 -0.485 1
1 147 . 5 1 1 A 12 12 LEU CA C 12 57.880 58.164 -0.284 1
1 148 . 5 1 1 A 12 12 LEU CB C 12 41.850 41.896 -0.046 1
1 152 . 5 1 1 A 12 12 LEU N N 12 120.500 120.934 -0.434 1
1 153 . 5 1 1 A 13 13 GLN H H 13 8.371 8.887 -0.516 1
1 154 . 5 1 1 A 13 13 GLN HA H 13 3.879 4.114 -0.235 1
1 161 . 5 1 1 A 13 13 GLN C C 13 178.600 178.140 0.460 1
1 162 . 5 1 1 A 13 13 GLN CA C 13 59.570 58.093 1.477 1
1 163 . 5 1 1 A 13 13 GLN CB C 13 28.440 27.366 1.074 1
1 165 . 5 1 1 A 13 13 GLN N N 13 118.400 117.638 0.762 1
1 167 . 5 1 1 A 14 14 GLU H H 14 7.913 7.597 0.316 1
1 168 . 5 1 1 A 14 14 GLU HA H 14 4.021 4.191 -0.170 1
1 173 . 5 1 1 A 14 14 GLU C C 14 179.000 178.950 0.050 1
1 174 . 5 1 1 A 14 14 GLU CA C 14 59.030 59.021 0.009 1
1 175 . 5 1 1 A 14 14 GLU CB C 14 28.720 30.044 -1.324 1
1 177 . 5 1 1 A 14 14 GLU N N 14 119.100 119.544 -0.444 1
1 178 . 5 1 1 A 15 15 VAL H H 15 7.991 7.890 0.101 1
1 179 . 5 1 1 A 15 15 VAL HA H 15 3.696 3.907 -0.211 1
1 187 . 5 1 1 A 15 15 VAL C C 15 178.300 177.921 0.379 1
1 188 . 5 1 1 A 15 15 VAL CA C 15 66.640 65.640 1.000 1
1 189 . 5 1 1 A 15 15 VAL CB C 15 31.470 31.597 -0.127 1
1 192 . 5 1 1 A 15 15 VAL N N 15 120.300 117.813 2.487 1
1 193 . 5 1 1 A 16 16 LEU H H 16 8.172 8.013 0.159 1
1 194 . 5 1 1 A 16 16 LEU HA H 16 3.876 4.115 -0.239 1
1 204 . 5 1 1 A 16 16 LEU C C 16 178.400 178.371 0.029 1
1 205 . 5 1 1 A 16 16 LEU CA C 16 58.050 58.510 -0.460 1
1 206 . 5 1 1 A 16 16 LEU CB C 16 41.420 41.895 -0.475 1
1 210 . 5 1 1 A 16 16 LEU N N 16 119.700 124.823 -5.123 1
1 211 . 5 1 1 A 17 17 LYS H H 17 7.755 8.663 -0.908 1
1 212 . 5 1 1 A 17 17 LYS HA H 17 3.951 4.118 -0.167 1
1 221 . 5 1 1 A 17 17 LYS C C 17 178.800 177.749 1.051 1
1 222 . 5 1 1 A 17 17 LYS CA C 17 59.470 58.342 1.128 1
1 223 . 5 1 1 A 17 17 LYS CB C 17 32.350 32.362 -0.012 1
1 227 . 5 1 1 A 17 17 LYS N N 17 117.800 119.162 -1.362 1
1 228 . 5 1 1 A 18 18 HIS H H 18 7.847 7.978 -0.131 1
1 229 . 5 1 1 A 18 18 HIS HA H 18 4.549 4.714 -0.165 1
1 233 . 5 1 1 A 18 18 HIS C C 18 177.200 176.602 0.598 1
1 234 . 5 1 1 A 18 18 HIS CA C 18 57.870 55.664 2.206 1
1 235 . 5 1 1 A 18 18 HIS CB C 18 28.730 30.085 -1.355 1
1 236 . 5 1 1 A 18 18 HIS N N 18 116.200 117.366 -1.166 1
1 237 . 5 1 1 A 19 19 VAL H H 19 8.415 7.487 0.928 1
1 238 . 5 1 1 A 19 19 VAL HA H 19 3.746 4.011 -0.265 1
1 246 . 5 1 1 A 19 19 VAL CA C 19 65.850 65.351 0.499 1
1 247 . 5 1 1 A 19 19 VAL CB C 19 31.600 32.314 -0.714 1
1 250 . 5 1 1 A 20 20 ASN H H 20 8.041 8.062 -0.021 1
1 251 . 5 1 1 A 20 20 ASN HA H 20 4.545 4.544 0.001 1
1 256 . 5 1 1 A 20 20 ASN C C 20 176.900 176.918 -0.018 1
1 257 . 5 1 1 A 20 20 ASN CA C 20 55.070 55.862 -0.792 1
1 258 . 5 1 1 A 20 20 ASN CB C 20 38.270 37.653 0.617 1
1 259 . 5 1 1 A 20 20 ASN N N 20 117.900 118.749 -0.849 1
1 261 . 5 1 1 A 21 21 GLN H H 21 7.887 8.229 -0.342 1
1 262 . 5 1 1 A 21 21 GLN HA H 21 4.096 4.184 -0.088 1
1 269 . 5 1 1 A 21 21 GLN C C 21 176.900 176.755 0.145 1
1 270 . 5 1 1 A 21 21 GLN CA C 21 57.510 56.903 0.607 1
1 271 . 5 1 1 A 21 21 GLN CB C 21 29.100 28.736 0.364 1
1 273 . 5 1 1 A 21 21 GLN N N 21 117.900 117.119 0.781 1
1 275 . 5 1 1 A 22 22 HIS H H 22 7.887 9.066 -1.179 1
1 276 . 5 1 1 A 22 22 HIS HA H 22 4.679 4.931 -0.252 1
1 280 . 5 1 1 A 22 22 HIS C C 22 174.300 174.694 -0.394 1
1 281 . 5 1 1 A 22 22 HIS CA C 22 55.770 55.892 -0.122 1
1 282 . 5 1 1 A 22 22 HIS CB C 22 28.630 30.768 -2.138 1
1 283 . 5 1 1 A 22 22 HIS N N 22 116.100 114.878 1.222 1
1 284 . 5 1 1 A 23 23 TRP H H 23 7.929 7.838 0.091 1
1 285 . 5 1 1 A 23 23 TRP HA H 23 4.542 4.644 -0.102 1
1 292 . 5 1 1 A 23 23 TRP C C 23 176.600 175.486 1.114 1
1 293 . 5 1 1 A 23 23 TRP CA C 23 58.020 58.389 -0.369 1
1 294 . 5 1 1 A 23 23 TRP CB C 23 29.700 30.527 -0.827 1
1 295 . 5 1 1 A 23 23 TRP N N 23 122.000 123.717 -1.717 1
1 297 . 5 1 1 A 24 24 GLN H H 24 8.258 8.230 0.028 1
1 298 . 5 1 1 A 24 24 GLN HA H 24 4.329 4.727 -0.398 1
1 305 . 5 1 1 A 24 24 GLN C C 24 176.200 175.628 0.572 1
1 306 . 5 1 1 A 24 24 GLN CA C 24 55.960 54.717 1.243 1
1 307 . 5 1 1 A 24 24 GLN CB C 24 29.440 31.328 -1.888 1
1 309 . 5 1 1 A 24 24 GLN N N 24 123.800 126.193 -2.393 1
1 311 . 5 1 1 A 25 25 GLY H H 25 7.470 8.724 -1.254 1
1 312 . 5 1 1 A 25 25 GLY HA2 H 25 3.939 3.878 0.061 1
1 313 . 5 1 1 A 25 25 GLY HA3 H 25 3.800 3.888 -0.088 1
1 314 . 5 1 1 A 25 25 GLY C C 25 174.800 174.905 -0.105 1
1 315 . 5 1 1 A 25 25 GLY CA C 25 45.470 47.244 -1.774 1
1 316 . 5 1 1 A 25 25 GLY N N 25 108.100 108.683 -0.583 1
1 317 . 5 1 1 A 26 26 GLY H H 26 8.332 8.663 -0.331 1
1 318 . 5 1 1 A 26 26 GLY HA2 H 26 4.105 4.250 -0.145 1
1 319 . 5 1 1 A 26 26 GLY HA3 H 26 3.974 4.272 -0.298 1
1 320 . 5 1 1 A 26 26 GLY C C 26 174.900 175.068 -0.168 1
1 321 . 5 1 1 A 26 26 GLY CA C 26 45.410 45.379 0.031 1
1 322 . 5 1 1 A 26 26 GLY N N 26 108.700 112.082 -3.382 1
1 323 . 5 1 1 A 27 27 GLN H H 27 8.474 8.775 -0.301 1
1 324 . 5 1 1 A 27 27 GLN HA H 27 4.106 4.031 0.075 1
1 331 . 5 1 1 A 27 27 GLN C C 27 177.100 176.037 1.063 1
1 332 . 5 1 1 A 27 27 GLN CA C 27 57.540 57.675 -0.135 1
1 333 . 5 1 1 A 27 27 GLN CB C 27 29.050 27.804 1.246 1
1 335 . 5 1 1 A 27 27 GLN N N 27 121.100 124.213 -3.113 1
1 337 . 5 1 1 A 28 28 LYS H H 28 8.448 8.235 0.213 1
1 338 . 5 1 1 A 28 28 LYS HA H 28 4.068 4.058 0.010 1
1 347 . 5 1 1 A 28 28 LYS C C 28 177.900 177.584 0.316 1
1 348 . 5 1 1 A 28 28 LYS CA C 28 58.410 58.401 0.009 1
1 349 . 5 1 1 A 28 28 LYS CB C 28 32.210 32.100 0.110 1
1 353 . 5 1 1 A 28 28 LYS N N 28 120.500 120.533 -0.033 1
1 354 . 5 1 1 A 29 29 ASN H H 29 8.273 8.236 0.037 1
1 355 . 5 1 1 A 29 29 ASN HA H 29 4.584 4.437 0.147 1
1 360 . 5 1 1 A 29 29 ASN C C 29 176.200 177.325 -1.125 1
1 361 . 5 1 1 A 29 29 ASN CA C 29 54.400 55.614 -1.214 1
1 362 . 5 1 1 A 29 29 ASN CB C 29 38.280 38.609 -0.329 1
1 363 . 5 1 1 A 29 29 ASN N N 29 117.500 117.216 0.284 1
1 365 . 5 1 1 A 30 30 MET H H 30 7.870 7.512 0.358 1
1 366 . 5 1 1 A 30 30 MET HA H 30 4.085 2.441 1.644 1
1 371 . 5 1 1 A 30 30 MET C C 30 177.000 177.615 -0.615 1
1 372 . 5 1 1 A 30 30 MET CA C 30 56.880 57.791 -0.911 1
1 373 . 5 1 1 A 30 30 MET CB C 30 32.340 31.274 1.066 1
1 375 . 5 1 1 A 30 30 MET N N 30 121.100 118.727 2.373 1
1 376 . 5 1 1 A 31 31 ASN H H 31 8.186 7.585 0.601 1
1 377 . 5 1 1 A 31 31 ASN HA H 31 4.311 4.412 -0.101 1
1 382 . 5 1 1 A 31 31 ASN C C 31 176.700 178.085 -1.385 1
1 383 . 5 1 1 A 31 31 ASN CA C 31 55.320 56.027 -0.707 1
1 384 . 5 1 1 A 31 31 ASN CB C 31 38.410 38.095 0.315 1
1 385 . 5 1 1 A 31 31 ASN N N 31 117.900 116.377 1.523 1
1 387 . 5 1 1 A 32 32 LYS H H 32 7.792 7.537 0.255 1
1 388 . 5 1 1 A 32 32 LYS HA H 32 3.992 3.960 0.032 1
1 397 . 5 1 1 A 32 32 LYS C C 32 177.900 179.323 -1.423 1
1 398 . 5 1 1 A 32 32 LYS CA C 32 59.050 59.434 -0.384 1
1 399 . 5 1 1 A 32 32 LYS CB C 32 32.460 32.280 0.180 1
1 403 . 5 1 1 A 32 32 LYS N N 32 120.400 119.469 0.931 1
1 404 . 5 1 1 A 33 33 VAL H H 33 7.689 8.168 -0.479 1
1 405 . 5 1 1 A 33 33 VAL HA H 33 3.791 3.805 -0.014 1
1 413 . 5 1 1 A 33 33 VAL C C 33 177.100 177.485 -0.385 1
1 414 . 5 1 1 A 33 33 VAL CA C 33 65.360 65.269 0.091 1
1 415 . 5 1 1 A 33 33 VAL CB C 33 31.920 31.674 0.246 1
1 418 . 5 1 1 A 33 33 VAL N N 33 120.200 115.337 4.863 1
1 419 . 5 1 1 A 34 34 ASP H H 34 8.408 8.195 0.213 1
1 420 . 5 1 1 A 34 34 ASP HA H 34 4.303 4.281 0.022 1
1 423 . 5 1 1 A 34 34 ASP C C 34 178.200 178.165 0.035 1
1 424 . 5 1 1 A 34 34 ASP CA C 34 55.880 57.077 -1.197 1
1 425 . 5 1 1 A 34 34 ASP CB C 34 38.710 41.285 -2.575 1
1 426 . 5 1 1 A 34 34 ASP N N 34 120.100 122.106 -2.006 1
1 427 . 5 1 1 A 35 35 HIS H H 35 8.204 7.549 0.655 1
1 428 . 5 1 1 A 35 35 HIS HA H 35 4.343 4.325 0.018 1
1 431 . 5 1 1 A 35 35 HIS C C 35 176.800 177.456 -0.656 1
1 432 . 5 1 1 A 35 35 HIS CA C 35 58.310 59.134 -0.824 1
1 433 . 5 1 1 A 35 35 HIS CB C 35 28.070 30.492 -2.422 1
1 434 . 5 1 1 A 35 35 HIS N N 35 118.200 119.254 -1.054 1
1 435 . 5 1 1 A 36 36 HIS H H 36 8.067 7.628 0.439 1
1 436 . 5 1 1 A 36 36 HIS HA H 36 4.602 3.956 0.646 1
1 440 . 5 1 1 A 36 36 HIS C C 36 177.100 177.701 -0.601 1
1 441 . 5 1 1 A 36 36 HIS CA C 36 58.520 59.060 -0.540 1
1 442 . 5 1 1 A 36 36 HIS CB C 36 28.720 30.090 -1.370 1
1 443 . 5 1 1 A 36 36 HIS N N 36 117.100 116.978 0.122 1
1 444 . 5 1 1 A 37 37 LEU H H 37 8.473 8.570 -0.097 1
1 445 . 5 1 1 A 37 37 LEU HA H 37 3.894 3.586 0.308 1
1 455 . 5 1 1 A 37 37 LEU C C 37 178.200 178.649 -0.449 1
1 456 . 5 1 1 A 37 37 LEU CA C 37 58.520 58.313 0.207 1
1 457 . 5 1 1 A 37 37 LEU CB C 37 41.810 41.708 0.102 1
1 461 . 5 1 1 A 37 37 LEU N N 37 119.600 119.993 -0.393 1
1 462 . 5 1 1 A 38 38 GLN H H 38 8.337 8.841 -0.504 1
1 463 . 5 1 1 A 38 38 GLN HA H 38 3.882 3.927 -0.045 1
1 470 . 5 1 1 A 38 38 GLN C C 38 178.500 177.886 0.614 1
1 471 . 5 1 1 A 38 38 GLN CA C 38 59.200 58.813 0.387 1
1 472 . 5 1 1 A 38 38 GLN CB C 38 27.850 28.675 -0.825 1
1 474 . 5 1 1 A 38 38 GLN N N 38 118.000 117.991 0.009 1
1 476 . 5 1 1 A 39 39 ASN H H 39 7.923 8.106 -0.183 1
1 477 . 5 1 1 A 39 39 ASN HA H 39 4.390 4.493 -0.103 1
1 482 . 5 1 1 A 39 39 ASN C C 39 177.500 177.729 -0.229 1
1 483 . 5 1 1 A 39 39 ASN CA C 39 55.780 55.704 0.076 1
1 484 . 5 1 1 A 39 39 ASN CB C 39 37.450 38.108 -0.658 1
1 485 . 5 1 1 A 39 39 ASN N N 39 118.700 117.669 1.031 1
1 487 . 5 1 1 A 40 40 VAL H H 40 7.907 8.254 -0.347 1
1 488 . 5 1 1 A 40 40 VAL HA H 40 3.629 3.551 0.078 1
1 496 . 5 1 1 A 40 40 VAL C C 40 177.500 177.667 -0.167 1
1 497 . 5 1 1 A 40 40 VAL CA C 40 67.080 66.197 0.883 1
1 498 . 5 1 1 A 40 40 VAL CB C 40 31.390 31.453 -0.063 1
1 501 . 5 1 1 A 40 40 VAL N N 40 120.400 118.931 1.469 1
1 502 . 5 1 1 A 41 41 ILE H H 41 8.103 8.032 0.071 1
1 503 . 5 1 1 A 41 41 ILE HA H 41 3.401 3.613 -0.212 1
1 513 . 5 1 1 A 41 41 ILE C C 41 178.000 178.301 -0.301 1
1 514 . 5 1 1 A 41 41 ILE CA C 41 66.430 65.448 0.982 1
1 515 . 5 1 1 A 41 41 ILE CB C 41 38.050 37.703 0.347 1
1 519 . 5 1 1 A 41 41 ILE N N 41 120.600 119.475 1.125 1
1 520 . 5 1 1 A 42 42 GLU H H 42 8.150 7.922 0.228 1
1 521 . 5 1 1 A 42 42 GLU HA H 42 4.062 4.074 -0.012 1
1 526 . 5 1 1 A 42 42 GLU C C 42 178.500 178.871 -0.371 1
1 527 . 5 1 1 A 42 42 GLU CA C 42 59.120 59.721 -0.601 1
1 528 . 5 1 1 A 42 42 GLU CB C 42 28.160 29.467 -1.307 1
1 530 . 5 1 1 A 42 42 GLU N N 42 119.900 120.792 -0.892 1
1 531 . 5 1 1 A 43 43 ASP H H 43 8.453 9.166 -0.713 1
1 532 . 5 1 1 A 43 43 ASP HA H 43 4.445 4.496 -0.051 1
1 535 . 5 1 1 A 43 43 ASP C C 43 178.400 178.698 -0.298 1
1 536 . 5 1 1 A 43 43 ASP CA C 43 56.490 57.425 -0.935 1
1 537 . 5 1 1 A 43 43 ASP CB C 43 37.820 41.363 -3.543 1
1 538 . 5 1 1 A 43 43 ASP N N 43 119.700 120.368 -0.668 1
1 539 . 5 1 1 A 44 44 ILE H H 44 8.544 7.835 0.709 1
1 540 . 5 1 1 A 44 44 ILE HA H 44 3.590 3.747 -0.157 1
1 550 . 5 1 1 A 44 44 ILE C C 44 177.800 178.045 -0.245 1
1 551 . 5 1 1 A 44 44 ILE CA C 44 66.320 65.467 0.853 1
1 552 . 5 1 1 A 44 44 ILE CB C 44 37.690 37.984 -0.294 1
1 556 . 5 1 1 A 44 44 ILE N N 44 121.500 119.827 1.673 1
1 557 . 5 1 1 A 45 45 HIS H H 45 8.261 8.478 -0.217 1
1 558 . 5 1 1 A 45 45 HIS HA H 45 4.255 4.144 0.111 1
1 562 . 5 1 1 A 45 45 HIS C C 45 177.200 176.123 1.077 1
1 563 . 5 1 1 A 45 45 HIS CA C 45 59.580 59.911 -0.331 1
1 564 . 5 1 1 A 45 45 HIS CB C 45 27.790 30.272 -2.482 1
1 565 . 5 1 1 A 45 45 HIS N N 45 118.800 119.694 -0.894 1
1 566 . 5 1 1 A 46 46 ASP H H 46 8.680 8.350 0.330 1
1 567 . 5 1 1 A 46 46 ASP HA H 46 4.338 4.568 -0.230 1
1 570 . 5 1 1 A 46 46 ASP C C 46 178.700 177.746 0.954 1
1 571 . 5 1 1 A 46 46 ASP CA C 46 57.010 55.081 1.929 1
1 572 . 5 1 1 A 46 46 ASP CB C 46 39.400 41.009 -1.609 1
1 573 . 5 1 1 A 46 46 ASP N N 46 119.200 119.014 0.186 1
1 574 . 5 1 1 A 47 47 PHE H H 47 8.380 9.353 -0.973 1
1 575 . 5 1 1 A 47 47 PHE HA H 47 4.070 4.232 -0.162 1
1 580 . 5 1 1 A 47 47 PHE C C 47 178.600 177.093 1.507 1
1 581 . 5 1 1 A 47 47 PHE CA C 47 61.250 60.268 0.982 1
1 582 . 5 1 1 A 47 47 PHE CB C 47 39.570 39.774 -0.204 1
1 583 . 5 1 1 A 47 47 PHE N N 47 121.800 121.128 0.672 1
1 584 . 5 1 1 A 48 48 MET H H 48 8.366 7.620 0.746 1
1 585 . 5 1 1 A 48 48 MET HA H 48 3.998 4.621 -0.623 1
1 590 . 5 1 1 A 48 48 MET C C 48 177.400 177.011 0.389 1
1 591 . 5 1 1 A 48 48 MET CA C 48 58.470 56.507 1.963 1
1 592 . 5 1 1 A 48 48 MET CB C 48 33.170 32.581 0.589 1
1 594 . 5 1 1 A 48 48 MET N N 48 117.700 117.114 0.586 1
1 595 . 5 1 1 A 49 49 GLN H H 49 7.659 8.224 -0.565 1
1 596 . 5 1 1 A 49 49 GLN HA H 49 4.258 4.584 -0.326 1
1 603 . 5 1 1 A 49 49 GLN C C 49 176.700 177.686 -0.986 1
1 604 . 5 1 1 A 49 49 GLN CA C 49 56.380 56.352 0.028 1
1 605 . 5 1 1 A 49 49 GLN CB C 49 28.980 30.383 -1.403 1
1 607 . 5 1 1 A 49 49 GLN N N 49 116.700 115.730 0.970 1
1 609 . 5 1 1 A 50 50 GLY H H 50 7.685 8.550 -0.865 1
1 610 . 5 1 1 A 50 50 GLY HA2 H 50 3.998 3.848 0.150 1
1 611 . 5 1 1 A 50 50 GLY HA3 H 50 3.998 3.886 0.112 1
1 612 . 5 1 1 A 50 50 GLY C C 50 174.900 175.158 -0.258 1
1 613 . 5 1 1 A 50 50 GLY CA C 50 45.460 45.706 -0.246 1
1 614 . 5 1 1 A 50 50 GLY N N 50 106.400 108.461 -2.061 1
1 615 . 5 1 1 A 51 51 GLY H H 51 8.031 9.358 -1.327 1
1 616 . 5 1 1 A 51 51 GLY HA2 H 51 3.817 3.859 -0.042 1
1 617 . 5 1 1 A 51 51 GLY HA3 H 51 3.817 3.867 -0.050 1
1 618 . 5 1 1 A 51 51 GLY C C 51 174.500 174.409 0.091 1
1 619 . 5 1 1 A 51 51 GLY CA C 51 45.190 45.643 -0.453 1
1 620 . 5 1 1 A 51 51 GLY N N 51 108.900 109.330 -0.430 1
1 621 . 5 1 1 A 52 52 GLY H H 52 8.126 8.239 -0.113 1
1 622 . 5 1 1 A 52 52 GLY HA2 H 52 3.362 3.547 -0.185 1
1 623 . 5 1 1 A 52 52 GLY HA3 H 52 3.362 3.960 -0.598 1
1 624 . 5 1 1 A 52 52 GLY C C 52 173.300 174.280 -0.980 1
1 625 . 5 1 1 A 52 52 GLY CA C 52 45.120 45.159 -0.039 1
1 626 . 5 1 1 A 52 52 GLY N N 52 108.100 107.538 0.562 1
1 627 . 5 1 1 A 53 53 SER H H 53 7.594 7.910 -0.316 1
1 628 . 5 1 1 A 53 53 SER HA H 53 4.530 4.652 -0.122 1
1 631 . 5 1 1 A 53 53 SER C C 53 175.300 175.125 0.175 1
1 632 . 5 1 1 A 53 53 SER CA C 53 57.770 57.147 0.623 1
1 633 . 5 1 1 A 53 53 SER CB C 53 64.750 61.164 3.586 1
1 634 . 5 1 1 A 53 53 SER N N 53 114.100 116.061 -1.961 1
1 635 . 5 1 1 A 54 54 GLY H H 54 9.003 8.726 0.277 1
1 636 . 5 1 1 A 54 54 GLY HA2 H 54 4.037 3.943 0.094 1
1 637 . 5 1 1 A 54 54 GLY HA3 H 54 3.911 4.018 -0.107 1
1 638 . 5 1 1 A 54 54 GLY C C 54 176.500 175.327 1.173 1
1 639 . 5 1 1 A 54 54 GLY CA C 54 47.040 47.015 0.025 1
1 640 . 5 1 1 A 54 54 GLY N N 54 110.400 111.757 -1.357 1
1 641 . 5 1 1 A 55 55 GLY H H 55 8.617 8.230 0.387 1
1 642 . 5 1 1 A 55 55 GLY HA2 H 55 3.946 3.930 0.016 1
1 643 . 5 1 1 A 55 55 GLY HA3 H 55 3.946 3.942 0.004 1
1 644 . 5 1 1 A 55 55 GLY C C 55 176.400 175.554 0.846 1
1 645 . 5 1 1 A 55 55 GLY CA C 55 46.630 46.708 -0.078 1
1 646 . 5 1 1 A 55 55 GLY N N 55 109.800 109.484 0.316 1
1 647 . 5 1 1 A 56 56 LYS H H 56 7.876 8.580 -0.704 1
1 648 . 5 1 1 A 56 56 LYS HA H 56 4.195 4.247 -0.052 1
1 657 . 5 1 1 A 56 56 LYS C C 56 178.600 178.986 -0.386 1
1 658 . 5 1 1 A 56 56 LYS CA C 56 57.960 58.448 -0.488 1
1 659 . 5 1 1 A 56 56 LYS CB C 56 32.110 31.739 0.371 1
1 663 . 5 1 1 A 56 56 LYS N N 56 121.800 121.800 0.000 1
1 664 . 5 1 1 A 57 57 LEU H H 57 8.153 7.665 0.488 1
1 665 . 5 1 1 A 57 57 LEU HA H 57 3.992 4.178 -0.186 1
1 675 . 5 1 1 A 57 57 LEU C C 57 178.400 178.881 -0.481 1
1 676 . 5 1 1 A 57 57 LEU CA C 57 58.190 58.284 -0.094 1
1 677 . 5 1 1 A 57 57 LEU CB C 57 41.360 42.024 -0.664 1
1 681 . 5 1 1 A 57 57 LEU N N 57 120.700 121.209 -0.509 1
1 682 . 5 1 1 A 58 58 GLN H H 58 8.019 7.987 0.032 1
1 683 . 5 1 1 A 58 58 GLN HA H 58 3.942 4.208 -0.266 1
1 690 . 5 1 1 A 58 58 GLN C C 58 179.100 178.222 0.878 1
1 691 . 5 1 1 A 58 58 GLN CA C 58 59.360 58.216 1.144 1
1 692 . 5 1 1 A 58 58 GLN CB C 58 28.030 28.402 -0.372 1
1 694 . 5 1 1 A 58 58 GLN N N 58 117.400 117.373 0.027 1
1 696 . 5 1 1 A 59 59 GLU H H 59 7.838 8.014 -0.176 1
1 697 . 5 1 1 A 59 59 GLU HA H 59 4.030 4.113 -0.083 1
1 702 . 5 1 1 A 59 59 GLU C C 59 178.600 179.359 -0.759 1
1 703 . 5 1 1 A 59 59 GLU CA C 59 59.250 58.994 0.256 1
1 704 . 5 1 1 A 59 59 GLU CB C 59 28.960 29.799 -0.839 1
1 706 . 5 1 1 A 59 59 GLU N N 59 119.900 120.344 -0.444 1
1 707 . 5 1 1 A 60 60 MET H H 60 8.223 8.119 0.104 1
1 708 . 5 1 1 A 60 60 MET HA H 60 3.966 4.185 -0.219 1
1 713 . 5 1 1 A 60 60 MET C C 60 177.900 178.414 -0.514 1
1 714 . 5 1 1 A 60 60 MET CA C 60 59.350 57.694 1.656 1
1 715 . 5 1 1 A 60 60 MET CB C 60 33.210 32.249 0.961 1
1 717 . 5 1 1 A 60 60 MET N N 60 120.100 118.977 1.123 1
1 718 . 5 1 1 A 61 61 MET H H 61 8.134 8.147 -0.013 1
1 719 . 5 1 1 A 61 61 MET HA H 61 4.195 4.201 -0.006 1
1 724 . 5 1 1 A 61 61 MET C C 61 179.100 178.222 0.878 1
1 725 . 5 1 1 A 61 61 MET CA C 61 58.210 58.787 -0.577 1
1 726 . 5 1 1 A 61 61 MET CB C 61 31.340 32.270 -0.930 1
1 728 . 5 1 1 A 61 61 MET N N 61 117.000 119.396 -2.396 1
1 729 . 5 1 1 A 62 62 LYS H H 62 7.782 7.683 0.099 1
1 730 . 5 1 1 A 62 62 LYS HA H 62 4.085 3.901 0.184 1
1 739 . 5 1 1 A 62 62 LYS C C 62 179.600 179.232 0.368 1
1 740 . 5 1 1 A 62 62 LYS CA C 62 59.610 60.004 -0.394 1
1 741 . 5 1 1 A 62 62 LYS CB C 62 32.180 32.154 0.026 1
1 745 . 5 1 1 A 62 62 LYS N N 62 120.600 119.026 1.574 1
1 746 . 5 1 1 A 63 63 GLU H H 63 8.041 7.761 0.280 1
1 747 . 5 1 1 A 63 63 GLU HA H 63 4.057 3.618 0.439 1
1 752 . 5 1 1 A 63 63 GLU C C 63 178.900 178.856 0.044 1
1 753 . 5 1 1 A 63 63 GLU CA C 63 59.170 58.613 0.557 1
1 754 . 5 1 1 A 63 63 GLU CB C 63 29.000 29.285 -0.285 1
1 756 . 5 1 1 A 63 63 GLU N N 63 120.200 119.746 0.454 1
1 757 . 5 1 1 A 64 64 PHE H H 64 8.604 8.873 -0.269 1
1 758 . 5 1 1 A 64 64 PHE HA H 64 4.155 3.833 0.322 1
1 763 . 5 1 1 A 64 64 PHE C C 64 177.800 177.773 0.027 1
1 764 . 5 1 1 A 64 64 PHE CA C 64 59.820 60.897 -1.077 1
1 765 . 5 1 1 A 64 64 PHE CB C 64 38.470 38.733 -0.263 1
1 766 . 5 1 1 A 64 64 PHE N N 64 119.700 120.471 -0.771 1
1 767 . 5 1 1 A 65 65 GLN H H 65 8.177 8.637 -0.460 1
1 768 . 5 1 1 A 65 65 GLN HA H 65 3.637 3.894 -0.257 1
1 775 . 5 1 1 A 65 65 GLN C C 65 177.800 177.579 0.221 1
1 776 . 5 1 1 A 65 65 GLN CA C 65 58.970 57.793 1.177 1
1 777 . 5 1 1 A 65 65 GLN CB C 65 28.280 28.494 -0.214 1
1 779 . 5 1 1 A 65 65 GLN N N 65 118.500 118.694 -0.194 1
1 781 . 5 1 1 A 66 66 GLN H H 66 7.622 7.607 0.015 1
1 782 . 5 1 1 A 66 66 GLN HA H 66 4.040 4.314 -0.274 1
1 789 . 5 1 1 A 66 66 GLN C C 66 178.600 178.658 -0.058 1
1 790 . 5 1 1 A 66 66 GLN CA C 66 59.150 57.764 1.386 1
1 791 . 5 1 1 A 66 66 GLN CB C 66 28.230 29.561 -1.331 1
1 793 . 5 1 1 A 66 66 GLN N N 66 117.400 118.468 -1.068 1
1 795 . 5 1 1 A 67 67 VAL H H 67 7.744 7.508 0.236 1
1 796 . 5 1 1 A 67 67 VAL HA H 67 3.785 3.723 0.062 1
1 804 . 5 1 1 A 67 67 VAL C C 67 177.500 177.668 -0.168 1
1 805 . 5 1 1 A 67 67 VAL CA C 67 66.220 66.146 0.074 1
1 806 . 5 1 1 A 67 67 VAL CB C 67 31.390 31.605 -0.215 1
1 809 . 5 1 1 A 67 67 VAL N N 67 119.500 121.213 -1.713 1
1 810 . 5 1 1 A 68 68 LEU H H 68 7.983 7.807 0.176 1
1 811 . 5 1 1 A 68 68 LEU HA H 68 3.825 4.048 -0.223 1
1 821 . 5 1 1 A 68 68 LEU C C 68 179.100 178.144 0.956 1
1 822 . 5 1 1 A 68 68 LEU CA C 68 58.740 58.601 0.139 1
1 823 . 5 1 1 A 68 68 LEU CB C 68 41.090 42.175 -1.085 1
1 827 . 5 1 1 A 68 68 LEU N N 68 120.400 120.118 0.282 1
1 828 . 5 1 1 A 69 69 ASP H H 69 8.179 8.335 -0.156 1
1 829 . 5 1 1 A 69 69 ASP HA H 69 4.380 4.376 0.004 1
1 832 . 5 1 1 A 69 69 ASP C C 69 178.900 178.492 0.408 1
1 833 . 5 1 1 A 69 69 ASP CA C 69 57.320 57.038 0.282 1
1 834 . 5 1 1 A 69 69 ASP CB C 69 40.040 40.537 -0.497 1
1 835 . 5 1 1 A 69 69 ASP N N 69 119.000 118.189 0.811 1
1 836 . 5 1 1 A 70 70 GLU H H 70 8.166 7.911 0.255 1
1 837 . 5 1 1 A 70 70 GLU HA H 70 4.082 4.069 0.013 1
1 842 . 5 1 1 A 70 70 GLU C C 70 179.600 179.170 0.430 1
1 843 . 5 1 1 A 70 70 GLU CA C 70 59.010 59.319 -0.309 1
1 844 . 5 1 1 A 70 70 GLU CB C 70 28.900 29.359 -0.459 1
1 846 . 5 1 1 A 70 70 GLU N N 70 120.500 119.419 1.081 1
1 847 . 5 1 1 A 71 71 ILE H H 71 8.415 8.365 0.050 1
1 848 . 5 1 1 A 71 71 ILE HA H 71 3.790 3.492 0.298 1
1 858 . 5 1 1 A 71 71 ILE C C 71 177.400 177.768 -0.368 1
1 859 . 5 1 1 A 71 71 ILE CA C 71 64.890 65.289 -0.399 1
1 860 . 5 1 1 A 71 71 ILE CB C 71 37.680 37.651 0.029 1
1 864 . 5 1 1 A 71 71 ILE N N 71 119.200 119.844 -0.644 1
1 865 . 5 1 1 A 72 72 LYS H H 72 8.248 7.754 0.494 1
1 866 . 5 1 1 A 72 72 LYS HA H 72 3.625 3.311 0.314 1
1 873 . 5 1 1 A 72 72 LYS C C 72 178.400 178.228 0.172 1
1 874 . 5 1 1 A 72 72 LYS CA C 72 59.850 59.294 0.556 1
1 875 . 5 1 1 A 72 72 LYS CB C 72 32.070 32.012 0.058 1
1 879 . 5 1 1 A 72 72 LYS N N 72 120.800 120.725 0.075 1
1 880 . 5 1 1 A 73 73 GLN H H 73 7.937 7.877 0.060 1
1 881 . 5 1 1 A 73 73 GLN HA H 73 4.042 3.909 0.133 1
1 888 . 5 1 1 A 73 73 GLN C C 73 178.400 178.181 0.219 1
1 889 . 5 1 1 A 73 73 GLN CA C 73 58.510 59.172 -0.662 1
1 890 . 5 1 1 A 73 73 GLN CB C 73 28.430 28.433 -0.003 1
1 892 . 5 1 1 A 73 73 GLN N N 73 117.000 118.047 -1.047 1
1 894 . 5 1 1 A 74 74 GLN H H 74 7.712 7.852 -0.140 1
1 895 . 5 1 1 A 74 74 GLN HA H 74 4.080 3.926 0.154 1
1 902 . 5 1 1 A 74 74 GLN C C 74 177.800 178.188 -0.388 1
1 903 . 5 1 1 A 74 74 GLN CA C 74 57.270 58.404 -1.134 1
1 904 . 5 1 1 A 74 74 GLN CB C 74 28.700 27.845 0.855 1
1 906 . 5 1 1 A 74 74 GLN N N 74 118.200 118.308 -0.108 1
1 908 . 5 1 1 A 75 75 LEU H H 75 7.956 7.695 0.261 1
1 909 . 5 1 1 A 75 75 LEU HA H 75 4.212 3.740 0.472 1
1 919 . 5 1 1 A 75 75 LEU CA C 75 56.660 57.768 -1.108 1
1 920 . 5 1 1 A 75 75 LEU CB C 75 42.000 40.822 1.178 1
1 924 . 5 1 1 A 75 75 LEU N N 75 120.700 119.590 1.110 1
1 925 . 5 1 1 A 76 76 GLN H H 76 8.315 8.460 -0.145 1
1 926 . 5 1 1 A 76 76 GLN HA H 76 4.113 3.946 0.167 1
1 933 . 5 1 1 A 76 76 GLN C C 76 177.100 176.665 0.435 1
1 934 . 5 1 1 A 76 76 GLN CA C 76 57.400 59.518 -2.118 1
1 935 . 5 1 1 A 76 76 GLN CB C 76 28.640 28.914 -0.274 1
1 937 . 5 1 1 A 76 76 GLN N N 76 120.100 118.811 1.289 1
1 939 . 5 1 1 A 77 77 GLY H H 77 8.021 7.873 0.148 1
1 940 . 5 1 1 A 77 77 GLY HA2 H 77 4.042 4.015 0.027 1
1 941 . 5 1 1 A 77 77 GLY HA3 H 77 3.869 4.023 -0.154 1
1 942 . 5 1 1 A 77 77 GLY C C 77 174.600 174.759 -0.159 1
1 943 . 5 1 1 A 77 77 GLY CA C 77 45.430 44.576 0.854 1
1 944 . 5 1 1 A 77 77 GLY N N 77 107.700 107.507 0.193 1
1 945 . 5 1 1 A 78 78 GLY H H 78 7.819 8.614 -0.795 1
1 946 . 5 1 1 A 78 78 GLY HA2 H 78 4.208 3.966 0.242 1
1 947 . 5 1 1 A 78 78 GLY HA3 H 78 3.801 3.974 -0.173 1
1 948 . 5 1 1 A 78 78 GLY C C 78 173.900 174.313 -0.413 1
1 949 . 5 1 1 A 78 78 GLY CA C 78 45.140 44.964 0.176 1
1 950 . 5 1 1 A 78 78 GLY N N 78 107.100 109.892 -2.792 1
1 951 . 5 1 1 A 79 79 ASP H H 79 7.912 7.790 0.122 1
1 952 . 5 1 1 A 79 79 ASP HA H 79 4.722 4.766 -0.044 1
1 955 . 5 1 1 A 79 79 ASP C C 79 176.200 176.843 -0.643 1
1 956 . 5 1 1 A 79 79 ASP CA C 79 53.210 54.348 -1.138 1
1 957 . 5 1 1 A 79 79 ASP CB C 79 40.160 39.883 0.277 1
1 958 . 5 1 1 A 79 79 ASP N N 79 119.800 120.352 -0.552 1
1 959 . 5 1 1 A 80 80 ASN H H 80 8.450 9.320 -0.870 1
1 960 . 5 1 1 A 80 80 ASN HA H 80 4.593 4.557 0.036 1
1 965 . 5 1 1 A 80 80 ASN C C 80 177.300 177.110 0.190 1
1 966 . 5 1 1 A 80 80 ASN CA C 80 54.680 54.943 -0.263 1
1 967 . 5 1 1 A 80 80 ASN CB C 80 38.790 37.547 1.243 1
1 968 . 5 1 1 A 80 80 ASN N N 80 121.700 118.417 3.283 1
1 970 . 5 1 1 A 81 81 SER H H 81 8.444 8.109 0.335 1
1 971 . 5 1 1 A 81 81 SER HA H 81 4.263 4.204 0.059 1
1 974 . 5 1 1 A 81 81 SER C C 81 176.100 176.568 -0.468 1
1 975 . 5 1 1 A 81 81 SER CA C 81 61.470 61.979 -0.509 1
1 976 . 5 1 1 A 81 81 SER CB C 81 61.470 63.027 -1.557 1
1 977 . 5 1 1 A 81 81 SER N N 81 117.100 117.444 -0.344 1
1 978 . 5 1 1 A 82 82 LEU H H 82 7.929 8.176 -0.247 1
1 979 . 5 1 1 A 82 82 LEU HA H 82 4.332 3.974 0.358 1
1 989 . 5 1 1 A 82 82 LEU C C 82 177.400 178.977 -1.577 1
1 990 . 5 1 1 A 82 82 LEU CA C 82 55.060 57.882 -2.822 1
1 991 . 5 1 1 A 82 82 LEU CB C 82 41.940 41.545 0.395 1
1 995 . 5 1 1 A 82 82 LEU N N 82 120.400 120.971 -0.571 1
1 996 . 5 1 1 A 83 83 HIS H H 83 8.014 7.883 0.131 1
1 997 . 5 1 1 A 83 83 HIS HA H 83 4.173 4.340 -0.167 1
1 1000 . 5 1 1 A 83 83 HIS C C 83 176.100 176.847 -0.747 1
1 1001 . 5 1 1 A 83 83 HIS CA C 83 59.940 59.171 0.769 1
1 1002 . 5 1 1 A 83 83 HIS CB C 83 28.050 29.841 -1.791 1
1 1003 . 5 1 1 A 83 83 HIS N N 83 119.400 118.393 1.007 1
1 1004 . 5 1 1 A 84 84 ASN H H 84 8.598 8.466 0.132 1
1 1005 . 5 1 1 A 84 84 ASN HA H 84 4.735 4.680 0.055 1
1 1010 . 5 1 1 A 84 84 ASN C C 84 177.400 177.509 -0.109 1
1 1011 . 5 1 1 A 84 84 ASN CA C 84 55.790 55.395 0.395 1
1 1012 . 5 1 1 A 84 84 ASN CB C 84 37.520 38.956 -1.436 1
1 1013 . 5 1 1 A 84 84 ASN N N 84 118.100 117.690 0.410 1
1 1015 . 5 1 1 A 85 85 VAL H H 85 7.933 7.644 0.289 1
1 1016 . 5 1 1 A 85 85 VAL HA H 85 3.849 3.761 0.088 1
1 1024 . 5 1 1 A 85 85 VAL C C 85 177.100 178.030 -0.930 1
1 1025 . 5 1 1 A 85 85 VAL CA C 85 65.490 65.746 -0.256 1
1 1026 . 5 1 1 A 85 85 VAL CB C 85 31.760 31.848 -0.088 1
1 1029 . 5 1 1 A 85 85 VAL N N 85 120.500 120.151 0.349 1
1 1030 . 5 1 1 A 86 86 HIS H H 86 8.460 9.365 -0.905 1
1 1031 . 5 1 1 A 86 86 HIS HA H 86 4.054 4.115 -0.061 1
1 1035 . 5 1 1 A 86 86 HIS C C 86 176.300 176.625 -0.325 1
1 1036 . 5 1 1 A 86 86 HIS CA C 86 59.860 59.291 0.569 1
1 1037 . 5 1 1 A 86 86 HIS CB C 86 29.670 30.026 -0.356 1
1 1038 . 5 1 1 A 86 86 HIS N N 86 119.300 119.219 0.081 1
1 1039 . 5 1 1 A 87 87 GLU H H 87 7.897 8.076 -0.179 1
1 1040 . 5 1 1 A 87 87 GLU HA H 87 3.838 3.856 -0.018 1
1 1045 . 5 1 1 A 87 87 GLU C C 87 178.300 179.091 -0.791 1
1 1046 . 5 1 1 A 87 87 GLU CA C 87 58.690 58.048 0.642 1
1 1047 . 5 1 1 A 87 87 GLU CB C 87 28.460 29.319 -0.859 1
1 1049 . 5 1 1 A 87 87 GLU N N 87 117.100 118.699 -1.599 1
1 1050 . 5 1 1 A 88 88 ASN H H 88 8.103 8.946 -0.843 1
1 1051 . 5 1 1 A 88 88 ASN HA H 88 4.503 4.522 -0.019 1
1 1056 . 5 1 1 A 88 88 ASN C C 88 177.700 177.899 -0.199 1
1 1057 . 5 1 1 A 88 88 ASN CA C 88 55.990 55.978 0.012 1
1 1058 . 5 1 1 A 88 88 ASN CB C 88 39.010 38.527 0.483 1
1 1059 . 5 1 1 A 88 88 ASN N N 88 118.400 118.615 -0.215 1
1 1061 . 5 1 1 A 89 89 ILE H H 89 8.501 8.146 0.355 1
1 1062 . 5 1 1 A 89 89 ILE HA H 89 3.670 3.797 -0.127 1
1 1072 . 5 1 1 A 89 89 ILE C C 89 177.000 177.851 -0.851 1
1 1073 . 5 1 1 A 89 89 ILE CA C 89 65.390 65.352 0.038 1
1 1074 . 5 1 1 A 89 89 ILE CB C 89 37.440 37.735 -0.295 1
1 1078 . 5 1 1 A 89 89 ILE N N 89 118.700 119.499 -0.799 1
1 1079 . 5 1 1 A 90 90 LYS H H 90 8.017 7.998 0.019 1
1 1080 . 5 1 1 A 90 90 LYS HA H 90 3.775 3.829 -0.054 1
1 1089 . 5 1 1 A 90 90 LYS C C 90 178.800 178.695 0.105 1
1 1090 . 5 1 1 A 90 90 LYS CA C 90 60.450 59.876 0.574 1
1 1091 . 5 1 1 A 90 90 LYS CB C 90 32.110 32.335 -0.225 1
1 1095 . 5 1 1 A 90 90 LYS N N 90 120.900 120.461 0.439 1
1 1096 . 5 1 1 A 91 91 GLU H H 91 7.732 7.559 0.173 1
1 1097 . 5 1 1 A 91 91 GLU HA H 91 4.083 4.095 -0.012 1
1 1102 . 5 1 1 A 91 91 GLU C C 91 179.100 178.861 0.239 1
1 1103 . 5 1 1 A 91 91 GLU CA C 91 59.120 58.829 0.291 1
1 1104 . 5 1 1 A 91 91 GLU CB C 91 28.810 29.612 -0.802 1
1 1106 . 5 1 1 A 91 91 GLU N N 91 119.300 118.473 0.827 1
1 1107 . 5 1 1 A 92 92 ILE H H 92 8.110 9.156 -1.046 1
1 1108 . 5 1 1 A 92 92 ILE HA H 92 3.685 3.796 -0.111 1
1 1118 . 5 1 1 A 92 92 ILE C C 92 178.000 177.949 0.051 1
1 1119 . 5 1 1 A 92 92 ILE CA C 92 65.900 65.543 0.357 1
1 1120 . 5 1 1 A 92 92 ILE CB C 92 38.400 38.098 0.302 1
1 1124 . 5 1 1 A 92 92 ILE N N 92 121.100 120.247 0.853 1
1 1125 . 5 1 1 A 93 93 PHE H H 93 8.651 9.183 -0.532 1
1 1126 . 5 1 1 A 93 93 PHE HA H 93 3.873 3.083 0.790 1
1 1133 . 5 1 1 A 93 93 PHE C C 93 177.100 176.468 0.632 1
1 1134 . 5 1 1 A 93 93 PHE CA C 93 61.020 60.677 0.343 1
1 1135 . 5 1 1 A 93 93 PHE CB C 93 38.560 38.614 -0.054 1
1 1138 . 5 1 1 A 93 93 PHE N N 93 119.400 120.975 -1.575 1
1 1139 . 5 1 1 A 94 94 HIS H H 94 8.126 7.300 0.826 1
1 1140 . 5 1 1 A 94 94 HIS HA H 94 4.368 3.956 0.412 1
1 1145 . 5 1 1 A 94 94 HIS C C 94 177.100 176.256 0.844 1
1 1146 . 5 1 1 A 94 94 HIS CA C 94 58.310 57.044 1.266 1
1 1147 . 5 1 1 A 94 94 HIS CB C 94 27.910 28.778 -0.868 1
1 1148 . 5 1 1 A 94 94 HIS N N 94 116.400 113.124 3.276 1
1 1149 . 5 1 1 A 95 95 HIS H H 95 8.058 8.555 -0.497 1
1 1150 . 5 1 1 A 95 95 HIS HA H 95 4.465 4.269 0.196 1
1 1154 . 5 1 1 A 95 95 HIS C C 95 177.300 177.482 -0.182 1
1 1155 . 5 1 1 A 95 95 HIS CA C 95 57.900 58.851 -0.951 1
1 1156 . 5 1 1 A 95 95 HIS CB C 95 28.490 30.743 -2.253 1
1 1157 . 5 1 1 A 95 95 HIS N N 95 117.000 117.011 -0.011 1
1 1158 . 5 1 1 A 96 96 LEU H H 96 8.525 7.832 0.693 1
1 1159 . 5 1 1 A 96 96 LEU HA H 96 3.865 3.766 0.099 1
1 1169 . 5 1 1 A 96 96 LEU C C 96 178.300 178.627 -0.327 1
1 1170 . 5 1 1 A 96 96 LEU CA C 96 58.250 58.011 0.239 1
1 1171 . 5 1 1 A 96 96 LEU CB C 96 41.720 41.838 -0.118 1
1 1175 . 5 1 1 A 96 96 LEU N N 96 121.300 121.141 0.159 1
1 1176 . 5 1 1 A 97 97 GLU H H 97 8.076 8.244 -0.168 1
1 1177 . 5 1 1 A 97 97 GLU HA H 97 3.719 4.110 -0.391 1
1 1182 . 5 1 1 A 97 97 GLU C C 97 178.300 178.692 -0.392 1
1 1183 . 5 1 1 A 97 97 GLU CA C 97 59.300 58.637 0.663 1
1 1184 . 5 1 1 A 97 97 GLU CB C 97 28.960 29.656 -0.696 1
1 1186 . 5 1 1 A 97 97 GLU N N 97 117.100 118.473 -1.373 1
1 1187 . 5 1 1 A 98 98 GLU H H 98 7.329 7.812 -0.483 1
1 1188 . 5 1 1 A 98 98 GLU HA H 98 4.024 4.135 -0.111 1
1 1193 . 5 1 1 A 98 98 GLU C C 98 177.900 178.737 -0.837 1
1 1194 . 5 1 1 A 98 98 GLU CA C 98 58.190 58.432 -0.242 1
1 1195 . 5 1 1 A 98 98 GLU CB C 98 29.120 29.759 -0.639 1
1 1197 . 5 1 1 A 98 98 GLU N N 98 116.000 119.014 -3.014 1
1 1198 . 5 1 1 A 99 99 LEU H H 99 7.535 8.321 -0.786 1
1 1199 . 5 1 1 A 99 99 LEU HA H 99 4.183 4.139 0.044 1
1 1209 . 5 1 1 A 99 99 LEU C C 99 178.100 177.543 0.557 1
1 1210 . 5 1 1 A 99 99 LEU CA C 99 56.440 56.032 0.408 1
1 1211 . 5 1 1 A 99 99 LEU CB C 99 43.010 41.311 1.699 1
1 1215 . 5 1 1 A 99 99 LEU N N 99 118.200 118.824 -0.624 1
1 1216 . 5 1 1 A 100 100 VAL H H 100 7.561 7.388 0.173 1
1 1217 . 5 1 1 A 100 100 VAL HA H 100 4.033 4.434 -0.401 1
1 1225 . 5 1 1 A 100 100 VAL C C 100 175.400 177.558 -2.158 1
1 1226 . 5 1 1 A 100 100 VAL CA C 100 62.430 62.887 -0.457 1
1 1227 . 5 1 1 A 100 100 VAL CB C 100 32.050 33.305 -1.255 1
1 1230 . 5 1 1 A 100 100 VAL N N 100 114.800 113.680 1.120 1
1 1231 . 5 1 1 A 101 101 HIS H H 101 7.827 8.170 -0.343 1
1 1232 . 5 1 1 A 101 101 HIS HA H 101 4.630 4.082 0.548 1
1 1237 . 5 1 1 A 101 101 HIS C C 101 173.500 177.159 -3.659 1
1 1238 . 5 1 1 A 101 101 HIS CA C 101 55.410 59.691 -4.281 1
1 1239 . 5 1 1 A 101 101 HIS CB C 101 28.870 30.305 -1.435 1
1 1240 . 5 1 1 A 101 101 HIS N N 101 120.300 123.165 -2.865 1
1 10 . 6 1 1 A 2 2 TYR H H 2 8.688 7.192 1.496 1
1 11 . 6 1 1 A 2 2 TYR HA H 2 4.737 4.209 0.528 1
1 16 . 6 1 1 A 2 2 TYR C C 2 175.900 176.153 -0.253 1
1 17 . 6 1 1 A 2 2 TYR CA C 2 57.920 60.576 -2.656 1
1 18 . 6 1 1 A 2 2 TYR CB C 2 38.340 38.823 -0.483 1
1 19 . 6 1 1 A 2 2 TYR N N 2 122.100 124.304 -2.204 1
1 20 . 6 1 1 A 3 3 GLY H H 3 8.434 8.267 0.167 1
1 21 . 6 1 1 A 3 3 GLY HA2 H 3 3.909 4.022 -0.113 1
1 22 . 6 1 1 A 3 3 GLY HA3 H 3 3.841 4.044 -0.203 1
1 23 . 6 1 1 A 3 3 GLY C C 3 174.300 176.097 -1.797 1
1 24 . 6 1 1 A 3 3 GLY CA C 3 46.050 45.499 0.551 1
1 25 . 6 1 1 A 3 3 GLY N N 3 111.100 107.592 3.508 1
1 26 . 6 1 1 A 4 4 LYS H H 4 8.060 8.387 -0.327 1
1 27 . 6 1 1 A 4 4 LYS HA H 4 4.297 3.967 0.330 1
1 36 . 6 1 1 A 4 4 LYS C C 4 178.000 178.911 -0.911 1
1 37 . 6 1 1 A 4 4 LYS CA C 4 56.930 59.387 -2.457 1
1 38 . 6 1 1 A 4 4 LYS CB C 4 32.680 32.448 0.232 1
1 42 . 6 1 1 A 4 4 LYS N N 4 119.500 120.918 -1.418 1
1 43 . 6 1 1 A 5 5 LEU H H 5 8.243 8.106 0.137 1
1 44 . 6 1 1 A 5 5 LEU HA H 5 3.947 3.838 0.109 1
1 54 . 6 1 1 A 5 5 LEU C C 5 177.900 178.939 -1.039 1
1 55 . 6 1 1 A 5 5 LEU CA C 5 57.930 57.704 0.226 1
1 56 . 6 1 1 A 5 5 LEU CB C 5 41.620 41.648 -0.028 1
1 60 . 6 1 1 A 5 5 LEU N N 5 120.800 120.459 0.341 1
1 61 . 6 1 1 A 6 6 ASN H H 6 8.256 8.687 -0.431 1
1 62 . 6 1 1 A 6 6 ASN HA H 6 4.252 4.442 -0.190 1
1 67 . 6 1 1 A 6 6 ASN C C 6 177.300 177.428 -0.128 1
1 68 . 6 1 1 A 6 6 ASN CA C 6 56.900 55.731 1.169 1
1 69 . 6 1 1 A 6 6 ASN CB C 6 38.200 37.658 0.542 1
1 70 . 6 1 1 A 6 6 ASN N N 6 116.200 115.820 0.380 1
1 72 . 6 1 1 A 7 7 ASP H H 7 7.699 8.854 -1.155 1
1 73 . 6 1 1 A 7 7 ASP HA H 7 4.320 4.370 -0.050 1
1 76 . 6 1 1 A 7 7 ASP C C 7 178.000 178.760 -0.760 1
1 77 . 6 1 1 A 7 7 ASP CA C 7 56.980 57.189 -0.209 1
1 78 . 6 1 1 A 7 7 ASP CB C 7 39.870 40.828 -0.958 1
1 79 . 6 1 1 A 7 7 ASP N N 7 119.100 120.567 -1.467 1
1 80 . 6 1 1 A 8 8 LEU H H 8 7.580 8.428 -0.848 1
1 81 . 6 1 1 A 8 8 LEU HA H 8 4.091 4.069 0.022 1
1 91 . 6 1 1 A 8 8 LEU C C 8 178.800 178.838 -0.038 1
1 92 . 6 1 1 A 8 8 LEU CA C 8 57.790 57.877 -0.087 1
1 93 . 6 1 1 A 8 8 LEU CB C 8 41.880 41.689 0.191 1
1 97 . 6 1 1 A 8 8 LEU N N 8 120.400 120.212 0.188 1
1 98 . 6 1 1 A 9 9 LEU H H 9 8.125 9.105 -0.980 1
1 99 . 6 1 1 A 9 9 LEU HA H 9 3.891 3.960 -0.069 1
1 109 . 6 1 1 A 9 9 LEU C C 9 178.900 178.658 0.242 1
1 110 . 6 1 1 A 9 9 LEU CA C 9 58.350 58.529 -0.179 1
1 111 . 6 1 1 A 9 9 LEU CB C 9 41.510 41.876 -0.366 1
1 115 . 6 1 1 A 9 9 LEU N N 9 118.900 120.337 -1.437 1
1 116 . 6 1 1 A 10 10 GLU H H 10 8.011 8.515 -0.504 1
1 117 . 6 1 1 A 10 10 GLU HA H 10 4.072 4.098 -0.026 1
1 122 . 6 1 1 A 10 10 GLU C C 10 179.000 178.571 0.429 1
1 123 . 6 1 1 A 10 10 GLU CA C 10 59.090 59.983 -0.893 1
1 124 . 6 1 1 A 10 10 GLU CB C 10 27.910 29.294 -1.384 1
1 126 . 6 1 1 A 10 10 GLU N N 10 119.300 118.714 0.586 1
1 127 . 6 1 1 A 11 11 ASP H H 11 8.128 7.924 0.204 1
1 128 . 6 1 1 A 11 11 ASP HA H 11 4.383 4.297 0.086 1
1 131 . 6 1 1 A 11 11 ASP C C 11 178.500 178.735 -0.235 1
1 132 . 6 1 1 A 11 11 ASP CA C 11 56.580 57.333 -0.753 1
1 133 . 6 1 1 A 11 11 ASP CB C 11 38.600 40.644 -2.044 1
1 134 . 6 1 1 A 11 11 ASP N N 11 119.600 120.017 -0.417 1
1 135 . 6 1 1 A 12 12 LEU H H 12 8.394 8.413 -0.019 1
1 136 . 6 1 1 A 12 12 LEU HA H 12 3.923 4.135 -0.212 1
1 146 . 6 1 1 A 12 12 LEU C C 12 178.200 178.580 -0.380 1
1 147 . 6 1 1 A 12 12 LEU CA C 12 57.880 58.454 -0.574 1
1 148 . 6 1 1 A 12 12 LEU CB C 12 41.850 41.459 0.391 1
1 152 . 6 1 1 A 12 12 LEU N N 12 120.500 121.577 -1.077 1
1 153 . 6 1 1 A 13 13 GLN H H 13 8.371 9.162 -0.791 1
1 154 . 6 1 1 A 13 13 GLN HA H 13 3.879 4.163 -0.284 1
1 161 . 6 1 1 A 13 13 GLN C C 13 178.600 177.935 0.665 1
1 162 . 6 1 1 A 13 13 GLN CA C 13 59.570 57.611 1.959 1
1 163 . 6 1 1 A 13 13 GLN CB C 13 28.440 27.074 1.366 1
1 165 . 6 1 1 A 13 13 GLN N N 13 118.400 117.246 1.154 1
1 167 . 6 1 1 A 14 14 GLU H H 14 7.913 8.284 -0.371 1
1 168 . 6 1 1 A 14 14 GLU HA H 14 4.021 4.250 -0.229 1
1 173 . 6 1 1 A 14 14 GLU C C 14 179.000 179.076 -0.076 1
1 174 . 6 1 1 A 14 14 GLU CA C 14 59.030 58.790 0.240 1
1 175 . 6 1 1 A 14 14 GLU CB C 14 28.720 30.172 -1.452 1
1 177 . 6 1 1 A 14 14 GLU N N 14 119.100 119.089 0.011 1
1 178 . 6 1 1 A 15 15 VAL H H 15 7.991 8.433 -0.442 1
1 179 . 6 1 1 A 15 15 VAL HA H 15 3.696 3.904 -0.208 1
1 187 . 6 1 1 A 15 15 VAL C C 15 178.300 178.055 0.245 1
1 188 . 6 1 1 A 15 15 VAL CA C 15 66.640 65.589 1.051 1
1 189 . 6 1 1 A 15 15 VAL CB C 15 31.470 31.587 -0.117 1
1 192 . 6 1 1 A 15 15 VAL N N 15 120.300 118.181 2.119 1
1 193 . 6 1 1 A 16 16 LEU H H 16 8.172 7.429 0.743 1
1 194 . 6 1 1 A 16 16 LEU HA H 16 3.876 4.121 -0.245 1
1 204 . 6 1 1 A 16 16 LEU C C 16 178.400 178.522 -0.122 1
1 205 . 6 1 1 A 16 16 LEU CA C 16 58.050 57.985 0.065 1
1 206 . 6 1 1 A 16 16 LEU CB C 16 41.420 41.320 0.100 1
1 210 . 6 1 1 A 16 16 LEU N N 16 119.700 120.373 -0.673 1
1 211 . 6 1 1 A 17 17 LYS H H 17 7.755 9.206 -1.451 1
1 212 . 6 1 1 A 17 17 LYS HA H 17 3.951 4.109 -0.158 1
1 221 . 6 1 1 A 17 17 LYS C C 17 178.800 179.147 -0.347 1
1 222 . 6 1 1 A 17 17 LYS CA C 17 59.470 59.119 0.351 1
1 223 . 6 1 1 A 17 17 LYS CB C 17 32.350 32.590 -0.240 1
1 227 . 6 1 1 A 17 17 LYS N N 17 117.800 119.314 -1.514 1
1 228 . 6 1 1 A 18 18 HIS H H 18 7.847 8.103 -0.256 1
1 229 . 6 1 1 A 18 18 HIS HA H 18 4.549 4.417 0.132 1
1 233 . 6 1 1 A 18 18 HIS C C 18 177.200 175.775 1.425 1
1 234 . 6 1 1 A 18 18 HIS CA C 18 57.870 57.743 0.127 1
1 235 . 6 1 1 A 18 18 HIS CB C 18 28.730 29.389 -0.659 1
1 236 . 6 1 1 A 18 18 HIS N N 18 116.200 119.646 -3.446 1
1 237 . 6 1 1 A 19 19 VAL H H 19 8.415 7.871 0.544 1
1 238 . 6 1 1 A 19 19 VAL HA H 19 3.746 4.098 -0.352 1
1 246 . 6 1 1 A 19 19 VAL CA C 19 65.850 63.464 2.386 1
1 247 . 6 1 1 A 19 19 VAL CB C 19 31.600 33.616 -2.016 1
1 250 . 6 1 1 A 20 20 ASN H H 20 8.041 8.382 -0.341 1
1 251 . 6 1 1 A 20 20 ASN HA H 20 4.545 4.567 -0.022 1
1 256 . 6 1 1 A 20 20 ASN C C 20 176.900 178.212 -1.312 1
1 257 . 6 1 1 A 20 20 ASN CA C 20 55.070 56.807 -1.737 1
1 258 . 6 1 1 A 20 20 ASN CB C 20 38.270 38.130 0.140 1
1 259 . 6 1 1 A 20 20 ASN N N 20 117.900 119.294 -1.394 1
1 261 . 6 1 1 A 21 21 GLN H H 21 7.887 7.881 0.006 1
1 262 . 6 1 1 A 21 21 GLN HA H 21 4.096 4.299 -0.203 1
1 269 . 6 1 1 A 21 21 GLN C C 21 176.900 177.450 -0.550 1
1 270 . 6 1 1 A 21 21 GLN CA C 21 57.510 57.855 -0.345 1
1 271 . 6 1 1 A 21 21 GLN CB C 21 29.100 29.537 -0.437 1
1 273 . 6 1 1 A 21 21 GLN N N 21 117.900 119.415 -1.515 1
1 275 . 6 1 1 A 22 22 HIS H H 22 7.887 8.126 -0.239 1
1 276 . 6 1 1 A 22 22 HIS HA H 22 4.679 4.730 -0.051 1
1 280 . 6 1 1 A 22 22 HIS C C 22 174.300 175.359 -1.059 1
1 281 . 6 1 1 A 22 22 HIS CA C 22 55.770 55.400 0.370 1
1 282 . 6 1 1 A 22 22 HIS CB C 22 28.630 28.201 0.429 1
1 283 . 6 1 1 A 22 22 HIS N N 22 116.100 114.607 1.493 1
1 284 . 6 1 1 A 23 23 TRP H H 23 7.929 7.941 -0.012 1
1 285 . 6 1 1 A 23 23 TRP HA H 23 4.542 4.785 -0.243 1
1 292 . 6 1 1 A 23 23 TRP C C 23 176.600 175.341 1.259 1
1 293 . 6 1 1 A 23 23 TRP CA C 23 58.020 57.697 0.323 1
1 294 . 6 1 1 A 23 23 TRP CB C 23 29.700 30.592 -0.892 1
1 295 . 6 1 1 A 23 23 TRP N N 23 122.000 124.086 -2.086 1
1 297 . 6 1 1 A 24 24 GLN H H 24 8.258 8.186 0.072 1
1 298 . 6 1 1 A 24 24 GLN HA H 24 4.329 4.927 -0.598 1
1 305 . 6 1 1 A 24 24 GLN C C 24 176.200 175.948 0.252 1
1 306 . 6 1 1 A 24 24 GLN CA C 24 55.960 54.880 1.080 1
1 307 . 6 1 1 A 24 24 GLN CB C 24 29.440 32.178 -2.738 1
1 309 . 6 1 1 A 24 24 GLN N N 24 123.800 126.293 -2.493 1
1 311 . 6 1 1 A 25 25 GLY H H 25 7.470 8.692 -1.222 1
1 312 . 6 1 1 A 25 25 GLY HA2 H 25 3.939 4.015 -0.076 1
1 313 . 6 1 1 A 25 25 GLY HA3 H 25 3.800 4.032 -0.232 1
1 314 . 6 1 1 A 25 25 GLY C C 25 174.800 174.407 0.393 1
1 315 . 6 1 1 A 25 25 GLY CA C 25 45.470 45.123 0.347 1
1 316 . 6 1 1 A 25 25 GLY N N 25 108.100 112.066 -3.966 1
1 317 . 6 1 1 A 26 26 GLY H H 26 8.332 8.240 0.092 1
1 318 . 6 1 1 A 26 26 GLY HA2 H 26 4.105 4.187 -0.082 1
1 319 . 6 1 1 A 26 26 GLY HA3 H 26 3.974 4.234 -0.260 1
1 320 . 6 1 1 A 26 26 GLY C C 26 174.900 174.868 0.032 1
1 321 . 6 1 1 A 26 26 GLY CA C 26 45.410 45.577 -0.167 1
1 322 . 6 1 1 A 26 26 GLY N N 26 108.700 108.963 -0.263 1
1 323 . 6 1 1 A 27 27 GLN H H 27 8.474 8.637 -0.163 1
1 324 . 6 1 1 A 27 27 GLN HA H 27 4.106 3.894 0.212 1
1 331 . 6 1 1 A 27 27 GLN C C 27 177.100 177.154 -0.054 1
1 332 . 6 1 1 A 27 27 GLN CA C 27 57.540 58.089 -0.549 1
1 333 . 6 1 1 A 27 27 GLN CB C 27 29.050 28.782 0.268 1
1 335 . 6 1 1 A 27 27 GLN N N 27 121.100 123.890 -2.790 1
1 337 . 6 1 1 A 28 28 LYS H H 28 8.448 8.282 0.166 1
1 338 . 6 1 1 A 28 28 LYS HA H 28 4.068 4.049 0.019 1
1 347 . 6 1 1 A 28 28 LYS C C 28 177.900 177.942 -0.042 1
1 348 . 6 1 1 A 28 28 LYS CA C 28 58.410 58.418 -0.008 1
1 349 . 6 1 1 A 28 28 LYS CB C 28 32.210 31.781 0.429 1
1 353 . 6 1 1 A 28 28 LYS N N 28 120.500 117.621 2.879 1
1 354 . 6 1 1 A 29 29 ASN H H 29 8.273 9.006 -0.733 1
1 355 . 6 1 1 A 29 29 ASN HA H 29 4.584 4.428 0.156 1
1 360 . 6 1 1 A 29 29 ASN C C 29 176.200 177.220 -1.020 1
1 361 . 6 1 1 A 29 29 ASN CA C 29 54.400 55.762 -1.362 1
1 362 . 6 1 1 A 29 29 ASN CB C 29 38.280 38.548 -0.268 1
1 363 . 6 1 1 A 29 29 ASN N N 29 117.500 117.469 0.031 1
1 365 . 6 1 1 A 30 30 MET H H 30 7.870 7.417 0.453 1
1 366 . 6 1 1 A 30 30 MET HA H 30 4.085 3.102 0.983 1
1 371 . 6 1 1 A 30 30 MET C C 30 177.000 177.567 -0.567 1
1 372 . 6 1 1 A 30 30 MET CA C 30 56.880 57.678 -0.798 1
1 373 . 6 1 1 A 30 30 MET CB C 30 32.340 31.910 0.430 1
1 375 . 6 1 1 A 30 30 MET N N 30 121.100 118.683 2.417 1
1 376 . 6 1 1 A 31 31 ASN H H 31 8.186 7.565 0.621 1
1 377 . 6 1 1 A 31 31 ASN HA H 31 4.311 4.476 -0.165 1
1 382 . 6 1 1 A 31 31 ASN C C 31 176.700 177.730 -1.030 1
1 383 . 6 1 1 A 31 31 ASN CA C 31 55.320 55.344 -0.024 1
1 384 . 6 1 1 A 31 31 ASN CB C 31 38.410 38.692 -0.282 1
1 385 . 6 1 1 A 31 31 ASN N N 31 117.900 115.983 1.917 1
1 387 . 6 1 1 A 32 32 LYS H H 32 7.792 7.297 0.495 1
1 388 . 6 1 1 A 32 32 LYS HA H 32 3.992 4.005 -0.013 1
1 397 . 6 1 1 A 32 32 LYS C C 32 177.900 179.129 -1.229 1
1 398 . 6 1 1 A 32 32 LYS CA C 32 59.050 59.340 -0.290 1
1 399 . 6 1 1 A 32 32 LYS CB C 32 32.460 32.251 0.209 1
1 403 . 6 1 1 A 32 32 LYS N N 32 120.400 119.578 0.822 1
1 404 . 6 1 1 A 33 33 VAL H H 33 7.689 8.771 -1.082 1
1 405 . 6 1 1 A 33 33 VAL HA H 33 3.791 3.746 0.045 1
1 413 . 6 1 1 A 33 33 VAL C C 33 177.100 177.468 -0.368 1
1 414 . 6 1 1 A 33 33 VAL CA C 33 65.360 65.260 0.100 1
1 415 . 6 1 1 A 33 33 VAL CB C 33 31.920 31.566 0.354 1
1 418 . 6 1 1 A 33 33 VAL N N 33 120.200 116.266 3.934 1
1 419 . 6 1 1 A 34 34 ASP H H 34 8.408 7.803 0.605 1
1 420 . 6 1 1 A 34 34 ASP HA H 34 4.303 4.328 -0.025 1
1 423 . 6 1 1 A 34 34 ASP C C 34 178.200 178.056 0.144 1
1 424 . 6 1 1 A 34 34 ASP CA C 34 55.880 56.800 -0.920 1
1 425 . 6 1 1 A 34 34 ASP CB C 34 38.710 41.199 -2.489 1
1 426 . 6 1 1 A 34 34 ASP N N 34 120.100 121.964 -1.864 1
1 427 . 6 1 1 A 35 35 HIS H H 35 8.204 7.727 0.477 1
1 428 . 6 1 1 A 35 35 HIS HA H 35 4.343 4.335 0.008 1
1 431 . 6 1 1 A 35 35 HIS C C 35 176.800 177.537 -0.737 1
1 432 . 6 1 1 A 35 35 HIS CA C 35 58.310 58.895 -0.585 1
1 433 . 6 1 1 A 35 35 HIS CB C 35 28.070 30.582 -2.512 1
1 434 . 6 1 1 A 35 35 HIS N N 35 118.200 117.482 0.718 1
1 435 . 6 1 1 A 36 36 HIS H H 36 8.067 8.291 -0.224 1
1 436 . 6 1 1 A 36 36 HIS HA H 36 4.602 4.351 0.251 1
1 440 . 6 1 1 A 36 36 HIS C C 36 177.100 177.695 -0.595 1
1 441 . 6 1 1 A 36 36 HIS CA C 36 58.520 59.768 -1.248 1
1 442 . 6 1 1 A 36 36 HIS CB C 36 28.720 30.179 -1.459 1
1 443 . 6 1 1 A 36 36 HIS N N 36 117.100 116.831 0.269 1
1 444 . 6 1 1 A 37 37 LEU H H 37 8.473 8.210 0.263 1
1 445 . 6 1 1 A 37 37 LEU HA H 37 3.894 3.641 0.253 1
1 455 . 6 1 1 A 37 37 LEU C C 37 178.200 178.730 -0.530 1
1 456 . 6 1 1 A 37 37 LEU CA C 37 58.520 57.873 0.647 1
1 457 . 6 1 1 A 37 37 LEU CB C 37 41.810 41.367 0.443 1
1 461 . 6 1 1 A 37 37 LEU N N 37 119.600 119.616 -0.016 1
1 462 . 6 1 1 A 38 38 GLN H H 38 8.337 8.149 0.188 1
1 463 . 6 1 1 A 38 38 GLN HA H 38 3.882 3.946 -0.064 1
1 470 . 6 1 1 A 38 38 GLN C C 38 178.500 178.483 0.017 1
1 471 . 6 1 1 A 38 38 GLN CA C 38 59.200 59.356 -0.156 1
1 472 . 6 1 1 A 38 38 GLN CB C 38 27.850 28.090 -0.240 1
1 474 . 6 1 1 A 38 38 GLN N N 38 118.000 117.163 0.837 1
1 476 . 6 1 1 A 39 39 ASN H H 39 7.923 7.736 0.187 1
1 477 . 6 1 1 A 39 39 ASN HA H 39 4.390 4.544 -0.154 1
1 482 . 6 1 1 A 39 39 ASN C C 39 177.500 177.794 -0.294 1
1 483 . 6 1 1 A 39 39 ASN CA C 39 55.780 56.442 -0.662 1
1 484 . 6 1 1 A 39 39 ASN CB C 39 37.450 39.211 -1.761 1
1 485 . 6 1 1 A 39 39 ASN N N 39 118.700 118.117 0.583 1
1 487 . 6 1 1 A 40 40 VAL H H 40 7.907 7.547 0.360 1
1 488 . 6 1 1 A 40 40 VAL HA H 40 3.629 3.458 0.171 1
1 496 . 6 1 1 A 40 40 VAL C C 40 177.500 177.758 -0.258 1
1 497 . 6 1 1 A 40 40 VAL CA C 40 67.080 66.411 0.669 1
1 498 . 6 1 1 A 40 40 VAL CB C 40 31.390 31.245 0.145 1
1 501 . 6 1 1 A 40 40 VAL N N 40 120.400 118.497 1.903 1
1 502 . 6 1 1 A 41 41 ILE H H 41 8.103 8.603 -0.500 1
1 503 . 6 1 1 A 41 41 ILE HA H 41 3.401 3.669 -0.268 1
1 513 . 6 1 1 A 41 41 ILE C C 41 178.000 178.485 -0.485 1
1 514 . 6 1 1 A 41 41 ILE CA C 41 66.430 65.203 1.227 1
1 515 . 6 1 1 A 41 41 ILE CB C 41 38.050 37.564 0.486 1
1 519 . 6 1 1 A 41 41 ILE N N 41 120.600 119.388 1.212 1
1 520 . 6 1 1 A 42 42 GLU H H 42 8.150 7.930 0.220 1
1 521 . 6 1 1 A 42 42 GLU HA H 42 4.062 4.055 0.007 1
1 526 . 6 1 1 A 42 42 GLU C C 42 178.500 178.265 0.235 1
1 527 . 6 1 1 A 42 42 GLU CA C 42 59.120 59.188 -0.068 1
1 528 . 6 1 1 A 42 42 GLU CB C 42 28.160 29.004 -0.844 1
1 530 . 6 1 1 A 42 42 GLU N N 42 119.900 122.511 -2.611 1
1 531 . 6 1 1 A 43 43 ASP H H 43 8.453 9.229 -0.776 1
1 532 . 6 1 1 A 43 43 ASP HA H 43 4.445 4.416 0.029 1
1 535 . 6 1 1 A 43 43 ASP C C 43 178.400 178.613 -0.213 1
1 536 . 6 1 1 A 43 43 ASP CA C 43 56.490 57.912 -1.422 1
1 537 . 6 1 1 A 43 43 ASP CB C 43 37.820 41.863 -4.043 1
1 538 . 6 1 1 A 43 43 ASP N N 43 119.700 120.138 -0.438 1
1 539 . 6 1 1 A 44 44 ILE H H 44 8.544 7.890 0.654 1
1 540 . 6 1 1 A 44 44 ILE HA H 44 3.590 3.785 -0.195 1
1 550 . 6 1 1 A 44 44 ILE C C 44 177.800 177.841 -0.041 1
1 551 . 6 1 1 A 44 44 ILE CA C 44 66.320 65.364 0.956 1
1 552 . 6 1 1 A 44 44 ILE CB C 44 37.690 38.088 -0.398 1
1 556 . 6 1 1 A 44 44 ILE N N 44 121.500 119.622 1.878 1
1 557 . 6 1 1 A 45 45 HIS H H 45 8.261 8.417 -0.156 1
1 558 . 6 1 1 A 45 45 HIS HA H 45 4.255 4.124 0.131 1
1 562 . 6 1 1 A 45 45 HIS C C 45 177.200 177.586 -0.386 1
1 563 . 6 1 1 A 45 45 HIS CA C 45 59.580 59.942 -0.362 1
1 564 . 6 1 1 A 45 45 HIS CB C 45 27.790 30.280 -2.490 1
1 565 . 6 1 1 A 45 45 HIS N N 45 118.800 119.804 -1.004 1
1 566 . 6 1 1 A 46 46 ASP H H 46 8.680 8.364 0.316 1
1 567 . 6 1 1 A 46 46 ASP HA H 46 4.338 4.581 -0.243 1
1 570 . 6 1 1 A 46 46 ASP C C 46 178.700 177.652 1.048 1
1 571 . 6 1 1 A 46 46 ASP CA C 46 57.010 55.373 1.637 1
1 572 . 6 1 1 A 46 46 ASP CB C 46 39.400 41.019 -1.619 1
1 573 . 6 1 1 A 46 46 ASP N N 46 119.200 118.398 0.802 1
1 574 . 6 1 1 A 47 47 PHE H H 47 8.380 9.387 -1.007 1
1 575 . 6 1 1 A 47 47 PHE HA H 47 4.070 4.235 -0.165 1
1 580 . 6 1 1 A 47 47 PHE C C 47 178.600 177.760 0.840 1
1 581 . 6 1 1 A 47 47 PHE CA C 47 61.250 60.117 1.133 1
1 582 . 6 1 1 A 47 47 PHE CB C 47 39.570 39.923 -0.353 1
1 583 . 6 1 1 A 47 47 PHE N N 47 121.800 120.758 1.042 1
1 584 . 6 1 1 A 48 48 MET H H 48 8.366 8.170 0.196 1
1 585 . 6 1 1 A 48 48 MET HA H 48 3.998 4.683 -0.685 1
1 590 . 6 1 1 A 48 48 MET C C 48 177.400 176.771 0.629 1
1 591 . 6 1 1 A 48 48 MET CA C 48 58.470 57.571 0.899 1
1 592 . 6 1 1 A 48 48 MET CB C 48 33.170 32.785 0.385 1
1 594 . 6 1 1 A 48 48 MET N N 48 117.700 117.103 0.597 1
1 595 . 6 1 1 A 49 49 GLN H H 49 7.659 8.346 -0.687 1
1 596 . 6 1 1 A 49 49 GLN HA H 49 4.258 4.574 -0.316 1
1 603 . 6 1 1 A 49 49 GLN C C 49 176.700 177.889 -1.189 1
1 604 . 6 1 1 A 49 49 GLN CA C 49 56.380 56.359 0.021 1
1 605 . 6 1 1 A 49 49 GLN CB C 49 28.980 30.649 -1.669 1
1 607 . 6 1 1 A 49 49 GLN N N 49 116.700 115.886 0.814 1
1 609 . 6 1 1 A 50 50 GLY H H 50 7.685 8.403 -0.718 1
1 610 . 6 1 1 A 50 50 GLY HA2 H 50 3.998 3.885 0.113 1
1 611 . 6 1 1 A 50 50 GLY HA3 H 50 3.998 3.912 0.086 1
1 612 . 6 1 1 A 50 50 GLY C C 50 174.900 175.118 -0.218 1
1 613 . 6 1 1 A 50 50 GLY CA C 50 45.460 45.720 -0.260 1
1 614 . 6 1 1 A 50 50 GLY N N 50 106.400 108.802 -2.402 1
1 615 . 6 1 1 A 51 51 GLY H H 51 8.031 9.388 -1.357 1
1 616 . 6 1 1 A 51 51 GLY HA2 H 51 3.817 3.890 -0.073 1
1 617 . 6 1 1 A 51 51 GLY HA3 H 51 3.817 3.890 -0.073 1
1 618 . 6 1 1 A 51 51 GLY C C 51 174.500 174.423 0.077 1
1 619 . 6 1 1 A 51 51 GLY CA C 51 45.190 45.633 -0.443 1
1 620 . 6 1 1 A 51 51 GLY N N 51 108.900 108.786 0.114 1
1 621 . 6 1 1 A 52 52 GLY H H 52 8.126 8.354 -0.228 1
1 622 . 6 1 1 A 52 52 GLY HA2 H 52 3.362 3.654 -0.292 1
1 623 . 6 1 1 A 52 52 GLY HA3 H 52 3.362 3.959 -0.597 1
1 624 . 6 1 1 A 52 52 GLY C C 52 173.300 174.247 -0.947 1
1 625 . 6 1 1 A 52 52 GLY CA C 52 45.120 45.181 -0.061 1
1 626 . 6 1 1 A 52 52 GLY N N 52 108.100 107.482 0.618 1
1 627 . 6 1 1 A 53 53 SER H H 53 7.594 7.902 -0.308 1
1 628 . 6 1 1 A 53 53 SER HA H 53 4.530 4.667 -0.137 1
1 631 . 6 1 1 A 53 53 SER C C 53 175.300 175.159 0.141 1
1 632 . 6 1 1 A 53 53 SER CA C 53 57.770 57.172 0.598 1
1 633 . 6 1 1 A 53 53 SER CB C 53 64.750 61.328 3.422 1
1 634 . 6 1 1 A 53 53 SER N N 53 114.100 116.151 -2.051 1
1 635 . 6 1 1 A 54 54 GLY H H 54 9.003 8.576 0.427 1
1 636 . 6 1 1 A 54 54 GLY HA2 H 54 4.037 3.945 0.092 1
1 637 . 6 1 1 A 54 54 GLY HA3 H 54 3.911 4.008 -0.097 1
1 638 . 6 1 1 A 54 54 GLY C C 54 176.500 175.547 0.953 1
1 639 . 6 1 1 A 54 54 GLY CA C 54 47.040 46.732 0.308 1
1 640 . 6 1 1 A 54 54 GLY N N 54 110.400 111.396 -0.996 1
1 641 . 6 1 1 A 55 55 GLY H H 55 8.617 8.201 0.416 1
1 642 . 6 1 1 A 55 55 GLY HA2 H 55 3.946 3.813 0.133 1
1 643 . 6 1 1 A 55 55 GLY HA3 H 55 3.946 3.828 0.118 1
1 644 . 6 1 1 A 55 55 GLY C C 55 176.400 175.986 0.414 1
1 645 . 6 1 1 A 55 55 GLY CA C 55 46.630 47.020 -0.390 1
1 646 . 6 1 1 A 55 55 GLY N N 55 109.800 109.445 0.355 1
1 647 . 6 1 1 A 56 56 LYS H H 56 7.876 8.253 -0.377 1
1 648 . 6 1 1 A 56 56 LYS HA H 56 4.195 4.154 0.041 1
1 657 . 6 1 1 A 56 56 LYS C C 56 178.600 178.697 -0.097 1
1 658 . 6 1 1 A 56 56 LYS CA C 56 57.960 58.800 -0.840 1
1 659 . 6 1 1 A 56 56 LYS CB C 56 32.110 32.460 -0.350 1
1 663 . 6 1 1 A 56 56 LYS N N 56 121.800 122.512 -0.712 1
1 664 . 6 1 1 A 57 57 LEU H H 57 8.153 7.857 0.296 1
1 665 . 6 1 1 A 57 57 LEU HA H 57 3.992 4.659 -0.667 1
1 675 . 6 1 1 A 57 57 LEU C C 57 178.400 178.854 -0.454 1
1 676 . 6 1 1 A 57 57 LEU CA C 57 58.190 57.522 0.668 1
1 677 . 6 1 1 A 57 57 LEU CB C 57 41.360 42.192 -0.832 1
1 681 . 6 1 1 A 57 57 LEU N N 57 120.700 121.828 -1.128 1
1 682 . 6 1 1 A 58 58 GLN H H 58 8.019 8.060 -0.041 1
1 683 . 6 1 1 A 58 58 GLN HA H 58 3.942 4.143 -0.201 1
1 690 . 6 1 1 A 58 58 GLN C C 58 179.100 178.158 0.942 1
1 691 . 6 1 1 A 58 58 GLN CA C 58 59.360 58.431 0.929 1
1 692 . 6 1 1 A 58 58 GLN CB C 58 28.030 28.352 -0.322 1
1 694 . 6 1 1 A 58 58 GLN N N 58 117.400 117.757 -0.357 1
1 696 . 6 1 1 A 59 59 GLU H H 59 7.838 7.992 -0.154 1
1 697 . 6 1 1 A 59 59 GLU HA H 59 4.030 4.125 -0.095 1
1 702 . 6 1 1 A 59 59 GLU C C 59 178.600 179.172 -0.572 1
1 703 . 6 1 1 A 59 59 GLU CA C 59 59.250 58.919 0.331 1
1 704 . 6 1 1 A 59 59 GLU CB C 59 28.960 29.840 -0.880 1
1 706 . 6 1 1 A 59 59 GLU N N 59 119.900 120.315 -0.415 1
1 707 . 6 1 1 A 60 60 MET H H 60 8.223 8.090 0.133 1
1 708 . 6 1 1 A 60 60 MET HA H 60 3.966 4.260 -0.294 1
1 713 . 6 1 1 A 60 60 MET C C 60 177.900 178.134 -0.234 1
1 714 . 6 1 1 A 60 60 MET CA C 60 59.350 57.307 2.043 1
1 715 . 6 1 1 A 60 60 MET CB C 60 33.210 32.178 1.032 1
1 717 . 6 1 1 A 60 60 MET N N 60 120.100 118.478 1.622 1
1 718 . 6 1 1 A 61 61 MET H H 61 8.134 8.073 0.061 1
1 719 . 6 1 1 A 61 61 MET HA H 61 4.195 4.360 -0.165 1
1 724 . 6 1 1 A 61 61 MET C C 61 179.100 177.929 1.171 1
1 725 . 6 1 1 A 61 61 MET CA C 61 58.210 58.627 -0.417 1
1 726 . 6 1 1 A 61 61 MET CB C 61 31.340 32.390 -1.050 1
1 728 . 6 1 1 A 61 61 MET N N 61 117.000 120.407 -3.407 1
1 729 . 6 1 1 A 62 62 LYS H H 62 7.782 7.750 0.032 1
1 730 . 6 1 1 A 62 62 LYS HA H 62 4.085 4.084 0.001 1
1 739 . 6 1 1 A 62 62 LYS C C 62 179.600 178.739 0.861 1
1 740 . 6 1 1 A 62 62 LYS CA C 62 59.610 59.364 0.246 1
1 741 . 6 1 1 A 62 62 LYS CB C 62 32.180 32.078 0.102 1
1 745 . 6 1 1 A 62 62 LYS N N 62 120.600 117.620 2.980 1
1 746 . 6 1 1 A 63 63 GLU H H 63 8.041 7.878 0.163 1
1 747 . 6 1 1 A 63 63 GLU HA H 63 4.057 3.803 0.254 1
1 752 . 6 1 1 A 63 63 GLU C C 63 178.900 178.943 -0.043 1
1 753 . 6 1 1 A 63 63 GLU CA C 63 59.170 58.881 0.289 1
1 754 . 6 1 1 A 63 63 GLU CB C 63 29.000 28.845 0.155 1
1 756 . 6 1 1 A 63 63 GLU N N 63 120.200 119.775 0.425 1
1 757 . 6 1 1 A 64 64 PHE H H 64 8.604 8.933 -0.329 1
1 758 . 6 1 1 A 64 64 PHE HA H 64 4.155 3.804 0.351 1
1 763 . 6 1 1 A 64 64 PHE C C 64 177.800 177.981 -0.181 1
1 764 . 6 1 1 A 64 64 PHE CA C 64 59.820 60.989 -1.169 1
1 765 . 6 1 1 A 64 64 PHE CB C 64 38.470 38.234 0.236 1
1 766 . 6 1 1 A 64 64 PHE N N 64 119.700 121.138 -1.438 1
1 767 . 6 1 1 A 65 65 GLN H H 65 8.177 8.004 0.173 1
1 768 . 6 1 1 A 65 65 GLN HA H 65 3.637 4.283 -0.646 1
1 775 . 6 1 1 A 65 65 GLN C C 65 177.800 177.479 0.321 1
1 776 . 6 1 1 A 65 65 GLN CA C 65 58.970 58.358 0.612 1
1 777 . 6 1 1 A 65 65 GLN CB C 65 28.280 28.672 -0.392 1
1 779 . 6 1 1 A 65 65 GLN N N 65 118.500 118.846 -0.346 1
1 781 . 6 1 1 A 66 66 GLN H H 66 7.622 7.769 -0.147 1
1 782 . 6 1 1 A 66 66 GLN HA H 66 4.040 4.653 -0.613 1
1 789 . 6 1 1 A 66 66 GLN C C 66 178.600 178.631 -0.031 1
1 790 . 6 1 1 A 66 66 GLN CA C 66 59.150 57.935 1.215 1
1 791 . 6 1 1 A 66 66 GLN CB C 66 28.230 28.481 -0.251 1
1 793 . 6 1 1 A 66 66 GLN N N 66 117.400 118.061 -0.661 1
1 795 . 6 1 1 A 67 67 VAL H H 67 7.744 7.905 -0.161 1
1 796 . 6 1 1 A 67 67 VAL HA H 67 3.785 3.783 0.002 1
1 804 . 6 1 1 A 67 67 VAL C C 67 177.500 177.825 -0.325 1
1 805 . 6 1 1 A 67 67 VAL CA C 67 66.220 66.290 -0.070 1
1 806 . 6 1 1 A 67 67 VAL CB C 67 31.390 32.008 -0.618 1
1 809 . 6 1 1 A 67 67 VAL N N 67 119.500 120.869 -1.369 1
1 810 . 6 1 1 A 68 68 LEU H H 68 7.983 8.353 -0.370 1
1 811 . 6 1 1 A 68 68 LEU HA H 68 3.825 4.132 -0.307 1
1 821 . 6 1 1 A 68 68 LEU C C 68 179.100 178.834 0.266 1
1 822 . 6 1 1 A 68 68 LEU CA C 68 58.740 58.281 0.459 1
1 823 . 6 1 1 A 68 68 LEU CB C 68 41.090 41.712 -0.622 1
1 827 . 6 1 1 A 68 68 LEU N N 68 120.400 119.091 1.309 1
1 828 . 6 1 1 A 69 69 ASP H H 69 8.179 8.863 -0.684 1
1 829 . 6 1 1 A 69 69 ASP HA H 69 4.380 4.372 0.008 1
1 832 . 6 1 1 A 69 69 ASP C C 69 178.900 177.918 0.982 1
1 833 . 6 1 1 A 69 69 ASP CA C 69 57.320 56.394 0.926 1
1 834 . 6 1 1 A 69 69 ASP CB C 69 40.040 39.758 0.282 1
1 835 . 6 1 1 A 69 69 ASP N N 69 119.000 117.654 1.346 1
1 836 . 6 1 1 A 70 70 GLU H H 70 8.166 8.378 -0.212 1
1 837 . 6 1 1 A 70 70 GLU HA H 70 4.082 4.232 -0.150 1
1 842 . 6 1 1 A 70 70 GLU C C 70 179.600 178.846 0.754 1
1 843 . 6 1 1 A 70 70 GLU CA C 70 59.010 58.768 0.242 1
1 844 . 6 1 1 A 70 70 GLU CB C 70 28.900 30.321 -1.421 1
1 846 . 6 1 1 A 70 70 GLU N N 70 120.500 119.964 0.536 1
1 847 . 6 1 1 A 71 71 ILE H H 71 8.415 8.280 0.135 1
1 848 . 6 1 1 A 71 71 ILE HA H 71 3.790 3.564 0.226 1
1 858 . 6 1 1 A 71 71 ILE C C 71 177.400 177.473 -0.073 1
1 859 . 6 1 1 A 71 71 ILE CA C 71 64.890 64.438 0.452 1
1 860 . 6 1 1 A 71 71 ILE CB C 71 37.680 36.184 1.496 1
1 864 . 6 1 1 A 71 71 ILE N N 71 119.200 120.421 -1.221 1
1 865 . 6 1 1 A 72 72 LYS H H 72 8.248 8.641 -0.393 1
1 866 . 6 1 1 A 72 72 LYS HA H 72 3.625 3.431 0.194 1
1 873 . 6 1 1 A 72 72 LYS C C 72 178.400 178.559 -0.159 1
1 874 . 6 1 1 A 72 72 LYS CA C 72 59.850 59.432 0.418 1
1 875 . 6 1 1 A 72 72 LYS CB C 72 32.070 32.384 -0.314 1
1 879 . 6 1 1 A 72 72 LYS N N 72 120.800 121.457 -0.657 1
1 880 . 6 1 1 A 73 73 GLN H H 73 7.937 7.884 0.053 1
1 881 . 6 1 1 A 73 73 GLN HA H 73 4.042 3.935 0.107 1
1 888 . 6 1 1 A 73 73 GLN C C 73 178.400 177.801 0.599 1
1 889 . 6 1 1 A 73 73 GLN CA C 73 58.510 59.261 -0.751 1
1 890 . 6 1 1 A 73 73 GLN CB C 73 28.430 28.243 0.187 1
1 892 . 6 1 1 A 73 73 GLN N N 73 117.000 117.964 -0.964 1
1 894 . 6 1 1 A 74 74 GLN H H 74 7.712 7.556 0.156 1
1 895 . 6 1 1 A 74 74 GLN HA H 74 4.080 3.929 0.151 1
1 902 . 6 1 1 A 74 74 GLN C C 74 177.800 178.366 -0.566 1
1 903 . 6 1 1 A 74 74 GLN CA C 74 57.270 58.941 -1.671 1
1 904 . 6 1 1 A 74 74 GLN CB C 74 28.700 27.626 1.074 1
1 906 . 6 1 1 A 74 74 GLN N N 74 118.200 118.352 -0.152 1
1 908 . 6 1 1 A 75 75 LEU H H 75 7.956 7.810 0.146 1
1 909 . 6 1 1 A 75 75 LEU HA H 75 4.212 4.273 -0.061 1
1 919 . 6 1 1 A 75 75 LEU CA C 75 56.660 57.774 -1.114 1
1 920 . 6 1 1 A 75 75 LEU CB C 75 42.000 41.332 0.668 1
1 924 . 6 1 1 A 75 75 LEU N N 75 120.700 120.315 0.385 1
1 925 . 6 1 1 A 76 76 GLN H H 76 8.315 8.376 -0.061 1
1 926 . 6 1 1 A 76 76 GLN HA H 76 4.113 4.242 -0.129 1
1 933 . 6 1 1 A 76 76 GLN C C 76 177.100 176.185 0.915 1
1 934 . 6 1 1 A 76 76 GLN CA C 76 57.400 57.931 -0.531 1
1 935 . 6 1 1 A 76 76 GLN CB C 76 28.640 28.442 0.198 1
1 937 . 6 1 1 A 76 76 GLN N N 76 120.100 116.576 3.524 1
1 939 . 6 1 1 A 77 77 GLY H H 77 8.021 7.997 0.024 1
1 940 . 6 1 1 A 77 77 GLY HA2 H 77 4.042 4.023 0.019 1
1 941 . 6 1 1 A 77 77 GLY HA3 H 77 3.869 4.034 -0.165 1
1 942 . 6 1 1 A 77 77 GLY C C 77 174.600 174.171 0.429 1
1 943 . 6 1 1 A 77 77 GLY CA C 77 45.430 44.512 0.918 1
1 944 . 6 1 1 A 77 77 GLY N N 77 107.700 108.431 -0.731 1
1 945 . 6 1 1 A 78 78 GLY H H 78 7.819 8.694 -0.875 1
1 946 . 6 1 1 A 78 78 GLY HA2 H 78 4.208 3.919 0.289 1
1 947 . 6 1 1 A 78 78 GLY HA3 H 78 3.801 3.929 -0.128 1
1 948 . 6 1 1 A 78 78 GLY C C 78 173.900 174.495 -0.595 1
1 949 . 6 1 1 A 78 78 GLY CA C 78 45.140 46.720 -1.580 1
1 950 . 6 1 1 A 78 78 GLY N N 78 107.100 109.194 -2.094 1
1 951 . 6 1 1 A 79 79 ASP H H 79 7.912 7.811 0.101 1
1 952 . 6 1 1 A 79 79 ASP HA H 79 4.722 4.998 -0.276 1
1 955 . 6 1 1 A 79 79 ASP C C 79 176.200 176.702 -0.502 1
1 956 . 6 1 1 A 79 79 ASP CA C 79 53.210 52.816 0.394 1
1 957 . 6 1 1 A 79 79 ASP CB C 79 40.160 40.342 -0.182 1
1 958 . 6 1 1 A 79 79 ASP N N 79 119.800 118.904 0.896 1
1 959 . 6 1 1 A 80 80 ASN H H 80 8.450 8.388 0.062 1
1 960 . 6 1 1 A 80 80 ASN HA H 80 4.593 4.494 0.099 1
1 965 . 6 1 1 A 80 80 ASN C C 80 177.300 177.185 0.115 1
1 966 . 6 1 1 A 80 80 ASN CA C 80 54.680 55.388 -0.708 1
1 967 . 6 1 1 A 80 80 ASN CB C 80 38.790 38.184 0.606 1
1 968 . 6 1 1 A 80 80 ASN N N 80 121.700 120.919 0.781 1
1 970 . 6 1 1 A 81 81 SER H H 81 8.444 7.970 0.474 1
1 971 . 6 1 1 A 81 81 SER HA H 81 4.263 4.192 0.071 1
1 974 . 6 1 1 A 81 81 SER C C 81 176.100 176.430 -0.330 1
1 975 . 6 1 1 A 81 81 SER CA C 81 61.470 61.786 -0.316 1
1 976 . 6 1 1 A 81 81 SER CB C 81 61.470 63.061 -1.591 1
1 977 . 6 1 1 A 81 81 SER N N 81 117.100 115.885 1.215 1
1 978 . 6 1 1 A 82 82 LEU H H 82 7.929 8.059 -0.130 1
1 979 . 6 1 1 A 82 82 LEU HA H 82 4.332 3.927 0.405 1
1 989 . 6 1 1 A 82 82 LEU C C 82 177.400 179.199 -1.799 1
1 990 . 6 1 1 A 82 82 LEU CA C 82 55.060 57.794 -2.734 1
1 991 . 6 1 1 A 82 82 LEU CB C 82 41.940 41.530 0.410 1
1 995 . 6 1 1 A 82 82 LEU N N 82 120.400 120.859 -0.459 1
1 996 . 6 1 1 A 83 83 HIS H H 83 8.014 7.972 0.042 1
1 997 . 6 1 1 A 83 83 HIS HA H 83 4.173 4.142 0.031 1
1 1000 . 6 1 1 A 83 83 HIS C C 83 176.100 176.581 -0.481 1
1 1001 . 6 1 1 A 83 83 HIS CA C 83 59.940 59.776 0.164 1
1 1002 . 6 1 1 A 83 83 HIS CB C 83 28.050 30.194 -2.144 1
1 1003 . 6 1 1 A 83 83 HIS N N 83 119.400 118.414 0.986 1
1 1004 . 6 1 1 A 84 84 ASN H H 84 8.598 8.183 0.415 1
1 1005 . 6 1 1 A 84 84 ASN HA H 84 4.735 4.940 -0.205 1
1 1010 . 6 1 1 A 84 84 ASN C C 84 177.400 177.300 0.100 1
1 1011 . 6 1 1 A 84 84 ASN CA C 84 55.790 55.055 0.735 1
1 1012 . 6 1 1 A 84 84 ASN CB C 84 37.520 39.095 -1.575 1
1 1013 . 6 1 1 A 84 84 ASN N N 84 118.100 116.724 1.376 1
1 1015 . 6 1 1 A 85 85 VAL H H 85 7.933 7.656 0.277 1
1 1016 . 6 1 1 A 85 85 VAL HA H 85 3.849 3.849 0.000 1
1 1024 . 6 1 1 A 85 85 VAL C C 85 177.100 178.057 -0.957 1
1 1025 . 6 1 1 A 85 85 VAL CA C 85 65.490 65.541 -0.051 1
1 1026 . 6 1 1 A 85 85 VAL CB C 85 31.760 32.050 -0.290 1
1 1029 . 6 1 1 A 85 85 VAL N N 85 120.500 119.937 0.563 1
1 1030 . 6 1 1 A 86 86 HIS H H 86 8.460 9.363 -0.903 1
1 1031 . 6 1 1 A 86 86 HIS HA H 86 4.054 4.135 -0.081 1
1 1035 . 6 1 1 A 86 86 HIS C C 86 176.300 177.046 -0.746 1
1 1036 . 6 1 1 A 86 86 HIS CA C 86 59.860 59.271 0.589 1
1 1037 . 6 1 1 A 86 86 HIS CB C 86 29.670 30.095 -0.425 1
1 1038 . 6 1 1 A 86 86 HIS N N 86 119.300 119.300 0.000 1
1 1039 . 6 1 1 A 87 87 GLU H H 87 7.897 8.491 -0.594 1
1 1040 . 6 1 1 A 87 87 GLU HA H 87 3.838 3.717 0.121 1
1 1045 . 6 1 1 A 87 87 GLU C C 87 178.300 178.479 -0.179 1
1 1046 . 6 1 1 A 87 87 GLU CA C 87 58.690 57.940 0.750 1
1 1047 . 6 1 1 A 87 87 GLU CB C 87 28.460 29.028 -0.568 1
1 1049 . 6 1 1 A 87 87 GLU N N 87 117.100 117.257 -0.157 1
1 1050 . 6 1 1 A 88 88 ASN H H 88 8.103 8.719 -0.616 1
1 1051 . 6 1 1 A 88 88 ASN HA H 88 4.503 4.579 -0.076 1
1 1056 . 6 1 1 A 88 88 ASN C C 88 177.700 177.833 -0.133 1
1 1057 . 6 1 1 A 88 88 ASN CA C 88 55.990 55.721 0.269 1
1 1058 . 6 1 1 A 88 88 ASN CB C 88 39.010 38.628 0.382 1
1 1059 . 6 1 1 A 88 88 ASN N N 88 118.400 118.658 -0.258 1
1 1061 . 6 1 1 A 89 89 ILE H H 89 8.501 7.629 0.872 1
1 1062 . 6 1 1 A 89 89 ILE HA H 89 3.670 3.770 -0.100 1
1 1072 . 6 1 1 A 89 89 ILE C C 89 177.000 177.852 -0.852 1
1 1073 . 6 1 1 A 89 89 ILE CA C 89 65.390 65.360 0.030 1
1 1074 . 6 1 1 A 89 89 ILE CB C 89 37.440 37.775 -0.335 1
1 1078 . 6 1 1 A 89 89 ILE N N 89 118.700 120.291 -1.591 1
1 1079 . 6 1 1 A 90 90 LYS H H 90 8.017 7.986 0.031 1
1 1080 . 6 1 1 A 90 90 LYS HA H 90 3.775 3.911 -0.136 1
1 1089 . 6 1 1 A 90 90 LYS C C 90 178.800 178.570 0.230 1
1 1090 . 6 1 1 A 90 90 LYS CA C 90 60.450 59.731 0.719 1
1 1091 . 6 1 1 A 90 90 LYS CB C 90 32.110 32.132 -0.022 1
1 1095 . 6 1 1 A 90 90 LYS N N 90 120.900 120.172 0.728 1
1 1096 . 6 1 1 A 91 91 GLU H H 91 7.732 8.166 -0.434 1
1 1097 . 6 1 1 A 91 91 GLU HA H 91 4.083 4.160 -0.077 1
1 1102 . 6 1 1 A 91 91 GLU C C 91 179.100 179.275 -0.175 1
1 1103 . 6 1 1 A 91 91 GLU CA C 91 59.120 58.905 0.215 1
1 1104 . 6 1 1 A 91 91 GLU CB C 91 28.810 30.032 -1.222 1
1 1106 . 6 1 1 A 91 91 GLU N N 91 119.300 118.833 0.467 1
1 1107 . 6 1 1 A 92 92 ILE H H 92 8.110 9.169 -1.059 1
1 1108 . 6 1 1 A 92 92 ILE HA H 92 3.685 3.717 -0.032 1
1 1118 . 6 1 1 A 92 92 ILE C C 92 178.000 178.469 -0.469 1
1 1119 . 6 1 1 A 92 92 ILE CA C 92 65.900 65.516 0.384 1
1 1120 . 6 1 1 A 92 92 ILE CB C 92 38.400 38.175 0.225 1
1 1124 . 6 1 1 A 92 92 ILE N N 92 121.100 120.904 0.196 1
1 1125 . 6 1 1 A 93 93 PHE H H 93 8.651 8.945 -0.294 1
1 1126 . 6 1 1 A 93 93 PHE HA H 93 3.873 3.724 0.149 1
1 1133 . 6 1 1 A 93 93 PHE C C 93 177.100 177.894 -0.794 1
1 1134 . 6 1 1 A 93 93 PHE CA C 93 61.020 61.212 -0.192 1
1 1135 . 6 1 1 A 93 93 PHE CB C 93 38.560 38.462 0.098 1
1 1138 . 6 1 1 A 93 93 PHE N N 93 119.400 121.228 -1.828 1
1 1139 . 6 1 1 A 94 94 HIS H H 94 8.126 7.555 0.571 1
1 1140 . 6 1 1 A 94 94 HIS HA H 94 4.368 3.708 0.660 1
1 1145 . 6 1 1 A 94 94 HIS C C 94 177.100 176.663 0.437 1
1 1146 . 6 1 1 A 94 94 HIS CA C 94 58.310 57.569 0.741 1
1 1147 . 6 1 1 A 94 94 HIS CB C 94 27.910 29.454 -1.544 1
1 1148 . 6 1 1 A 94 94 HIS N N 94 116.400 118.300 -1.900 1
1 1149 . 6 1 1 A 95 95 HIS H H 95 8.058 8.411 -0.353 1
1 1150 . 6 1 1 A 95 95 HIS HA H 95 4.465 4.053 0.412 1
1 1154 . 6 1 1 A 95 95 HIS C C 95 177.300 177.094 0.206 1
1 1155 . 6 1 1 A 95 95 HIS CA C 95 57.900 58.979 -1.079 1
1 1156 . 6 1 1 A 95 95 HIS CB C 95 28.490 30.151 -1.661 1
1 1157 . 6 1 1 A 95 95 HIS N N 95 117.000 118.006 -1.006 1
1 1158 . 6 1 1 A 96 96 LEU H H 96 8.525 8.205 0.320 1
1 1159 . 6 1 1 A 96 96 LEU HA H 96 3.865 3.801 0.064 1
1 1169 . 6 1 1 A 96 96 LEU C C 96 178.300 178.469 -0.169 1
1 1170 . 6 1 1 A 96 96 LEU CA C 96 58.250 58.115 0.135 1
1 1171 . 6 1 1 A 96 96 LEU CB C 96 41.720 41.985 -0.265 1
1 1175 . 6 1 1 A 96 96 LEU N N 96 121.300 120.549 0.751 1
1 1176 . 6 1 1 A 97 97 GLU H H 97 8.076 7.810 0.266 1
1 1177 . 6 1 1 A 97 97 GLU HA H 97 3.719 4.197 -0.478 1
1 1182 . 6 1 1 A 97 97 GLU C C 97 178.300 178.319 -0.019 1
1 1183 . 6 1 1 A 97 97 GLU CA C 97 59.300 58.936 0.364 1
1 1184 . 6 1 1 A 97 97 GLU CB C 97 28.960 29.550 -0.590 1
1 1186 . 6 1 1 A 97 97 GLU N N 97 117.100 117.683 -0.583 1
1 1187 . 6 1 1 A 98 98 GLU H H 98 7.329 7.569 -0.240 1
1 1188 . 6 1 1 A 98 98 GLU HA H 98 4.024 4.164 -0.140 1
1 1193 . 6 1 1 A 98 98 GLU C C 98 177.900 179.010 -1.110 1
1 1194 . 6 1 1 A 98 98 GLU CA C 98 58.190 58.196 -0.006 1
1 1195 . 6 1 1 A 98 98 GLU CB C 98 29.120 30.094 -0.974 1
1 1197 . 6 1 1 A 98 98 GLU N N 98 116.000 120.135 -4.135 1
1 1198 . 6 1 1 A 99 99 LEU H H 99 7.535 7.858 -0.323 1
1 1199 . 6 1 1 A 99 99 LEU HA H 99 4.183 4.096 0.087 1
1 1209 . 6 1 1 A 99 99 LEU C C 99 178.100 177.601 0.499 1
1 1210 . 6 1 1 A 99 99 LEU CA C 99 56.440 57.028 -0.588 1
1 1211 . 6 1 1 A 99 99 LEU CB C 99 43.010 41.496 1.514 1
1 1215 . 6 1 1 A 99 99 LEU N N 99 118.200 119.949 -1.749 1
1 1216 . 6 1 1 A 100 100 VAL H H 100 7.561 7.014 0.547 1
1 1217 . 6 1 1 A 100 100 VAL HA H 100 4.033 4.257 -0.224 1
1 1225 . 6 1 1 A 100 100 VAL C C 100 175.400 177.592 -2.192 1
1 1226 . 6 1 1 A 100 100 VAL CA C 100 62.430 64.088 -1.658 1
1 1227 . 6 1 1 A 100 100 VAL CB C 100 32.050 32.960 -0.910 1
1 1230 . 6 1 1 A 100 100 VAL N N 100 114.800 113.111 1.689 1
1 1231 . 6 1 1 A 101 101 HIS H H 101 7.827 7.999 -0.172 1
1 1232 . 6 1 1 A 101 101 HIS HA H 101 4.630 4.105 0.525 1
1 1237 . 6 1 1 A 101 101 HIS C C 101 173.500 176.123 -2.623 1
1 1238 . 6 1 1 A 101 101 HIS CA C 101 55.410 59.578 -4.168 1
1 1239 . 6 1 1 A 101 101 HIS CB C 101 28.870 30.161 -1.291 1
1 1240 . 6 1 1 A 101 101 HIS N N 101 120.300 123.101 -2.801 1
1 10 . 7 1 1 A 2 2 TYR H H 2 8.688 7.415 1.273 1
1 11 . 7 1 1 A 2 2 TYR HA H 2 4.737 4.184 0.553 1
1 16 . 7 1 1 A 2 2 TYR C C 2 175.900 176.171 -0.271 1
1 17 . 7 1 1 A 2 2 TYR CA C 2 57.920 60.642 -2.722 1
1 18 . 7 1 1 A 2 2 TYR CB C 2 38.340 38.847 -0.507 1
1 19 . 7 1 1 A 2 2 TYR N N 2 122.100 125.540 -3.440 1
1 20 . 7 1 1 A 3 3 GLY H H 3 8.434 7.902 0.532 1
1 21 . 7 1 1 A 3 3 GLY HA2 H 3 3.909 3.955 -0.046 1
1 22 . 7 1 1 A 3 3 GLY HA3 H 3 3.841 3.992 -0.151 1
1 23 . 7 1 1 A 3 3 GLY C C 3 174.300 175.942 -1.642 1
1 24 . 7 1 1 A 3 3 GLY CA C 3 46.050 45.207 0.843 1
1 25 . 7 1 1 A 3 3 GLY N N 3 111.100 108.011 3.089 1
1 26 . 7 1 1 A 4 4 LYS H H 4 8.060 8.388 -0.328 1
1 27 . 7 1 1 A 4 4 LYS HA H 4 4.297 4.094 0.203 1
1 36 . 7 1 1 A 4 4 LYS C C 4 178.000 179.083 -1.083 1
1 37 . 7 1 1 A 4 4 LYS CA C 4 56.930 59.453 -2.523 1
1 38 . 7 1 1 A 4 4 LYS CB C 4 32.680 32.114 0.566 1
1 42 . 7 1 1 A 4 4 LYS N N 4 119.500 121.834 -2.334 1
1 43 . 7 1 1 A 5 5 LEU H H 5 8.243 8.267 -0.024 1
1 44 . 7 1 1 A 5 5 LEU HA H 5 3.947 4.027 -0.080 1
1 54 . 7 1 1 A 5 5 LEU C C 5 177.900 178.756 -0.856 1
1 55 . 7 1 1 A 5 5 LEU CA C 5 57.930 57.917 0.013 1
1 56 . 7 1 1 A 5 5 LEU CB C 5 41.620 41.634 -0.014 1
1 60 . 7 1 1 A 5 5 LEU N N 5 120.800 120.761 0.039 1
1 61 . 7 1 1 A 6 6 ASN H H 6 8.256 8.396 -0.140 1
1 62 . 7 1 1 A 6 6 ASN HA H 6 4.252 4.318 -0.066 1
1 67 . 7 1 1 A 6 6 ASN C C 6 177.300 177.566 -0.266 1
1 68 . 7 1 1 A 6 6 ASN CA C 6 56.900 56.476 0.424 1
1 69 . 7 1 1 A 6 6 ASN CB C 6 38.200 37.931 0.269 1
1 70 . 7 1 1 A 6 6 ASN N N 6 116.200 116.949 -0.749 1
1 72 . 7 1 1 A 7 7 ASP H H 7 7.699 9.355 -1.656 1
1 73 . 7 1 1 A 7 7 ASP HA H 7 4.320 4.377 -0.057 1
1 76 . 7 1 1 A 7 7 ASP C C 7 178.000 177.788 0.212 1
1 77 . 7 1 1 A 7 7 ASP CA C 7 56.980 57.299 -0.319 1
1 78 . 7 1 1 A 7 7 ASP CB C 7 39.870 42.092 -2.222 1
1 79 . 7 1 1 A 7 7 ASP N N 7 119.100 118.344 0.756 1
1 80 . 7 1 1 A 8 8 LEU H H 8 7.580 8.771 -1.191 1
1 81 . 7 1 1 A 8 8 LEU HA H 8 4.091 4.212 -0.121 1
1 91 . 7 1 1 A 8 8 LEU C C 8 178.800 179.151 -0.351 1
1 92 . 7 1 1 A 8 8 LEU CA C 8 57.790 57.659 0.131 1
1 93 . 7 1 1 A 8 8 LEU CB C 8 41.880 41.826 0.054 1
1 97 . 7 1 1 A 8 8 LEU N N 8 120.400 119.077 1.323 1
1 98 . 7 1 1 A 9 9 LEU H H 9 8.125 9.171 -1.046 1
1 99 . 7 1 1 A 9 9 LEU HA H 9 3.891 4.033 -0.142 1
1 109 . 7 1 1 A 9 9 LEU C C 9 178.900 178.225 0.675 1
1 110 . 7 1 1 A 9 9 LEU CA C 9 58.350 58.538 -0.188 1
1 111 . 7 1 1 A 9 9 LEU CB C 9 41.510 41.968 -0.458 1
1 115 . 7 1 1 A 9 9 LEU N N 9 118.900 120.116 -1.216 1
1 116 . 7 1 1 A 10 10 GLU H H 10 8.011 9.160 -1.149 1
1 117 . 7 1 1 A 10 10 GLU HA H 10 4.072 4.186 -0.114 1
1 122 . 7 1 1 A 10 10 GLU C C 10 179.000 177.832 1.168 1
1 123 . 7 1 1 A 10 10 GLU CA C 10 59.090 59.537 -0.447 1
1 124 . 7 1 1 A 10 10 GLU CB C 10 27.910 29.580 -1.670 1
1 126 . 7 1 1 A 10 10 GLU N N 10 119.300 118.797 0.503 1
1 127 . 7 1 1 A 11 11 ASP H H 11 8.128 7.875 0.253 1
1 128 . 7 1 1 A 11 11 ASP HA H 11 4.383 4.555 -0.172 1
1 131 . 7 1 1 A 11 11 ASP C C 11 178.500 178.462 0.038 1
1 132 . 7 1 1 A 11 11 ASP CA C 11 56.580 56.727 -0.147 1
1 133 . 7 1 1 A 11 11 ASP CB C 11 38.600 40.892 -2.292 1
1 134 . 7 1 1 A 11 11 ASP N N 11 119.600 118.487 1.113 1
1 135 . 7 1 1 A 12 12 LEU H H 12 8.394 8.763 -0.369 1
1 136 . 7 1 1 A 12 12 LEU HA H 12 3.923 4.197 -0.274 1
1 146 . 7 1 1 A 12 12 LEU C C 12 178.200 178.516 -0.316 1
1 147 . 7 1 1 A 12 12 LEU CA C 12 57.880 57.984 -0.104 1
1 148 . 7 1 1 A 12 12 LEU CB C 12 41.850 41.775 0.075 1
1 152 . 7 1 1 A 12 12 LEU N N 12 120.500 121.351 -0.851 1
1 153 . 7 1 1 A 13 13 GLN H H 13 8.371 9.102 -0.731 1
1 154 . 7 1 1 A 13 13 GLN HA H 13 3.879 4.150 -0.271 1
1 161 . 7 1 1 A 13 13 GLN C C 13 178.600 178.158 0.442 1
1 162 . 7 1 1 A 13 13 GLN CA C 13 59.570 57.826 1.744 1
1 163 . 7 1 1 A 13 13 GLN CB C 13 28.440 27.166 1.274 1
1 165 . 7 1 1 A 13 13 GLN N N 13 118.400 116.748 1.652 1
1 167 . 7 1 1 A 14 14 GLU H H 14 7.913 7.883 0.030 1
1 168 . 7 1 1 A 14 14 GLU HA H 14 4.021 4.065 -0.044 1
1 173 . 7 1 1 A 14 14 GLU C C 14 179.000 178.436 0.564 1
1 174 . 7 1 1 A 14 14 GLU CA C 14 59.030 58.787 0.243 1
1 175 . 7 1 1 A 14 14 GLU CB C 14 28.720 29.537 -0.817 1
1 177 . 7 1 1 A 14 14 GLU N N 14 119.100 120.530 -1.430 1
1 178 . 7 1 1 A 15 15 VAL H H 15 7.991 7.852 0.139 1
1 179 . 7 1 1 A 15 15 VAL HA H 15 3.696 3.761 -0.065 1
1 187 . 7 1 1 A 15 15 VAL C C 15 178.300 177.841 0.459 1
1 188 . 7 1 1 A 15 15 VAL CA C 15 66.640 65.320 1.320 1
1 189 . 7 1 1 A 15 15 VAL CB C 15 31.470 31.451 0.019 1
1 192 . 7 1 1 A 15 15 VAL N N 15 120.300 118.717 1.583 1
1 193 . 7 1 1 A 16 16 LEU H H 16 8.172 7.759 0.413 1
1 194 . 7 1 1 A 16 16 LEU HA H 16 3.876 4.220 -0.344 1
1 204 . 7 1 1 A 16 16 LEU C C 16 178.400 178.364 0.036 1
1 205 . 7 1 1 A 16 16 LEU CA C 16 58.050 58.292 -0.242 1
1 206 . 7 1 1 A 16 16 LEU CB C 16 41.420 41.659 -0.239 1
1 210 . 7 1 1 A 16 16 LEU N N 16 119.700 124.828 -5.128 1
1 211 . 7 1 1 A 17 17 LYS H H 17 7.755 9.170 -1.415 1
1 212 . 7 1 1 A 17 17 LYS HA H 17 3.951 4.021 -0.070 1
1 221 . 7 1 1 A 17 17 LYS C C 17 178.800 179.118 -0.318 1
1 222 . 7 1 1 A 17 17 LYS CA C 17 59.470 59.105 0.365 1
1 223 . 7 1 1 A 17 17 LYS CB C 17 32.350 32.042 0.308 1
1 227 . 7 1 1 A 17 17 LYS N N 17 117.800 119.696 -1.896 1
1 228 . 7 1 1 A 18 18 HIS H H 18 7.847 7.808 0.039 1
1 229 . 7 1 1 A 18 18 HIS HA H 18 4.549 4.514 0.035 1
1 233 . 7 1 1 A 18 18 HIS C C 18 177.200 177.540 -0.340 1
1 234 . 7 1 1 A 18 18 HIS CA C 18 57.870 59.558 -1.688 1
1 235 . 7 1 1 A 18 18 HIS CB C 18 28.730 30.024 -1.294 1
1 236 . 7 1 1 A 18 18 HIS N N 18 116.200 119.012 -2.812 1
1 237 . 7 1 1 A 19 19 VAL H H 19 8.415 7.962 0.453 1
1 238 . 7 1 1 A 19 19 VAL HA H 19 3.746 3.683 0.063 1
1 246 . 7 1 1 A 19 19 VAL CA C 19 65.850 67.171 -1.321 1
1 247 . 7 1 1 A 19 19 VAL CB C 19 31.600 32.043 -0.443 1
1 250 . 7 1 1 A 20 20 ASN H H 20 8.041 8.229 -0.188 1
1 251 . 7 1 1 A 20 20 ASN HA H 20 4.545 4.485 0.060 1
1 256 . 7 1 1 A 20 20 ASN C C 20 176.900 176.406 0.494 1
1 257 . 7 1 1 A 20 20 ASN CA C 20 55.070 56.730 -1.660 1
1 258 . 7 1 1 A 20 20 ASN CB C 20 38.270 38.062 0.208 1
1 259 . 7 1 1 A 20 20 ASN N N 20 117.900 118.607 -0.707 1
1 261 . 7 1 1 A 21 21 GLN H H 21 7.887 7.795 0.092 1
1 262 . 7 1 1 A 21 21 GLN HA H 21 4.096 4.372 -0.276 1
1 269 . 7 1 1 A 21 21 GLN C C 21 176.900 176.842 0.058 1
1 270 . 7 1 1 A 21 21 GLN CA C 21 57.510 56.315 1.195 1
1 271 . 7 1 1 A 21 21 GLN CB C 21 29.100 28.917 0.183 1
1 273 . 7 1 1 A 21 21 GLN N N 21 117.900 116.188 1.712 1
1 275 . 7 1 1 A 22 22 HIS H H 22 7.887 9.061 -1.174 1
1 276 . 7 1 1 A 22 22 HIS HA H 22 4.679 4.903 -0.224 1
1 280 . 7 1 1 A 22 22 HIS C C 22 174.300 174.597 -0.297 1
1 281 . 7 1 1 A 22 22 HIS CA C 22 55.770 55.948 -0.178 1
1 282 . 7 1 1 A 22 22 HIS CB C 22 28.630 30.909 -2.279 1
1 283 . 7 1 1 A 22 22 HIS N N 22 116.100 116.830 -0.730 1
1 284 . 7 1 1 A 23 23 TRP H H 23 7.929 8.108 -0.179 1
1 285 . 7 1 1 A 23 23 TRP HA H 23 4.542 4.771 -0.229 1
1 292 . 7 1 1 A 23 23 TRP C C 23 176.600 175.132 1.468 1
1 293 . 7 1 1 A 23 23 TRP CA C 23 58.020 58.032 -0.012 1
1 294 . 7 1 1 A 23 23 TRP CB C 23 29.700 31.095 -1.395 1
1 295 . 7 1 1 A 23 23 TRP N N 23 122.000 123.588 -1.588 1
1 297 . 7 1 1 A 24 24 GLN H H 24 8.258 8.159 0.099 1
1 298 . 7 1 1 A 24 24 GLN HA H 24 4.329 4.745 -0.416 1
1 305 . 7 1 1 A 24 24 GLN C C 24 176.200 176.049 0.151 1
1 306 . 7 1 1 A 24 24 GLN CA C 24 55.960 54.904 1.056 1
1 307 . 7 1 1 A 24 24 GLN CB C 24 29.440 31.265 -1.825 1
1 309 . 7 1 1 A 24 24 GLN N N 24 123.800 125.453 -1.653 1
1 311 . 7 1 1 A 25 25 GLY H H 25 7.470 8.623 -1.153 1
1 312 . 7 1 1 A 25 25 GLY HA2 H 25 3.939 3.903 0.036 1
1 313 . 7 1 1 A 25 25 GLY HA3 H 25 3.800 3.921 -0.121 1
1 314 . 7 1 1 A 25 25 GLY C C 25 174.800 174.330 0.470 1
1 315 . 7 1 1 A 25 25 GLY CA C 25 45.470 47.315 -1.845 1
1 316 . 7 1 1 A 25 25 GLY N N 25 108.100 108.706 -0.606 1
1 317 . 7 1 1 A 26 26 GLY H H 26 8.332 8.656 -0.324 1
1 318 . 7 1 1 A 26 26 GLY HA2 H 26 4.105 4.390 -0.285 1
1 319 . 7 1 1 A 26 26 GLY HA3 H 26 3.974 4.411 -0.437 1
1 320 . 7 1 1 A 26 26 GLY C C 26 174.900 174.207 0.693 1
1 321 . 7 1 1 A 26 26 GLY CA C 26 45.410 45.057 0.353 1
1 322 . 7 1 1 A 26 26 GLY N N 26 108.700 110.514 -1.814 1
1 323 . 7 1 1 A 27 27 GLN H H 27 8.474 8.930 -0.456 1
1 324 . 7 1 1 A 27 27 GLN HA H 27 4.106 4.069 0.037 1
1 331 . 7 1 1 A 27 27 GLN C C 27 177.100 176.972 0.128 1
1 332 . 7 1 1 A 27 27 GLN CA C 27 57.540 57.315 0.225 1
1 333 . 7 1 1 A 27 27 GLN CB C 27 29.050 28.412 0.638 1
1 335 . 7 1 1 A 27 27 GLN N N 27 121.100 124.992 -3.892 1
1 337 . 7 1 1 A 28 28 LYS H H 28 8.448 8.496 -0.048 1
1 338 . 7 1 1 A 28 28 LYS HA H 28 4.068 4.045 0.023 1
1 347 . 7 1 1 A 28 28 LYS C C 28 177.900 178.452 -0.552 1
1 348 . 7 1 1 A 28 28 LYS CA C 28 58.410 58.966 -0.556 1
1 349 . 7 1 1 A 28 28 LYS CB C 28 32.210 32.533 -0.323 1
1 353 . 7 1 1 A 28 28 LYS N N 28 120.500 118.216 2.284 1
1 354 . 7 1 1 A 29 29 ASN H H 29 8.273 7.848 0.425 1
1 355 . 7 1 1 A 29 29 ASN HA H 29 4.584 4.510 0.074 1
1 360 . 7 1 1 A 29 29 ASN C C 29 176.200 177.256 -1.056 1
1 361 . 7 1 1 A 29 29 ASN CA C 29 54.400 55.823 -1.423 1
1 362 . 7 1 1 A 29 29 ASN CB C 29 38.280 38.630 -0.350 1
1 363 . 7 1 1 A 29 29 ASN N N 29 117.500 117.972 -0.472 1
1 365 . 7 1 1 A 30 30 MET H H 30 7.870 7.672 0.198 1
1 366 . 7 1 1 A 30 30 MET HA H 30 4.085 2.372 1.713 1
1 371 . 7 1 1 A 30 30 MET C C 30 177.000 177.376 -0.376 1
1 372 . 7 1 1 A 30 30 MET CA C 30 56.880 57.524 -0.644 1
1 373 . 7 1 1 A 30 30 MET CB C 30 32.340 31.428 0.912 1
1 375 . 7 1 1 A 30 30 MET N N 30 121.100 118.512 2.588 1
1 376 . 7 1 1 A 31 31 ASN H H 31 8.186 7.582 0.604 1
1 377 . 7 1 1 A 31 31 ASN HA H 31 4.311 4.554 -0.243 1
1 382 . 7 1 1 A 31 31 ASN C C 31 176.700 177.512 -0.812 1
1 383 . 7 1 1 A 31 31 ASN CA C 31 55.320 54.912 0.408 1
1 384 . 7 1 1 A 31 31 ASN CB C 31 38.410 38.865 -0.455 1
1 385 . 7 1 1 A 31 31 ASN N N 31 117.900 116.061 1.839 1
1 387 . 7 1 1 A 32 32 LYS H H 32 7.792 7.366 0.426 1
1 388 . 7 1 1 A 32 32 LYS HA H 32 3.992 3.975 0.017 1
1 397 . 7 1 1 A 32 32 LYS C C 32 177.900 179.239 -1.339 1
1 398 . 7 1 1 A 32 32 LYS CA C 32 59.050 58.806 0.244 1
1 399 . 7 1 1 A 32 32 LYS CB C 32 32.460 32.765 -0.305 1
1 403 . 7 1 1 A 32 32 LYS N N 32 120.400 118.398 2.002 1
1 404 . 7 1 1 A 33 33 VAL H H 33 7.689 8.464 -0.775 1
1 405 . 7 1 1 A 33 33 VAL HA H 33 3.791 3.962 -0.171 1
1 413 . 7 1 1 A 33 33 VAL C C 33 177.100 177.747 -0.647 1
1 414 . 7 1 1 A 33 33 VAL CA C 33 65.360 65.222 0.138 1
1 415 . 7 1 1 A 33 33 VAL CB C 33 31.920 31.800 0.120 1
1 418 . 7 1 1 A 33 33 VAL N N 33 120.200 116.222 3.978 1
1 419 . 7 1 1 A 34 34 ASP H H 34 8.408 7.965 0.443 1
1 420 . 7 1 1 A 34 34 ASP HA H 34 4.303 4.324 -0.021 1
1 423 . 7 1 1 A 34 34 ASP C C 34 178.200 178.314 -0.114 1
1 424 . 7 1 1 A 34 34 ASP CA C 34 55.880 57.010 -1.130 1
1 425 . 7 1 1 A 34 34 ASP CB C 34 38.710 41.093 -2.383 1
1 426 . 7 1 1 A 34 34 ASP N N 34 120.100 122.205 -2.105 1
1 427 . 7 1 1 A 35 35 HIS H H 35 8.204 7.662 0.542 1
1 428 . 7 1 1 A 35 35 HIS HA H 35 4.343 4.224 0.119 1
1 431 . 7 1 1 A 35 35 HIS C C 35 176.800 176.968 -0.168 1
1 432 . 7 1 1 A 35 35 HIS CA C 35 58.310 58.932 -0.622 1
1 433 . 7 1 1 A 35 35 HIS CB C 35 28.070 29.839 -1.769 1
1 434 . 7 1 1 A 35 35 HIS N N 35 118.200 118.909 -0.709 1
1 435 . 7 1 1 A 36 36 HIS H H 36 8.067 8.747 -0.680 1
1 436 . 7 1 1 A 36 36 HIS HA H 36 4.602 4.015 0.587 1
1 440 . 7 1 1 A 36 36 HIS C C 36 177.100 177.723 -0.623 1
1 441 . 7 1 1 A 36 36 HIS CA C 36 58.520 59.669 -1.149 1
1 442 . 7 1 1 A 36 36 HIS CB C 36 28.720 29.979 -1.259 1
1 443 . 7 1 1 A 36 36 HIS N N 36 117.100 117.162 -0.062 1
1 444 . 7 1 1 A 37 37 LEU H H 37 8.473 8.154 0.319 1
1 445 . 7 1 1 A 37 37 LEU HA H 37 3.894 3.715 0.179 1
1 455 . 7 1 1 A 37 37 LEU C C 37 178.200 178.694 -0.494 1
1 456 . 7 1 1 A 37 37 LEU CA C 37 58.520 57.917 0.603 1
1 457 . 7 1 1 A 37 37 LEU CB C 37 41.810 41.532 0.278 1
1 461 . 7 1 1 A 37 37 LEU N N 37 119.600 119.668 -0.068 1
1 462 . 7 1 1 A 38 38 GLN H H 38 8.337 8.249 0.088 1
1 463 . 7 1 1 A 38 38 GLN HA H 38 3.882 3.982 -0.100 1
1 470 . 7 1 1 A 38 38 GLN C C 38 178.500 178.561 -0.061 1
1 471 . 7 1 1 A 38 38 GLN CA C 38 59.200 59.413 -0.213 1
1 472 . 7 1 1 A 38 38 GLN CB C 38 27.850 28.265 -0.415 1
1 474 . 7 1 1 A 38 38 GLN N N 38 118.000 117.056 0.944 1
1 476 . 7 1 1 A 39 39 ASN H H 39 7.923 8.080 -0.157 1
1 477 . 7 1 1 A 39 39 ASN HA H 39 4.390 4.533 -0.143 1
1 482 . 7 1 1 A 39 39 ASN C C 39 177.500 177.271 0.229 1
1 483 . 7 1 1 A 39 39 ASN CA C 39 55.780 55.887 -0.107 1
1 484 . 7 1 1 A 39 39 ASN CB C 39 37.450 38.324 -0.874 1
1 485 . 7 1 1 A 39 39 ASN N N 39 118.700 118.135 0.565 1
1 487 . 7 1 1 A 40 40 VAL H H 40 7.907 8.126 -0.219 1
1 488 . 7 1 1 A 40 40 VAL HA H 40 3.629 3.659 -0.030 1
1 496 . 7 1 1 A 40 40 VAL C C 40 177.500 177.801 -0.301 1
1 497 . 7 1 1 A 40 40 VAL CA C 40 67.080 65.940 1.140 1
1 498 . 7 1 1 A 40 40 VAL CB C 40 31.390 31.483 -0.093 1
1 501 . 7 1 1 A 40 40 VAL N N 40 120.400 120.116 0.284 1
1 502 . 7 1 1 A 41 41 ILE H H 41 8.103 8.761 -0.658 1
1 503 . 7 1 1 A 41 41 ILE HA H 41 3.401 3.621 -0.220 1
1 513 . 7 1 1 A 41 41 ILE C C 41 178.000 178.550 -0.550 1
1 514 . 7 1 1 A 41 41 ILE CA C 41 66.430 65.409 1.021 1
1 515 . 7 1 1 A 41 41 ILE CB C 41 38.050 37.584 0.466 1
1 519 . 7 1 1 A 41 41 ILE N N 41 120.600 119.609 0.991 1
1 520 . 7 1 1 A 42 42 GLU H H 42 8.150 8.002 0.148 1
1 521 . 7 1 1 A 42 42 GLU HA H 42 4.062 4.093 -0.031 1
1 526 . 7 1 1 A 42 42 GLU C C 42 178.500 178.356 0.144 1
1 527 . 7 1 1 A 42 42 GLU CA C 42 59.120 59.267 -0.147 1
1 528 . 7 1 1 A 42 42 GLU CB C 42 28.160 29.263 -1.103 1
1 530 . 7 1 1 A 42 42 GLU N N 42 119.900 121.464 -1.564 1
1 531 . 7 1 1 A 43 43 ASP H H 43 8.453 8.987 -0.534 1
1 532 . 7 1 1 A 43 43 ASP HA H 43 4.445 4.422 0.023 1
1 535 . 7 1 1 A 43 43 ASP C C 43 178.400 178.547 -0.147 1
1 536 . 7 1 1 A 43 43 ASP CA C 43 56.490 57.921 -1.431 1
1 537 . 7 1 1 A 43 43 ASP CB C 43 37.820 41.628 -3.808 1
1 538 . 7 1 1 A 43 43 ASP N N 43 119.700 120.131 -0.431 1
1 539 . 7 1 1 A 44 44 ILE H H 44 8.544 7.989 0.555 1
1 540 . 7 1 1 A 44 44 ILE HA H 44 3.590 3.862 -0.272 1
1 550 . 7 1 1 A 44 44 ILE C C 44 177.800 178.141 -0.341 1
1 551 . 7 1 1 A 44 44 ILE CA C 44 66.320 65.422 0.898 1
1 552 . 7 1 1 A 44 44 ILE CB C 44 37.690 38.239 -0.549 1
1 556 . 7 1 1 A 44 44 ILE N N 44 121.500 119.631 1.869 1
1 557 . 7 1 1 A 45 45 HIS H H 45 8.261 8.372 -0.111 1
1 558 . 7 1 1 A 45 45 HIS HA H 45 4.255 4.108 0.147 1
1 562 . 7 1 1 A 45 45 HIS C C 45 177.200 176.831 0.369 1
1 563 . 7 1 1 A 45 45 HIS CA C 45 59.580 59.646 -0.066 1
1 564 . 7 1 1 A 45 45 HIS CB C 45 27.790 30.261 -2.471 1
1 565 . 7 1 1 A 45 45 HIS N N 45 118.800 119.742 -0.942 1
1 566 . 7 1 1 A 46 46 ASP H H 46 8.680 8.359 0.321 1
1 567 . 7 1 1 A 46 46 ASP HA H 46 4.338 4.543 -0.205 1
1 570 . 7 1 1 A 46 46 ASP C C 46 178.700 178.272 0.428 1
1 571 . 7 1 1 A 46 46 ASP CA C 46 57.010 55.729 1.281 1
1 572 . 7 1 1 A 46 46 ASP CB C 46 39.400 40.824 -1.424 1
1 573 . 7 1 1 A 46 46 ASP N N 46 119.200 118.093 1.107 1
1 574 . 7 1 1 A 47 47 PHE H H 47 8.380 9.262 -0.882 1
1 575 . 7 1 1 A 47 47 PHE HA H 47 4.070 4.271 -0.201 1
1 580 . 7 1 1 A 47 47 PHE C C 47 178.600 177.088 1.512 1
1 581 . 7 1 1 A 47 47 PHE CA C 47 61.250 59.878 1.372 1
1 582 . 7 1 1 A 47 47 PHE CB C 47 39.570 39.954 -0.384 1
1 583 . 7 1 1 A 47 47 PHE N N 47 121.800 121.132 0.668 1
1 584 . 7 1 1 A 48 48 MET H H 48 8.366 7.905 0.461 1
1 585 . 7 1 1 A 48 48 MET HA H 48 3.998 4.201 -0.203 1
1 590 . 7 1 1 A 48 48 MET C C 48 177.400 177.313 0.087 1
1 591 . 7 1 1 A 48 48 MET CA C 48 58.470 56.931 1.539 1
1 592 . 7 1 1 A 48 48 MET CB C 48 33.170 33.133 0.037 1
1 594 . 7 1 1 A 48 48 MET N N 48 117.700 117.226 0.474 1
1 595 . 7 1 1 A 49 49 GLN H H 49 7.659 8.214 -0.555 1
1 596 . 7 1 1 A 49 49 GLN HA H 49 4.258 4.359 -0.101 1
1 603 . 7 1 1 A 49 49 GLN C C 49 176.700 178.412 -1.712 1
1 604 . 7 1 1 A 49 49 GLN CA C 49 56.380 57.766 -1.386 1
1 605 . 7 1 1 A 49 49 GLN CB C 49 28.980 29.902 -0.922 1
1 607 . 7 1 1 A 49 49 GLN N N 49 116.700 116.478 0.222 1
1 609 . 7 1 1 A 50 50 GLY H H 50 7.685 8.550 -0.865 1
1 610 . 7 1 1 A 50 50 GLY HA2 H 50 3.998 3.944 0.054 1
1 611 . 7 1 1 A 50 50 GLY HA3 H 50 3.998 3.993 0.005 1
1 612 . 7 1 1 A 50 50 GLY C C 50 174.900 175.490 -0.590 1
1 613 . 7 1 1 A 50 50 GLY CA C 50 45.460 46.099 -0.639 1
1 614 . 7 1 1 A 50 50 GLY N N 50 106.400 108.529 -2.129 1
1 615 . 7 1 1 A 51 51 GLY H H 51 8.031 9.214 -1.183 1
1 616 . 7 1 1 A 51 51 GLY HA2 H 51 3.817 3.889 -0.072 1
1 617 . 7 1 1 A 51 51 GLY HA3 H 51 3.817 3.932 -0.115 1
1 618 . 7 1 1 A 51 51 GLY C C 51 174.500 174.503 -0.003 1
1 619 . 7 1 1 A 51 51 GLY CA C 51 45.190 45.528 -0.338 1
1 620 . 7 1 1 A 51 51 GLY N N 51 108.900 109.908 -1.008 1
1 621 . 7 1 1 A 52 52 GLY H H 52 8.126 8.802 -0.676 1
1 622 . 7 1 1 A 52 52 GLY HA2 H 52 3.362 4.283 -0.921 1
1 623 . 7 1 1 A 52 52 GLY HA3 H 52 3.362 4.464 -1.102 1
1 624 . 7 1 1 A 52 52 GLY C C 52 173.300 174.452 -1.152 1
1 625 . 7 1 1 A 52 52 GLY CA C 52 45.120 45.839 -0.719 1
1 626 . 7 1 1 A 52 52 GLY N N 52 108.100 108.445 -0.345 1
1 627 . 7 1 1 A 53 53 SER H H 53 7.594 8.541 -0.947 1
1 628 . 7 1 1 A 53 53 SER HA H 53 4.530 4.832 -0.302 1
1 631 . 7 1 1 A 53 53 SER C C 53 175.300 175.284 0.016 1
1 632 . 7 1 1 A 53 53 SER CA C 53 57.770 57.976 -0.206 1
1 633 . 7 1 1 A 53 53 SER CB C 53 64.750 62.648 2.102 1
1 634 . 7 1 1 A 53 53 SER N N 53 114.100 115.815 -1.715 1
1 635 . 7 1 1 A 54 54 GLY H H 54 9.003 8.548 0.455 1
1 636 . 7 1 1 A 54 54 GLY HA2 H 54 4.037 3.812 0.225 1
1 637 . 7 1 1 A 54 54 GLY HA3 H 54 3.911 3.908 0.003 1
1 638 . 7 1 1 A 54 54 GLY C C 54 176.500 175.361 1.139 1
1 639 . 7 1 1 A 54 54 GLY CA C 54 47.040 47.011 0.029 1
1 640 . 7 1 1 A 54 54 GLY N N 54 110.400 110.419 -0.019 1
1 641 . 7 1 1 A 55 55 GLY H H 55 8.617 8.258 0.359 1
1 642 . 7 1 1 A 55 55 GLY HA2 H 55 3.946 3.813 0.133 1
1 643 . 7 1 1 A 55 55 GLY HA3 H 55 3.946 3.820 0.126 1
1 644 . 7 1 1 A 55 55 GLY C C 55 176.400 175.640 0.760 1
1 645 . 7 1 1 A 55 55 GLY CA C 55 46.630 47.024 -0.394 1
1 646 . 7 1 1 A 55 55 GLY N N 55 109.800 109.592 0.208 1
1 647 . 7 1 1 A 56 56 LYS H H 56 7.876 8.416 -0.540 1
1 648 . 7 1 1 A 56 56 LYS HA H 56 4.195 4.210 -0.015 1
1 657 . 7 1 1 A 56 56 LYS C C 56 178.600 178.720 -0.120 1
1 658 . 7 1 1 A 56 56 LYS CA C 56 57.960 58.540 -0.580 1
1 659 . 7 1 1 A 56 56 LYS CB C 56 32.110 31.822 0.288 1
1 663 . 7 1 1 A 56 56 LYS N N 56 121.800 121.590 0.210 1
1 664 . 7 1 1 A 57 57 LEU H H 57 8.153 7.821 0.332 1
1 665 . 7 1 1 A 57 57 LEU HA H 57 3.992 4.032 -0.040 1
1 675 . 7 1 1 A 57 57 LEU C C 57 178.400 178.712 -0.312 1
1 676 . 7 1 1 A 57 57 LEU CA C 57 58.190 58.082 0.108 1
1 677 . 7 1 1 A 57 57 LEU CB C 57 41.360 41.728 -0.368 1
1 681 . 7 1 1 A 57 57 LEU N N 57 120.700 120.949 -0.249 1
1 682 . 7 1 1 A 58 58 GLN H H 58 8.019 7.938 0.081 1
1 683 . 7 1 1 A 58 58 GLN HA H 58 3.942 4.059 -0.117 1
1 690 . 7 1 1 A 58 58 GLN C C 58 179.100 178.223 0.877 1
1 691 . 7 1 1 A 58 58 GLN CA C 58 59.360 58.750 0.610 1
1 692 . 7 1 1 A 58 58 GLN CB C 58 28.030 28.371 -0.341 1
1 694 . 7 1 1 A 58 58 GLN N N 58 117.400 117.585 -0.185 1
1 696 . 7 1 1 A 59 59 GLU H H 59 7.838 8.205 -0.367 1
1 697 . 7 1 1 A 59 59 GLU HA H 59 4.030 4.117 -0.087 1
1 702 . 7 1 1 A 59 59 GLU C C 59 178.600 179.293 -0.693 1
1 703 . 7 1 1 A 59 59 GLU CA C 59 59.250 59.003 0.247 1
1 704 . 7 1 1 A 59 59 GLU CB C 59 28.960 29.611 -0.651 1
1 706 . 7 1 1 A 59 59 GLU N N 59 119.900 120.815 -0.915 1
1 707 . 7 1 1 A 60 60 MET H H 60 8.223 8.153 0.070 1
1 708 . 7 1 1 A 60 60 MET HA H 60 3.966 4.168 -0.202 1
1 713 . 7 1 1 A 60 60 MET C C 60 177.900 178.186 -0.286 1
1 714 . 7 1 1 A 60 60 MET CA C 60 59.350 58.278 1.072 1
1 715 . 7 1 1 A 60 60 MET CB C 60 33.210 32.478 0.732 1
1 717 . 7 1 1 A 60 60 MET N N 60 120.100 119.160 0.940 1
1 718 . 7 1 1 A 61 61 MET H H 61 8.134 8.315 -0.181 1
1 719 . 7 1 1 A 61 61 MET HA H 61 4.195 4.253 -0.058 1
1 724 . 7 1 1 A 61 61 MET C C 61 179.100 178.158 0.942 1
1 725 . 7 1 1 A 61 61 MET CA C 61 58.210 59.092 -0.882 1
1 726 . 7 1 1 A 61 61 MET CB C 61 31.340 32.397 -1.057 1
1 728 . 7 1 1 A 61 61 MET N N 61 117.000 119.359 -2.359 1
1 729 . 7 1 1 A 62 62 LYS H H 62 7.782 8.272 -0.490 1
1 730 . 7 1 1 A 62 62 LYS HA H 62 4.085 4.084 0.001 1
1 739 . 7 1 1 A 62 62 LYS C C 62 179.600 178.767 0.833 1
1 740 . 7 1 1 A 62 62 LYS CA C 62 59.610 59.466 0.144 1
1 741 . 7 1 1 A 62 62 LYS CB C 62 32.180 32.046 0.134 1
1 745 . 7 1 1 A 62 62 LYS N N 62 120.600 117.955 2.645 1
1 746 . 7 1 1 A 63 63 GLU H H 63 8.041 8.132 -0.091 1
1 747 . 7 1 1 A 63 63 GLU HA H 63 4.057 3.984 0.073 1
1 752 . 7 1 1 A 63 63 GLU C C 63 178.900 178.947 -0.047 1
1 753 . 7 1 1 A 63 63 GLU CA C 63 59.170 58.873 0.297 1
1 754 . 7 1 1 A 63 63 GLU CB C 63 29.000 29.487 -0.487 1
1 756 . 7 1 1 A 63 63 GLU N N 63 120.200 119.689 0.511 1
1 757 . 7 1 1 A 64 64 PHE H H 64 8.604 8.425 0.179 1
1 758 . 7 1 1 A 64 64 PHE HA H 64 4.155 3.787 0.368 1
1 763 . 7 1 1 A 64 64 PHE C C 64 177.800 177.726 0.074 1
1 764 . 7 1 1 A 64 64 PHE CA C 64 59.820 60.729 -0.909 1
1 765 . 7 1 1 A 64 64 PHE CB C 64 38.470 38.090 0.380 1
1 766 . 7 1 1 A 64 64 PHE N N 64 119.700 120.683 -0.983 1
1 767 . 7 1 1 A 65 65 GLN H H 65 8.177 7.678 0.499 1
1 768 . 7 1 1 A 65 65 GLN HA H 65 3.637 4.176 -0.539 1
1 775 . 7 1 1 A 65 65 GLN C C 65 177.800 177.918 -0.118 1
1 776 . 7 1 1 A 65 65 GLN CA C 65 58.970 58.296 0.674 1
1 777 . 7 1 1 A 65 65 GLN CB C 65 28.280 28.657 -0.377 1
1 779 . 7 1 1 A 65 65 GLN N N 65 118.500 118.410 0.090 1
1 781 . 7 1 1 A 66 66 GLN H H 66 7.622 7.782 -0.160 1
1 782 . 7 1 1 A 66 66 GLN HA H 66 4.040 4.121 -0.081 1
1 789 . 7 1 1 A 66 66 GLN C C 66 178.600 178.682 -0.082 1
1 790 . 7 1 1 A 66 66 GLN CA C 66 59.150 58.135 1.015 1
1 791 . 7 1 1 A 66 66 GLN CB C 66 28.230 28.317 -0.087 1
1 793 . 7 1 1 A 66 66 GLN N N 66 117.400 118.299 -0.899 1
1 795 . 7 1 1 A 67 67 VAL H H 67 7.744 7.494 0.250 1
1 796 . 7 1 1 A 67 67 VAL HA H 67 3.785 3.625 0.160 1
1 804 . 7 1 1 A 67 67 VAL C C 67 177.500 177.869 -0.369 1
1 805 . 7 1 1 A 67 67 VAL CA C 67 66.220 66.374 -0.154 1
1 806 . 7 1 1 A 67 67 VAL CB C 67 31.390 31.598 -0.208 1
1 809 . 7 1 1 A 67 67 VAL N N 67 119.500 120.262 -0.762 1
1 810 . 7 1 1 A 68 68 LEU H H 68 7.983 7.836 0.147 1
1 811 . 7 1 1 A 68 68 LEU HA H 68 3.825 4.038 -0.213 1
1 821 . 7 1 1 A 68 68 LEU C C 68 179.100 177.975 1.125 1
1 822 . 7 1 1 A 68 68 LEU CA C 68 58.740 58.357 0.383 1
1 823 . 7 1 1 A 68 68 LEU CB C 68 41.090 41.682 -0.592 1
1 827 . 7 1 1 A 68 68 LEU N N 68 120.400 119.884 0.516 1
1 828 . 7 1 1 A 69 69 ASP H H 69 8.179 7.680 0.499 1
1 829 . 7 1 1 A 69 69 ASP HA H 69 4.380 4.521 -0.141 1
1 832 . 7 1 1 A 69 69 ASP C C 69 178.900 178.304 0.596 1
1 833 . 7 1 1 A 69 69 ASP CA C 69 57.320 55.838 1.482 1
1 834 . 7 1 1 A 69 69 ASP CB C 69 40.040 41.141 -1.101 1
1 835 . 7 1 1 A 69 69 ASP N N 69 119.000 118.317 0.683 1
1 836 . 7 1 1 A 70 70 GLU H H 70 8.166 7.867 0.299 1
1 837 . 7 1 1 A 70 70 GLU HA H 70 4.082 4.207 -0.125 1
1 842 . 7 1 1 A 70 70 GLU C C 70 179.600 178.918 0.682 1
1 843 . 7 1 1 A 70 70 GLU CA C 70 59.010 58.883 0.127 1
1 844 . 7 1 1 A 70 70 GLU CB C 70 28.900 30.131 -1.231 1
1 846 . 7 1 1 A 70 70 GLU N N 70 120.500 118.839 1.661 1
1 847 . 7 1 1 A 71 71 ILE H H 71 8.415 8.065 0.350 1
1 848 . 7 1 1 A 71 71 ILE HA H 71 3.790 3.477 0.313 1
1 858 . 7 1 1 A 71 71 ILE C C 71 177.400 177.752 -0.352 1
1 859 . 7 1 1 A 71 71 ILE CA C 71 64.890 65.401 -0.511 1
1 860 . 7 1 1 A 71 71 ILE CB C 71 37.680 37.613 0.067 1
1 864 . 7 1 1 A 71 71 ILE N N 71 119.200 120.373 -1.173 1
1 865 . 7 1 1 A 72 72 LYS H H 72 8.248 8.210 0.038 1
1 866 . 7 1 1 A 72 72 LYS HA H 72 3.625 3.241 0.384 1
1 873 . 7 1 1 A 72 72 LYS C C 72 178.400 178.569 -0.169 1
1 874 . 7 1 1 A 72 72 LYS CA C 72 59.850 59.364 0.486 1
1 875 . 7 1 1 A 72 72 LYS CB C 72 32.070 32.126 -0.056 1
1 879 . 7 1 1 A 72 72 LYS N N 72 120.800 121.205 -0.405 1
1 880 . 7 1 1 A 73 73 GLN H H 73 7.937 8.178 -0.241 1
1 881 . 7 1 1 A 73 73 GLN HA H 73 4.042 4.239 -0.197 1
1 888 . 7 1 1 A 73 73 GLN C C 73 178.400 178.821 -0.421 1
1 889 . 7 1 1 A 73 73 GLN CA C 73 58.510 58.931 -0.421 1
1 890 . 7 1 1 A 73 73 GLN CB C 73 28.430 28.260 0.170 1
1 892 . 7 1 1 A 73 73 GLN N N 73 117.000 117.884 -0.884 1
1 894 . 7 1 1 A 74 74 GLN H H 74 7.712 8.065 -0.353 1
1 895 . 7 1 1 A 74 74 GLN HA H 74 4.080 4.011 0.069 1
1 902 . 7 1 1 A 74 74 GLN C C 74 177.800 178.171 -0.371 1
1 903 . 7 1 1 A 74 74 GLN CA C 74 57.270 58.317 -1.047 1
1 904 . 7 1 1 A 74 74 GLN CB C 74 28.700 28.124 0.576 1
1 906 . 7 1 1 A 74 74 GLN N N 74 118.200 119.296 -1.096 1
1 908 . 7 1 1 A 75 75 LEU H H 75 7.956 7.238 0.718 1
1 909 . 7 1 1 A 75 75 LEU HA H 75 4.212 4.067 0.145 1
1 919 . 7 1 1 A 75 75 LEU CA C 75 56.660 55.996 0.664 1
1 920 . 7 1 1 A 75 75 LEU CB C 75 42.000 41.228 0.772 1
1 924 . 7 1 1 A 75 75 LEU N N 75 120.700 119.499 1.201 1
1 925 . 7 1 1 A 76 76 GLN H H 76 8.315 7.924 0.391 1
1 926 . 7 1 1 A 76 76 GLN HA H 76 4.113 4.386 -0.273 1
1 933 . 7 1 1 A 76 76 GLN C C 76 177.100 175.027 2.073 1
1 934 . 7 1 1 A 76 76 GLN CA C 76 57.400 55.573 1.827 1
1 935 . 7 1 1 A 76 76 GLN CB C 76 28.640 26.754 1.886 1
1 937 . 7 1 1 A 76 76 GLN N N 76 120.100 117.264 2.836 1
1 939 . 7 1 1 A 77 77 GLY H H 77 8.021 7.562 0.459 1
1 940 . 7 1 1 A 77 77 GLY HA2 H 77 4.042 4.162 -0.120 1
1 941 . 7 1 1 A 77 77 GLY HA3 H 77 3.869 4.163 -0.294 1
1 942 . 7 1 1 A 77 77 GLY C C 77 174.600 173.806 0.794 1
1 943 . 7 1 1 A 77 77 GLY CA C 77 45.430 45.935 -0.505 1
1 944 . 7 1 1 A 77 77 GLY N N 77 107.700 108.519 -0.819 1
1 945 . 7 1 1 A 78 78 GLY H H 78 7.819 8.462 -0.643 1
1 946 . 7 1 1 A 78 78 GLY HA2 H 78 4.208 3.956 0.252 1
1 947 . 7 1 1 A 78 78 GLY HA3 H 78 3.801 3.969 -0.168 1
1 948 . 7 1 1 A 78 78 GLY C C 78 173.900 174.249 -0.349 1
1 949 . 7 1 1 A 78 78 GLY CA C 78 45.140 45.204 -0.064 1
1 950 . 7 1 1 A 78 78 GLY N N 78 107.100 109.846 -2.746 1
1 951 . 7 1 1 A 79 79 ASP H H 79 7.912 8.218 -0.306 1
1 952 . 7 1 1 A 79 79 ASP HA H 79 4.722 4.614 0.108 1
1 955 . 7 1 1 A 79 79 ASP C C 79 176.200 176.543 -0.343 1
1 956 . 7 1 1 A 79 79 ASP CA C 79 53.210 54.219 -1.009 1
1 957 . 7 1 1 A 79 79 ASP CB C 79 40.160 39.882 0.278 1
1 958 . 7 1 1 A 79 79 ASP N N 79 119.800 119.824 -0.024 1
1 959 . 7 1 1 A 80 80 ASN H H 80 8.450 9.278 -0.828 1
1 960 . 7 1 1 A 80 80 ASN HA H 80 4.593 4.569 0.024 1
1 965 . 7 1 1 A 80 80 ASN C C 80 177.300 177.422 -0.122 1
1 966 . 7 1 1 A 80 80 ASN CA C 80 54.680 55.419 -0.739 1
1 967 . 7 1 1 A 80 80 ASN CB C 80 38.790 38.231 0.559 1
1 968 . 7 1 1 A 80 80 ASN N N 80 121.700 118.792 2.908 1
1 970 . 7 1 1 A 81 81 SER H H 81 8.444 7.855 0.589 1
1 971 . 7 1 1 A 81 81 SER HA H 81 4.263 4.289 -0.026 1
1 974 . 7 1 1 A 81 81 SER C C 81 176.100 177.172 -1.072 1
1 975 . 7 1 1 A 81 81 SER CA C 81 61.470 61.163 0.307 1
1 976 . 7 1 1 A 81 81 SER CB C 81 61.470 62.797 -1.327 1
1 977 . 7 1 1 A 81 81 SER N N 81 117.100 114.348 2.752 1
1 978 . 7 1 1 A 82 82 LEU H H 82 7.929 8.250 -0.321 1
1 979 . 7 1 1 A 82 82 LEU HA H 82 4.332 3.988 0.344 1
1 989 . 7 1 1 A 82 82 LEU C C 82 177.400 179.108 -1.708 1
1 990 . 7 1 1 A 82 82 LEU CA C 82 55.060 57.946 -2.886 1
1 991 . 7 1 1 A 82 82 LEU CB C 82 41.940 41.668 0.272 1
1 995 . 7 1 1 A 82 82 LEU N N 82 120.400 121.632 -1.232 1
1 996 . 7 1 1 A 83 83 HIS H H 83 8.014 7.853 0.161 1
1 997 . 7 1 1 A 83 83 HIS HA H 83 4.173 4.216 -0.043 1
1 1000 . 7 1 1 A 83 83 HIS C C 83 176.100 177.102 -1.002 1
1 1001 . 7 1 1 A 83 83 HIS CA C 83 59.940 59.774 0.166 1
1 1002 . 7 1 1 A 83 83 HIS CB C 83 28.050 30.199 -2.149 1
1 1003 . 7 1 1 A 83 83 HIS N N 83 119.400 118.403 0.997 1
1 1004 . 7 1 1 A 84 84 ASN H H 84 8.598 8.863 -0.265 1
1 1005 . 7 1 1 A 84 84 ASN HA H 84 4.735 4.625 0.110 1
1 1010 . 7 1 1 A 84 84 ASN C C 84 177.400 176.838 0.562 1
1 1011 . 7 1 1 A 84 84 ASN CA C 84 55.790 54.427 1.363 1
1 1012 . 7 1 1 A 84 84 ASN CB C 84 37.520 38.988 -1.468 1
1 1013 . 7 1 1 A 84 84 ASN N N 84 118.100 116.559 1.541 1
1 1015 . 7 1 1 A 85 85 VAL H H 85 7.933 8.201 -0.268 1
1 1016 . 7 1 1 A 85 85 VAL HA H 85 3.849 3.928 -0.079 1
1 1024 . 7 1 1 A 85 85 VAL C C 85 177.100 177.947 -0.847 1
1 1025 . 7 1 1 A 85 85 VAL CA C 85 65.490 64.720 0.770 1
1 1026 . 7 1 1 A 85 85 VAL CB C 85 31.760 32.288 -0.528 1
1 1029 . 7 1 1 A 85 85 VAL N N 85 120.500 119.556 0.944 1
1 1030 . 7 1 1 A 86 86 HIS H H 86 8.460 9.526 -1.066 1
1 1031 . 7 1 1 A 86 86 HIS HA H 86 4.054 4.127 -0.073 1
1 1035 . 7 1 1 A 86 86 HIS C C 86 176.300 177.224 -0.924 1
1 1036 . 7 1 1 A 86 86 HIS CA C 86 59.860 59.410 0.450 1
1 1037 . 7 1 1 A 86 86 HIS CB C 86 29.670 30.147 -0.477 1
1 1038 . 7 1 1 A 86 86 HIS N N 86 119.300 119.363 -0.063 1
1 1039 . 7 1 1 A 87 87 GLU H H 87 7.897 8.383 -0.486 1
1 1040 . 7 1 1 A 87 87 GLU HA H 87 3.838 3.797 0.041 1
1 1045 . 7 1 1 A 87 87 GLU C C 87 178.300 178.972 -0.672 1
1 1046 . 7 1 1 A 87 87 GLU CA C 87 58.690 58.306 0.384 1
1 1047 . 7 1 1 A 87 87 GLU CB C 87 28.460 29.613 -1.153 1
1 1049 . 7 1 1 A 87 87 GLU N N 87 117.100 116.636 0.464 1
1 1050 . 7 1 1 A 88 88 ASN H H 88 8.103 9.303 -1.200 1
1 1051 . 7 1 1 A 88 88 ASN HA H 88 4.503 4.380 0.123 1
1 1056 . 7 1 1 A 88 88 ASN C C 88 177.700 177.633 0.067 1
1 1057 . 7 1 1 A 88 88 ASN CA C 88 55.990 56.025 -0.035 1
1 1058 . 7 1 1 A 88 88 ASN CB C 88 39.010 37.904 1.106 1
1 1059 . 7 1 1 A 88 88 ASN N N 88 118.400 118.430 -0.030 1
1 1061 . 7 1 1 A 89 89 ILE H H 89 8.501 7.813 0.688 1
1 1062 . 7 1 1 A 89 89 ILE HA H 89 3.670 3.720 -0.050 1
1 1072 . 7 1 1 A 89 89 ILE C C 89 177.000 177.783 -0.783 1
1 1073 . 7 1 1 A 89 89 ILE CA C 89 65.390 65.406 -0.016 1
1 1074 . 7 1 1 A 89 89 ILE CB C 89 37.440 37.758 -0.318 1
1 1078 . 7 1 1 A 89 89 ILE N N 89 118.700 119.883 -1.183 1
1 1079 . 7 1 1 A 90 90 LYS H H 90 8.017 8.027 -0.010 1
1 1080 . 7 1 1 A 90 90 LYS HA H 90 3.775 3.885 -0.110 1
1 1089 . 7 1 1 A 90 90 LYS C C 90 178.800 179.069 -0.269 1
1 1090 . 7 1 1 A 90 90 LYS CA C 90 60.450 59.865 0.585 1
1 1091 . 7 1 1 A 90 90 LYS CB C 90 32.110 32.429 -0.319 1
1 1095 . 7 1 1 A 90 90 LYS N N 90 120.900 120.283 0.617 1
1 1096 . 7 1 1 A 91 91 GLU H H 91 7.732 8.089 -0.357 1
1 1097 . 7 1 1 A 91 91 GLU HA H 91 4.083 4.119 -0.036 1
1 1102 . 7 1 1 A 91 91 GLU C C 91 179.100 179.118 -0.018 1
1 1103 . 7 1 1 A 91 91 GLU CA C 91 59.120 58.910 0.210 1
1 1104 . 7 1 1 A 91 91 GLU CB C 91 28.810 30.004 -1.194 1
1 1106 . 7 1 1 A 91 91 GLU N N 91 119.300 118.139 1.161 1
1 1107 . 7 1 1 A 92 92 ILE H H 92 8.110 8.896 -0.786 1
1 1108 . 7 1 1 A 92 92 ILE HA H 92 3.685 3.613 0.072 1
1 1118 . 7 1 1 A 92 92 ILE C C 92 178.000 178.109 -0.109 1
1 1119 . 7 1 1 A 92 92 ILE CA C 92 65.900 65.261 0.639 1
1 1120 . 7 1 1 A 92 92 ILE CB C 92 38.400 38.031 0.369 1
1 1124 . 7 1 1 A 92 92 ILE N N 92 121.100 120.893 0.207 1
1 1125 . 7 1 1 A 93 93 PHE H H 93 8.651 8.964 -0.313 1
1 1126 . 7 1 1 A 93 93 PHE HA H 93 3.873 3.338 0.535 1
1 1133 . 7 1 1 A 93 93 PHE C C 93 177.100 177.849 -0.749 1
1 1134 . 7 1 1 A 93 93 PHE CA C 93 61.020 61.273 -0.253 1
1 1135 . 7 1 1 A 93 93 PHE CB C 93 38.560 38.037 0.523 1
1 1138 . 7 1 1 A 93 93 PHE N N 93 119.400 120.826 -1.426 1
1 1139 . 7 1 1 A 94 94 HIS H H 94 8.126 7.596 0.530 1
1 1140 . 7 1 1 A 94 94 HIS HA H 94 4.368 3.685 0.683 1
1 1145 . 7 1 1 A 94 94 HIS C C 94 177.100 176.781 0.319 1
1 1146 . 7 1 1 A 94 94 HIS CA C 94 58.310 57.357 0.953 1
1 1147 . 7 1 1 A 94 94 HIS CB C 94 27.910 30.043 -2.133 1
1 1148 . 7 1 1 A 94 94 HIS N N 94 116.400 117.674 -1.274 1
1 1149 . 7 1 1 A 95 95 HIS H H 95 8.058 8.246 -0.188 1
1 1150 . 7 1 1 A 95 95 HIS HA H 95 4.465 4.105 0.360 1
1 1154 . 7 1 1 A 95 95 HIS C C 95 177.300 177.562 -0.262 1
1 1155 . 7 1 1 A 95 95 HIS CA C 95 57.900 59.279 -1.379 1
1 1156 . 7 1 1 A 95 95 HIS CB C 95 28.490 30.663 -2.173 1
1 1157 . 7 1 1 A 95 95 HIS N N 95 117.000 116.424 0.576 1
1 1158 . 7 1 1 A 96 96 LEU H H 96 8.525 7.943 0.582 1
1 1159 . 7 1 1 A 96 96 LEU HA H 96 3.865 3.955 -0.090 1
1 1169 . 7 1 1 A 96 96 LEU C C 96 178.300 178.820 -0.520 1
1 1170 . 7 1 1 A 96 96 LEU CA C 96 58.250 58.354 -0.104 1
1 1171 . 7 1 1 A 96 96 LEU CB C 96 41.720 42.087 -0.367 1
1 1175 . 7 1 1 A 96 96 LEU N N 96 121.300 120.586 0.714 1
1 1176 . 7 1 1 A 97 97 GLU H H 97 8.076 8.236 -0.160 1
1 1177 . 7 1 1 A 97 97 GLU HA H 97 3.719 4.096 -0.377 1
1 1182 . 7 1 1 A 97 97 GLU C C 97 178.300 178.662 -0.362 1
1 1183 . 7 1 1 A 97 97 GLU CA C 97 59.300 58.708 0.592 1
1 1184 . 7 1 1 A 97 97 GLU CB C 97 28.960 29.741 -0.781 1
1 1186 . 7 1 1 A 97 97 GLU N N 97 117.100 118.624 -1.524 1
1 1187 . 7 1 1 A 98 98 GLU H H 98 7.329 7.631 -0.302 1
1 1188 . 7 1 1 A 98 98 GLU HA H 98 4.024 4.063 -0.039 1
1 1193 . 7 1 1 A 98 98 GLU C C 98 177.900 178.780 -0.880 1
1 1194 . 7 1 1 A 98 98 GLU CA C 98 58.190 58.497 -0.307 1
1 1195 . 7 1 1 A 98 98 GLU CB C 98 29.120 29.385 -0.265 1
1 1197 . 7 1 1 A 98 98 GLU N N 98 116.000 119.232 -3.232 1
1 1198 . 7 1 1 A 99 99 LEU H H 99 7.535 8.457 -0.922 1
1 1199 . 7 1 1 A 99 99 LEU HA H 99 4.183 4.264 -0.081 1
1 1209 . 7 1 1 A 99 99 LEU C C 99 178.100 177.754 0.346 1
1 1210 . 7 1 1 A 99 99 LEU CA C 99 56.440 56.331 0.109 1
1 1211 . 7 1 1 A 99 99 LEU CB C 99 43.010 41.812 1.198 1
1 1215 . 7 1 1 A 99 99 LEU N N 99 118.200 118.987 -0.787 1
1 1216 . 7 1 1 A 100 100 VAL H H 100 7.561 6.946 0.615 1
1 1217 . 7 1 1 A 100 100 VAL HA H 100 4.033 4.562 -0.529 1
1 1225 . 7 1 1 A 100 100 VAL C C 100 175.400 177.573 -2.173 1
1 1226 . 7 1 1 A 100 100 VAL CA C 100 62.430 61.773 0.657 1
1 1227 . 7 1 1 A 100 100 VAL CB C 100 32.050 33.494 -1.444 1
1 1230 . 7 1 1 A 100 100 VAL N N 100 114.800 112.209 2.591 1
1 1231 . 7 1 1 A 101 101 HIS H H 101 7.827 7.793 0.034 1
1 1232 . 7 1 1 A 101 101 HIS HA H 101 4.630 4.290 0.340 1
1 1237 . 7 1 1 A 101 101 HIS C C 101 173.500 175.850 -2.350 1
1 1238 . 7 1 1 A 101 101 HIS CA C 101 55.410 57.496 -2.086 1
1 1239 . 7 1 1 A 101 101 HIS CB C 101 28.870 30.307 -1.437 1
1 1240 . 7 1 1 A 101 101 HIS N N 101 120.300 122.386 -2.086 1
1 10 . 8 1 1 A 2 2 TYR H H 2 8.688 7.264 1.424 1
1 11 . 8 1 1 A 2 2 TYR HA H 2 4.737 4.221 0.516 1
1 16 . 8 1 1 A 2 2 TYR C C 2 175.900 176.252 -0.352 1
1 17 . 8 1 1 A 2 2 TYR CA C 2 57.920 60.519 -2.599 1
1 18 . 8 1 1 A 2 2 TYR CB C 2 38.340 38.634 -0.294 1
1 19 . 8 1 1 A 2 2 TYR N N 2 122.100 124.630 -2.530 1
1 20 . 8 1 1 A 3 3 GLY H H 3 8.434 8.416 0.018 1
1 21 . 8 1 1 A 3 3 GLY HA2 H 3 3.909 4.091 -0.182 1
1 22 . 8 1 1 A 3 3 GLY HA3 H 3 3.841 4.135 -0.294 1
1 23 . 8 1 1 A 3 3 GLY C C 3 174.300 175.955 -1.655 1
1 24 . 8 1 1 A 3 3 GLY CA C 3 46.050 45.349 0.701 1
1 25 . 8 1 1 A 3 3 GLY N N 3 111.100 108.852 2.248 1
1 26 . 8 1 1 A 4 4 LYS H H 4 8.060 8.424 -0.364 1
1 27 . 8 1 1 A 4 4 LYS HA H 4 4.297 4.056 0.241 1
1 36 . 8 1 1 A 4 4 LYS C C 4 178.000 179.110 -1.110 1
1 37 . 8 1 1 A 4 4 LYS CA C 4 56.930 59.439 -2.509 1
1 38 . 8 1 1 A 4 4 LYS CB C 4 32.680 31.939 0.741 1
1 42 . 8 1 1 A 4 4 LYS N N 4 119.500 121.666 -2.166 1
1 43 . 8 1 1 A 5 5 LEU H H 5 8.243 8.124 0.119 1
1 44 . 8 1 1 A 5 5 LEU HA H 5 3.947 3.762 0.185 1
1 54 . 8 1 1 A 5 5 LEU C C 5 177.900 178.935 -1.035 1
1 55 . 8 1 1 A 5 5 LEU CA C 5 57.930 57.680 0.250 1
1 56 . 8 1 1 A 5 5 LEU CB C 5 41.620 41.634 -0.014 1
1 60 . 8 1 1 A 5 5 LEU N N 5 120.800 120.153 0.647 1
1 61 . 8 1 1 A 6 6 ASN H H 6 8.256 8.698 -0.442 1
1 62 . 8 1 1 A 6 6 ASN HA H 6 4.252 4.412 -0.160 1
1 67 . 8 1 1 A 6 6 ASN C C 6 177.300 177.388 -0.088 1
1 68 . 8 1 1 A 6 6 ASN CA C 6 56.900 55.741 1.159 1
1 69 . 8 1 1 A 6 6 ASN CB C 6 38.200 37.693 0.507 1
1 70 . 8 1 1 A 6 6 ASN N N 6 116.200 116.175 0.025 1
1 72 . 8 1 1 A 7 7 ASP H H 7 7.699 9.092 -1.393 1
1 73 . 8 1 1 A 7 7 ASP HA H 7 4.320 4.344 -0.024 1
1 76 . 8 1 1 A 7 7 ASP C C 7 178.000 178.662 -0.662 1
1 77 . 8 1 1 A 7 7 ASP CA C 7 56.980 57.242 -0.262 1
1 78 . 8 1 1 A 7 7 ASP CB C 7 39.870 40.793 -0.923 1
1 79 . 8 1 1 A 7 7 ASP N N 7 119.100 120.497 -1.397 1
1 80 . 8 1 1 A 8 8 LEU H H 8 7.580 8.281 -0.701 1
1 81 . 8 1 1 A 8 8 LEU HA H 8 4.091 4.019 0.072 1
1 91 . 8 1 1 A 8 8 LEU C C 8 178.800 178.625 0.175 1
1 92 . 8 1 1 A 8 8 LEU CA C 8 57.790 57.813 -0.023 1
1 93 . 8 1 1 A 8 8 LEU CB C 8 41.880 41.692 0.188 1
1 97 . 8 1 1 A 8 8 LEU N N 8 120.400 120.125 0.275 1
1 98 . 8 1 1 A 9 9 LEU H H 9 8.125 9.109 -0.984 1
1 99 . 8 1 1 A 9 9 LEU HA H 9 3.891 3.879 0.012 1
1 109 . 8 1 1 A 9 9 LEU C C 9 178.900 178.434 0.466 1
1 110 . 8 1 1 A 9 9 LEU CA C 9 58.350 58.752 -0.402 1
1 111 . 8 1 1 A 9 9 LEU CB C 9 41.510 41.846 -0.336 1
1 115 . 8 1 1 A 9 9 LEU N N 9 118.900 119.914 -1.014 1
1 116 . 8 1 1 A 10 10 GLU H H 10 8.011 8.554 -0.543 1
1 117 . 8 1 1 A 10 10 GLU HA H 10 4.072 4.087 -0.015 1
1 122 . 8 1 1 A 10 10 GLU C C 10 179.000 178.517 0.483 1
1 123 . 8 1 1 A 10 10 GLU CA C 10 59.090 60.035 -0.945 1
1 124 . 8 1 1 A 10 10 GLU CB C 10 27.910 29.244 -1.334 1
1 126 . 8 1 1 A 10 10 GLU N N 10 119.300 118.595 0.705 1
1 127 . 8 1 1 A 11 11 ASP H H 11 8.128 8.161 -0.033 1
1 128 . 8 1 1 A 11 11 ASP HA H 11 4.383 4.359 0.024 1
1 131 . 8 1 1 A 11 11 ASP C C 11 178.500 178.208 0.292 1
1 132 . 8 1 1 A 11 11 ASP CA C 11 56.580 57.084 -0.504 1
1 133 . 8 1 1 A 11 11 ASP CB C 11 38.600 41.861 -3.261 1
1 134 . 8 1 1 A 11 11 ASP N N 11 119.600 119.966 -0.366 1
1 135 . 8 1 1 A 12 12 LEU H H 12 8.394 8.546 -0.152 1
1 136 . 8 1 1 A 12 12 LEU HA H 12 3.923 4.229 -0.306 1
1 146 . 8 1 1 A 12 12 LEU C C 12 178.200 178.912 -0.712 1
1 147 . 8 1 1 A 12 12 LEU CA C 12 57.880 57.813 0.067 1
1 148 . 8 1 1 A 12 12 LEU CB C 12 41.850 41.987 -0.137 1
1 152 . 8 1 1 A 12 12 LEU N N 12 120.500 120.257 0.243 1
1 153 . 8 1 1 A 13 13 GLN H H 13 8.371 8.881 -0.510 1
1 154 . 8 1 1 A 13 13 GLN HA H 13 3.879 4.022 -0.143 1
1 161 . 8 1 1 A 13 13 GLN C C 13 178.600 177.844 0.756 1
1 162 . 8 1 1 A 13 13 GLN CA C 13 59.570 58.110 1.460 1
1 163 . 8 1 1 A 13 13 GLN CB C 13 28.440 27.705 0.735 1
1 165 . 8 1 1 A 13 13 GLN N N 13 118.400 117.219 1.181 1
1 167 . 8 1 1 A 14 14 GLU H H 14 7.913 7.694 0.219 1
1 168 . 8 1 1 A 14 14 GLU HA H 14 4.021 3.998 0.023 1
1 173 . 8 1 1 A 14 14 GLU C C 14 179.000 178.724 0.276 1
1 174 . 8 1 1 A 14 14 GLU CA C 14 59.030 58.868 0.162 1
1 175 . 8 1 1 A 14 14 GLU CB C 14 28.720 29.332 -0.612 1
1 177 . 8 1 1 A 14 14 GLU N N 14 119.100 119.646 -0.546 1
1 178 . 8 1 1 A 15 15 VAL H H 15 7.991 7.720 0.271 1
1 179 . 8 1 1 A 15 15 VAL HA H 15 3.696 3.866 -0.170 1
1 187 . 8 1 1 A 15 15 VAL C C 15 178.300 177.981 0.319 1
1 188 . 8 1 1 A 15 15 VAL CA C 15 66.640 65.472 1.168 1
1 189 . 8 1 1 A 15 15 VAL CB C 15 31.470 31.490 -0.020 1
1 192 . 8 1 1 A 15 15 VAL N N 15 120.300 117.735 2.565 1
1 193 . 8 1 1 A 16 16 LEU H H 16 8.172 7.931 0.241 1
1 194 . 8 1 1 A 16 16 LEU HA H 16 3.876 4.161 -0.285 1
1 204 . 8 1 1 A 16 16 LEU C C 16 178.400 178.462 -0.062 1
1 205 . 8 1 1 A 16 16 LEU CA C 16 58.050 58.264 -0.214 1
1 206 . 8 1 1 A 16 16 LEU CB C 16 41.420 41.409 0.011 1
1 210 . 8 1 1 A 16 16 LEU N N 16 119.700 124.831 -5.131 1
1 211 . 8 1 1 A 17 17 LYS H H 17 7.755 9.037 -1.282 1
1 212 . 8 1 1 A 17 17 LYS HA H 17 3.951 4.112 -0.161 1
1 221 . 8 1 1 A 17 17 LYS C C 17 178.800 178.983 -0.183 1
1 222 . 8 1 1 A 17 17 LYS CA C 17 59.470 58.947 0.523 1
1 223 . 8 1 1 A 17 17 LYS CB C 17 32.350 32.407 -0.057 1
1 227 . 8 1 1 A 17 17 LYS N N 17 117.800 119.894 -2.094 1
1 228 . 8 1 1 A 18 18 HIS H H 18 7.847 8.429 -0.582 1
1 229 . 8 1 1 A 18 18 HIS HA H 18 4.549 4.701 -0.152 1
1 233 . 8 1 1 A 18 18 HIS C C 18 177.200 176.667 0.533 1
1 234 . 8 1 1 A 18 18 HIS CA C 18 57.870 57.837 0.033 1
1 235 . 8 1 1 A 18 18 HIS CB C 18 28.730 29.215 -0.485 1
1 236 . 8 1 1 A 18 18 HIS N N 18 116.200 117.148 -0.948 1
1 237 . 8 1 1 A 19 19 VAL H H 19 8.415 7.864 0.551 1
1 238 . 8 1 1 A 19 19 VAL HA H 19 3.746 4.326 -0.580 1
1 246 . 8 1 1 A 19 19 VAL CA C 19 65.850 62.552 3.298 1
1 247 . 8 1 1 A 19 19 VAL CB C 19 31.600 32.675 -1.075 1
1 250 . 8 1 1 A 20 20 ASN H H 20 8.041 8.024 0.017 1
1 251 . 8 1 1 A 20 20 ASN HA H 20 4.545 4.730 -0.185 1
1 256 . 8 1 1 A 20 20 ASN C C 20 176.900 177.012 -0.112 1
1 257 . 8 1 1 A 20 20 ASN CA C 20 55.070 56.341 -1.271 1
1 258 . 8 1 1 A 20 20 ASN CB C 20 38.270 38.996 -0.726 1
1 259 . 8 1 1 A 20 20 ASN N N 20 117.900 121.429 -3.529 1
1 261 . 8 1 1 A 21 21 GLN H H 21 7.887 8.136 -0.249 1
1 262 . 8 1 1 A 21 21 GLN HA H 21 4.096 4.391 -0.295 1
1 269 . 8 1 1 A 21 21 GLN C C 21 176.900 177.371 -0.471 1
1 270 . 8 1 1 A 21 21 GLN CA C 21 57.510 56.670 0.840 1
1 271 . 8 1 1 A 21 21 GLN CB C 21 29.100 29.803 -0.703 1
1 273 . 8 1 1 A 21 21 GLN N N 21 117.900 116.873 1.027 1
1 275 . 8 1 1 A 22 22 HIS H H 22 7.887 8.174 -0.287 1
1 276 . 8 1 1 A 22 22 HIS HA H 22 4.679 4.759 -0.080 1
1 280 . 8 1 1 A 22 22 HIS C C 22 174.300 175.340 -1.040 1
1 281 . 8 1 1 A 22 22 HIS CA C 22 55.770 55.543 0.227 1
1 282 . 8 1 1 A 22 22 HIS CB C 22 28.630 29.259 -0.629 1
1 283 . 8 1 1 A 22 22 HIS N N 22 116.100 113.983 2.117 1
1 284 . 8 1 1 A 23 23 TRP H H 23 7.929 7.835 0.094 1
1 285 . 8 1 1 A 23 23 TRP HA H 23 4.542 4.793 -0.251 1
1 292 . 8 1 1 A 23 23 TRP C C 23 176.600 175.253 1.347 1
1 293 . 8 1 1 A 23 23 TRP CA C 23 58.020 58.027 -0.007 1
1 294 . 8 1 1 A 23 23 TRP CB C 23 29.700 30.877 -1.177 1
1 295 . 8 1 1 A 23 23 TRP N N 23 122.000 123.619 -1.619 1
1 297 . 8 1 1 A 24 24 GLN H H 24 8.258 8.359 -0.101 1
1 298 . 8 1 1 A 24 24 GLN HA H 24 4.329 4.910 -0.581 1
1 305 . 8 1 1 A 24 24 GLN C C 24 176.200 175.544 0.656 1
1 306 . 8 1 1 A 24 24 GLN CA C 24 55.960 54.764 1.196 1
1 307 . 8 1 1 A 24 24 GLN CB C 24 29.440 32.933 -3.493 1
1 309 . 8 1 1 A 24 24 GLN N N 24 123.800 125.641 -1.841 1
1 311 . 8 1 1 A 25 25 GLY H H 25 7.470 8.805 -1.335 1
1 312 . 8 1 1 A 25 25 GLY HA2 H 25 3.939 3.925 0.014 1
1 313 . 8 1 1 A 25 25 GLY HA3 H 25 3.800 3.935 -0.135 1
1 314 . 8 1 1 A 25 25 GLY C C 25 174.800 175.355 -0.555 1
1 315 . 8 1 1 A 25 25 GLY CA C 25 45.470 46.679 -1.209 1
1 316 . 8 1 1 A 25 25 GLY N N 25 108.100 110.951 -2.851 1
1 317 . 8 1 1 A 26 26 GLY H H 26 8.332 8.780 -0.448 1
1 318 . 8 1 1 A 26 26 GLY HA2 H 26 4.105 4.105 0.000 1
1 319 . 8 1 1 A 26 26 GLY HA3 H 26 3.974 4.136 -0.162 1
1 320 . 8 1 1 A 26 26 GLY C C 26 174.900 175.521 -0.621 1
1 321 . 8 1 1 A 26 26 GLY CA C 26 45.410 46.008 -0.598 1
1 322 . 8 1 1 A 26 26 GLY N N 26 108.700 107.086 1.614 1
1 323 . 8 1 1 A 27 27 GLN H H 27 8.474 8.354 0.120 1
1 324 . 8 1 1 A 27 27 GLN HA H 27 4.106 4.008 0.098 1
1 331 . 8 1 1 A 27 27 GLN C C 27 177.100 176.199 0.901 1
1 332 . 8 1 1 A 27 27 GLN CA C 27 57.540 56.304 1.236 1
1 333 . 8 1 1 A 27 27 GLN CB C 27 29.050 27.337 1.713 1
1 335 . 8 1 1 A 27 27 GLN N N 27 121.100 120.766 0.334 1
1 337 . 8 1 1 A 28 28 LYS H H 28 8.448 8.570 -0.122 1
1 338 . 8 1 1 A 28 28 LYS HA H 28 4.068 4.051 0.017 1
1 347 . 8 1 1 A 28 28 LYS C C 28 177.900 177.543 0.357 1
1 348 . 8 1 1 A 28 28 LYS CA C 28 58.410 58.460 -0.050 1
1 349 . 8 1 1 A 28 28 LYS CB C 28 32.210 31.638 0.572 1
1 353 . 8 1 1 A 28 28 LYS N N 28 120.500 119.947 0.553 1
1 354 . 8 1 1 A 29 29 ASN H H 29 8.273 7.663 0.610 1
1 355 . 8 1 1 A 29 29 ASN HA H 29 4.584 4.462 0.122 1
1 360 . 8 1 1 A 29 29 ASN C C 29 176.200 176.977 -0.777 1
1 361 . 8 1 1 A 29 29 ASN CA C 29 54.400 55.003 -0.603 1
1 362 . 8 1 1 A 29 29 ASN CB C 29 38.280 38.684 -0.404 1
1 363 . 8 1 1 A 29 29 ASN N N 29 117.500 117.075 0.425 1
1 365 . 8 1 1 A 30 30 MET H H 30 7.870 7.373 0.497 1
1 366 . 8 1 1 A 30 30 MET HA H 30 4.085 3.046 1.039 1
1 371 . 8 1 1 A 30 30 MET C C 30 177.000 177.819 -0.819 1
1 372 . 8 1 1 A 30 30 MET CA C 30 56.880 57.861 -0.981 1
1 373 . 8 1 1 A 30 30 MET CB C 30 32.340 31.473 0.867 1
1 375 . 8 1 1 A 30 30 MET N N 30 121.100 119.002 2.098 1
1 376 . 8 1 1 A 31 31 ASN H H 31 8.186 7.624 0.562 1
1 377 . 8 1 1 A 31 31 ASN HA H 31 4.311 4.498 -0.187 1
1 382 . 8 1 1 A 31 31 ASN C C 31 176.700 177.803 -1.103 1
1 383 . 8 1 1 A 31 31 ASN CA C 31 55.320 55.781 -0.461 1
1 384 . 8 1 1 A 31 31 ASN CB C 31 38.410 38.440 -0.030 1
1 385 . 8 1 1 A 31 31 ASN N N 31 117.900 116.186 1.714 1
1 387 . 8 1 1 A 32 32 LYS H H 32 7.792 7.563 0.229 1
1 388 . 8 1 1 A 32 32 LYS HA H 32 3.992 3.936 0.056 1
1 397 . 8 1 1 A 32 32 LYS C C 32 177.900 179.298 -1.398 1
1 398 . 8 1 1 A 32 32 LYS CA C 32 59.050 59.399 -0.349 1
1 399 . 8 1 1 A 32 32 LYS CB C 32 32.460 32.229 0.231 1
1 403 . 8 1 1 A 32 32 LYS N N 32 120.400 118.764 1.636 1
1 404 . 8 1 1 A 33 33 VAL H H 33 7.689 8.132 -0.443 1
1 405 . 8 1 1 A 33 33 VAL HA H 33 3.791 3.682 0.109 1
1 413 . 8 1 1 A 33 33 VAL C C 33 177.100 177.675 -0.575 1
1 414 . 8 1 1 A 33 33 VAL CA C 33 65.360 65.247 0.113 1
1 415 . 8 1 1 A 33 33 VAL CB C 33 31.920 31.607 0.313 1
1 418 . 8 1 1 A 33 33 VAL N N 33 120.200 115.272 4.928 1
1 419 . 8 1 1 A 34 34 ASP H H 34 8.408 8.164 0.244 1
1 420 . 8 1 1 A 34 34 ASP HA H 34 4.303 4.286 0.017 1
1 423 . 8 1 1 A 34 34 ASP C C 34 178.200 178.534 -0.334 1
1 424 . 8 1 1 A 34 34 ASP CA C 34 55.880 57.192 -1.312 1
1 425 . 8 1 1 A 34 34 ASP CB C 34 38.710 41.834 -3.124 1
1 426 . 8 1 1 A 34 34 ASP N N 34 120.100 121.720 -1.620 1
1 427 . 8 1 1 A 35 35 HIS H H 35 8.204 8.095 0.109 1
1 428 . 8 1 1 A 35 35 HIS HA H 35 4.343 4.231 0.112 1
1 431 . 8 1 1 A 35 35 HIS C C 35 176.800 177.706 -0.906 1
1 432 . 8 1 1 A 35 35 HIS CA C 35 58.310 59.656 -1.346 1
1 433 . 8 1 1 A 35 35 HIS CB C 35 28.070 29.874 -1.804 1
1 434 . 8 1 1 A 35 35 HIS N N 35 118.200 118.437 -0.237 1
1 435 . 8 1 1 A 36 36 HIS H H 36 8.067 7.868 0.199 1
1 436 . 8 1 1 A 36 36 HIS HA H 36 4.602 4.406 0.196 1
1 440 . 8 1 1 A 36 36 HIS C C 36 177.100 177.668 -0.568 1
1 441 . 8 1 1 A 36 36 HIS CA C 36 58.520 59.164 -0.644 1
1 442 . 8 1 1 A 36 36 HIS CB C 36 28.720 29.969 -1.249 1
1 443 . 8 1 1 A 36 36 HIS N N 36 117.100 117.263 -0.163 1
1 444 . 8 1 1 A 37 37 LEU H H 37 8.473 8.690 -0.217 1
1 445 . 8 1 1 A 37 37 LEU HA H 37 3.894 3.624 0.270 1
1 455 . 8 1 1 A 37 37 LEU C C 37 178.200 178.846 -0.646 1
1 456 . 8 1 1 A 37 37 LEU CA C 37 58.520 57.884 0.636 1
1 457 . 8 1 1 A 37 37 LEU CB C 37 41.810 41.373 0.437 1
1 461 . 8 1 1 A 37 37 LEU N N 37 119.600 119.587 0.013 1
1 462 . 8 1 1 A 38 38 GLN H H 38 8.337 8.938 -0.601 1
1 463 . 8 1 1 A 38 38 GLN HA H 38 3.882 3.894 -0.012 1
1 470 . 8 1 1 A 38 38 GLN C C 38 178.500 178.564 -0.064 1
1 471 . 8 1 1 A 38 38 GLN CA C 38 59.200 59.458 -0.258 1
1 472 . 8 1 1 A 38 38 GLN CB C 38 27.850 28.088 -0.238 1
1 474 . 8 1 1 A 38 38 GLN N N 38 118.000 117.207 0.793 1
1 476 . 8 1 1 A 39 39 ASN H H 39 7.923 7.381 0.542 1
1 477 . 8 1 1 A 39 39 ASN HA H 39 4.390 4.589 -0.199 1
1 482 . 8 1 1 A 39 39 ASN C C 39 177.500 178.031 -0.531 1
1 483 . 8 1 1 A 39 39 ASN CA C 39 55.780 55.930 -0.150 1
1 484 . 8 1 1 A 39 39 ASN CB C 39 37.450 38.882 -1.432 1
1 485 . 8 1 1 A 39 39 ASN N N 39 118.700 117.913 0.787 1
1 487 . 8 1 1 A 40 40 VAL H H 40 7.907 7.825 0.082 1
1 488 . 8 1 1 A 40 40 VAL HA H 40 3.629 3.473 0.156 1
1 496 . 8 1 1 A 40 40 VAL C C 40 177.500 177.777 -0.277 1
1 497 . 8 1 1 A 40 40 VAL CA C 40 67.080 66.349 0.731 1
1 498 . 8 1 1 A 40 40 VAL CB C 40 31.390 31.366 0.024 1
1 501 . 8 1 1 A 40 40 VAL N N 40 120.400 120.259 0.141 1
1 502 . 8 1 1 A 41 41 ILE H H 41 8.103 8.145 -0.042 1
1 503 . 8 1 1 A 41 41 ILE HA H 41 3.401 3.583 -0.182 1
1 513 . 8 1 1 A 41 41 ILE C C 41 178.000 178.663 -0.663 1
1 514 . 8 1 1 A 41 41 ILE CA C 41 66.430 65.374 1.056 1
1 515 . 8 1 1 A 41 41 ILE CB C 41 38.050 37.628 0.422 1
1 519 . 8 1 1 A 41 41 ILE N N 41 120.600 119.424 1.176 1
1 520 . 8 1 1 A 42 42 GLU H H 42 8.150 8.075 0.075 1
1 521 . 8 1 1 A 42 42 GLU HA H 42 4.062 4.120 -0.058 1
1 526 . 8 1 1 A 42 42 GLU C C 42 178.500 178.259 0.241 1
1 527 . 8 1 1 A 42 42 GLU CA C 42 59.120 59.092 0.028 1
1 528 . 8 1 1 A 42 42 GLU CB C 42 28.160 29.254 -1.094 1
1 530 . 8 1 1 A 42 42 GLU N N 42 119.900 121.793 -1.893 1
1 531 . 8 1 1 A 43 43 ASP H H 43 8.453 9.112 -0.659 1
1 532 . 8 1 1 A 43 43 ASP HA H 43 4.445 4.386 0.059 1
1 535 . 8 1 1 A 43 43 ASP C C 43 178.400 178.551 -0.151 1
1 536 . 8 1 1 A 43 43 ASP CA C 43 56.490 58.097 -1.607 1
1 537 . 8 1 1 A 43 43 ASP CB C 43 37.820 41.849 -4.029 1
1 538 . 8 1 1 A 43 43 ASP N N 43 119.700 120.139 -0.439 1
1 539 . 8 1 1 A 44 44 ILE H H 44 8.544 7.856 0.688 1
1 540 . 8 1 1 A 44 44 ILE HA H 44 3.590 3.740 -0.150 1
1 550 . 8 1 1 A 44 44 ILE C C 44 177.800 178.208 -0.408 1
1 551 . 8 1 1 A 44 44 ILE CA C 44 66.320 65.415 0.905 1
1 552 . 8 1 1 A 44 44 ILE CB C 44 37.690 38.041 -0.351 1
1 556 . 8 1 1 A 44 44 ILE N N 44 121.500 119.464 2.036 1
1 557 . 8 1 1 A 45 45 HIS H H 45 8.261 8.472 -0.211 1
1 558 . 8 1 1 A 45 45 HIS HA H 45 4.255 4.423 -0.168 1
1 562 . 8 1 1 A 45 45 HIS C C 45 177.200 177.064 0.136 1
1 563 . 8 1 1 A 45 45 HIS CA C 45 59.580 59.091 0.489 1
1 564 . 8 1 1 A 45 45 HIS CB C 45 27.790 29.728 -1.938 1
1 565 . 8 1 1 A 45 45 HIS N N 45 118.800 119.254 -0.454 1
1 566 . 8 1 1 A 46 46 ASP H H 46 8.680 8.121 0.559 1
1 567 . 8 1 1 A 46 46 ASP HA H 46 4.338 4.469 -0.131 1
1 570 . 8 1 1 A 46 46 ASP C C 46 178.700 178.193 0.507 1
1 571 . 8 1 1 A 46 46 ASP CA C 46 57.010 56.083 0.927 1
1 572 . 8 1 1 A 46 46 ASP CB C 46 39.400 40.890 -1.490 1
1 573 . 8 1 1 A 46 46 ASP N N 46 119.200 119.319 -0.119 1
1 574 . 8 1 1 A 47 47 PHE H H 47 8.380 9.338 -0.958 1
1 575 . 8 1 1 A 47 47 PHE HA H 47 4.070 4.218 -0.148 1
1 580 . 8 1 1 A 47 47 PHE C C 47 178.600 177.873 0.727 1
1 581 . 8 1 1 A 47 47 PHE CA C 47 61.250 60.430 0.820 1
1 582 . 8 1 1 A 47 47 PHE CB C 47 39.570 39.517 0.053 1
1 583 . 8 1 1 A 47 47 PHE N N 47 121.800 120.705 1.095 1
1 584 . 8 1 1 A 48 48 MET H H 48 8.366 7.879 0.487 1
1 585 . 8 1 1 A 48 48 MET HA H 48 3.998 4.602 -0.604 1
1 590 . 8 1 1 A 48 48 MET C C 48 177.400 178.083 -0.683 1
1 591 . 8 1 1 A 48 48 MET CA C 48 58.470 58.725 -0.255 1
1 592 . 8 1 1 A 48 48 MET CB C 48 33.170 32.639 0.531 1
1 594 . 8 1 1 A 48 48 MET N N 48 117.700 118.338 -0.638 1
1 595 . 8 1 1 A 49 49 GLN H H 49 7.659 8.283 -0.624 1
1 596 . 8 1 1 A 49 49 GLN HA H 49 4.258 4.128 0.130 1
1 603 . 8 1 1 A 49 49 GLN C C 49 176.700 178.251 -1.551 1
1 604 . 8 1 1 A 49 49 GLN CA C 49 56.380 58.551 -2.171 1
1 605 . 8 1 1 A 49 49 GLN CB C 49 28.980 28.649 0.331 1
1 607 . 8 1 1 A 49 49 GLN N N 49 116.700 116.492 0.208 1
1 609 . 8 1 1 A 50 50 GLY H H 50 7.685 8.705 -1.020 1
1 610 . 8 1 1 A 50 50 GLY HA2 H 50 3.998 3.818 0.180 1
1 611 . 8 1 1 A 50 50 GLY HA3 H 50 3.998 3.847 0.151 1
1 612 . 8 1 1 A 50 50 GLY C C 50 174.900 175.365 -0.465 1
1 613 . 8 1 1 A 50 50 GLY CA C 50 45.460 46.181 -0.721 1
1 614 . 8 1 1 A 50 50 GLY N N 50 106.400 108.956 -2.556 1
1 615 . 8 1 1 A 51 51 GLY H H 51 8.031 9.295 -1.264 1
1 616 . 8 1 1 A 51 51 GLY HA2 H 51 3.817 3.881 -0.064 1
1 617 . 8 1 1 A 51 51 GLY HA3 H 51 3.817 3.882 -0.065 1
1 618 . 8 1 1 A 51 51 GLY C C 51 174.500 174.324 0.176 1
1 619 . 8 1 1 A 51 51 GLY CA C 51 45.190 45.487 -0.297 1
1 620 . 8 1 1 A 51 51 GLY N N 51 108.900 109.032 -0.132 1
1 621 . 8 1 1 A 52 52 GLY H H 52 8.126 8.189 -0.063 1
1 622 . 8 1 1 A 52 52 GLY HA2 H 52 3.362 3.693 -0.331 1
1 623 . 8 1 1 A 52 52 GLY HA3 H 52 3.362 4.028 -0.666 1
1 624 . 8 1 1 A 52 52 GLY C C 52 173.300 174.214 -0.914 1
1 625 . 8 1 1 A 52 52 GLY CA C 52 45.120 45.152 -0.032 1
1 626 . 8 1 1 A 52 52 GLY N N 52 108.100 107.841 0.259 1
1 627 . 8 1 1 A 53 53 SER H H 53 7.594 7.939 -0.345 1
1 628 . 8 1 1 A 53 53 SER HA H 53 4.530 4.659 -0.129 1
1 631 . 8 1 1 A 53 53 SER C C 53 175.300 175.319 -0.019 1
1 632 . 8 1 1 A 53 53 SER CA C 53 57.770 57.366 0.404 1
1 633 . 8 1 1 A 53 53 SER CB C 53 64.750 61.166 3.584 1
1 634 . 8 1 1 A 53 53 SER N N 53 114.100 115.373 -1.273 1
1 635 . 8 1 1 A 54 54 GLY H H 54 9.003 8.411 0.592 1
1 636 . 8 1 1 A 54 54 GLY HA2 H 54 4.037 3.985 0.052 1
1 637 . 8 1 1 A 54 54 GLY HA3 H 54 3.911 4.073 -0.162 1
1 638 . 8 1 1 A 54 54 GLY C C 54 176.500 175.569 0.931 1
1 639 . 8 1 1 A 54 54 GLY CA C 54 47.040 46.879 0.161 1
1 640 . 8 1 1 A 54 54 GLY N N 54 110.400 110.714 -0.314 1
1 641 . 8 1 1 A 55 55 GLY H H 55 8.617 8.188 0.429 1
1 642 . 8 1 1 A 55 55 GLY HA2 H 55 3.946 3.809 0.137 1
1 643 . 8 1 1 A 55 55 GLY HA3 H 55 3.946 3.823 0.123 1
1 644 . 8 1 1 A 55 55 GLY C C 55 176.400 175.957 0.443 1
1 645 . 8 1 1 A 55 55 GLY CA C 55 46.630 47.022 -0.392 1
1 646 . 8 1 1 A 55 55 GLY N N 55 109.800 109.566 0.234 1
1 647 . 8 1 1 A 56 56 LYS H H 56 7.876 8.293 -0.417 1
1 648 . 8 1 1 A 56 56 LYS HA H 56 4.195 4.197 -0.002 1
1 657 . 8 1 1 A 56 56 LYS C C 56 178.600 178.731 -0.131 1
1 658 . 8 1 1 A 56 56 LYS CA C 56 57.960 59.031 -1.071 1
1 659 . 8 1 1 A 56 56 LYS CB C 56 32.110 32.591 -0.481 1
1 663 . 8 1 1 A 56 56 LYS N N 56 121.800 122.380 -0.580 1
1 664 . 8 1 1 A 57 57 LEU H H 57 8.153 7.886 0.267 1
1 665 . 8 1 1 A 57 57 LEU HA H 57 3.992 4.439 -0.447 1
1 675 . 8 1 1 A 57 57 LEU C C 57 178.400 178.939 -0.539 1
1 676 . 8 1 1 A 57 57 LEU CA C 57 58.190 57.762 0.428 1
1 677 . 8 1 1 A 57 57 LEU CB C 57 41.360 41.989 -0.629 1
1 681 . 8 1 1 A 57 57 LEU N N 57 120.700 121.996 -1.296 1
1 682 . 8 1 1 A 58 58 GLN H H 58 8.019 8.029 -0.010 1
1 683 . 8 1 1 A 58 58 GLN HA H 58 3.942 4.115 -0.173 1
1 690 . 8 1 1 A 58 58 GLN C C 58 179.100 178.307 0.793 1
1 691 . 8 1 1 A 58 58 GLN CA C 58 59.360 58.411 0.949 1
1 692 . 8 1 1 A 58 58 GLN CB C 58 28.030 28.278 -0.248 1
1 694 . 8 1 1 A 58 58 GLN N N 58 117.400 117.500 -0.100 1
1 696 . 8 1 1 A 59 59 GLU H H 59 7.838 8.190 -0.352 1
1 697 . 8 1 1 A 59 59 GLU HA H 59 4.030 4.191 -0.161 1
1 702 . 8 1 1 A 59 59 GLU C C 59 178.600 179.372 -0.772 1
1 703 . 8 1 1 A 59 59 GLU CA C 59 59.250 58.934 0.316 1
1 704 . 8 1 1 A 59 59 GLU CB C 59 28.960 30.288 -1.328 1
1 706 . 8 1 1 A 59 59 GLU N N 59 119.900 119.264 0.636 1
1 707 . 8 1 1 A 60 60 MET H H 60 8.223 8.021 0.202 1
1 708 . 8 1 1 A 60 60 MET HA H 60 3.966 4.242 -0.276 1
1 713 . 8 1 1 A 60 60 MET C C 60 177.900 178.234 -0.334 1
1 714 . 8 1 1 A 60 60 MET CA C 60 59.350 57.331 2.019 1
1 715 . 8 1 1 A 60 60 MET CB C 60 33.210 32.255 0.955 1
1 717 . 8 1 1 A 60 60 MET N N 60 120.100 119.264 0.836 1
1 718 . 8 1 1 A 61 61 MET H H 61 8.134 8.046 0.088 1
1 719 . 8 1 1 A 61 61 MET HA H 61 4.195 4.213 -0.018 1
1 724 . 8 1 1 A 61 61 MET C C 61 179.100 178.216 0.884 1
1 725 . 8 1 1 A 61 61 MET CA C 61 58.210 58.775 -0.565 1
1 726 . 8 1 1 A 61 61 MET CB C 61 31.340 32.092 -0.752 1
1 728 . 8 1 1 A 61 61 MET N N 61 117.000 120.090 -3.090 1
1 729 . 8 1 1 A 62 62 LYS H H 62 7.782 8.139 -0.357 1
1 730 . 8 1 1 A 62 62 LYS HA H 62 4.085 3.993 0.092 1
1 739 . 8 1 1 A 62 62 LYS C C 62 179.600 179.652 -0.052 1
1 740 . 8 1 1 A 62 62 LYS CA C 62 59.610 59.918 -0.308 1
1 741 . 8 1 1 A 62 62 LYS CB C 62 32.180 32.109 0.071 1
1 745 . 8 1 1 A 62 62 LYS N N 62 120.600 118.653 1.947 1
1 746 . 8 1 1 A 63 63 GLU H H 63 8.041 7.929 0.112 1
1 747 . 8 1 1 A 63 63 GLU HA H 63 4.057 3.887 0.170 1
1 752 . 8 1 1 A 63 63 GLU C C 63 178.900 178.562 0.338 1
1 753 . 8 1 1 A 63 63 GLU CA C 63 59.170 58.863 0.307 1
1 754 . 8 1 1 A 63 63 GLU CB C 63 29.000 29.183 -0.183 1
1 756 . 8 1 1 A 63 63 GLU N N 63 120.200 119.757 0.443 1
1 757 . 8 1 1 A 64 64 PHE H H 64 8.604 8.525 0.079 1
1 758 . 8 1 1 A 64 64 PHE HA H 64 4.155 3.892 0.263 1
1 763 . 8 1 1 A 64 64 PHE C C 64 177.800 177.686 0.114 1
1 764 . 8 1 1 A 64 64 PHE CA C 64 59.820 60.883 -1.063 1
1 765 . 8 1 1 A 64 64 PHE CB C 64 38.470 38.303 0.167 1
1 766 . 8 1 1 A 64 64 PHE N N 64 119.700 121.440 -1.740 1
1 767 . 8 1 1 A 65 65 GLN H H 65 8.177 8.028 0.149 1
1 768 . 8 1 1 A 65 65 GLN HA H 65 3.637 3.988 -0.351 1
1 775 . 8 1 1 A 65 65 GLN C C 65 177.800 177.824 -0.024 1
1 776 . 8 1 1 A 65 65 GLN CA C 65 58.970 58.100 0.870 1
1 777 . 8 1 1 A 65 65 GLN CB C 65 28.280 28.627 -0.347 1
1 779 . 8 1 1 A 65 65 GLN N N 65 118.500 118.373 0.127 1
1 781 . 8 1 1 A 66 66 GLN H H 66 7.622 7.882 -0.260 1
1 782 . 8 1 1 A 66 66 GLN HA H 66 4.040 4.236 -0.196 1
1 789 . 8 1 1 A 66 66 GLN C C 66 178.600 178.457 0.143 1
1 790 . 8 1 1 A 66 66 GLN CA C 66 59.150 58.439 0.711 1
1 791 . 8 1 1 A 66 66 GLN CB C 66 28.230 28.610 -0.380 1
1 793 . 8 1 1 A 66 66 GLN N N 66 117.400 117.936 -0.536 1
1 795 . 8 1 1 A 67 67 VAL H H 67 7.744 7.655 0.089 1
1 796 . 8 1 1 A 67 67 VAL HA H 67 3.785 3.799 -0.014 1
1 804 . 8 1 1 A 67 67 VAL C C 67 177.500 177.775 -0.275 1
1 805 . 8 1 1 A 67 67 VAL CA C 67 66.220 66.304 -0.084 1
1 806 . 8 1 1 A 67 67 VAL CB C 67 31.390 31.796 -0.406 1
1 809 . 8 1 1 A 67 67 VAL N N 67 119.500 121.317 -1.817 1
1 810 . 8 1 1 A 68 68 LEU H H 68 7.983 7.927 0.056 1
1 811 . 8 1 1 A 68 68 LEU HA H 68 3.825 4.002 -0.177 1
1 821 . 8 1 1 A 68 68 LEU C C 68 179.100 178.234 0.866 1
1 822 . 8 1 1 A 68 68 LEU CA C 68 58.740 58.341 0.399 1
1 823 . 8 1 1 A 68 68 LEU CB C 68 41.090 41.527 -0.437 1
1 827 . 8 1 1 A 68 68 LEU N N 68 120.400 120.359 0.041 1
1 828 . 8 1 1 A 69 69 ASP H H 69 8.179 7.755 0.424 1
1 829 . 8 1 1 A 69 69 ASP HA H 69 4.380 4.657 -0.277 1
1 832 . 8 1 1 A 69 69 ASP C C 69 178.900 178.014 0.886 1
1 833 . 8 1 1 A 69 69 ASP CA C 69 57.320 56.364 0.956 1
1 834 . 8 1 1 A 69 69 ASP CB C 69 40.040 40.810 -0.770 1
1 835 . 8 1 1 A 69 69 ASP N N 69 119.000 118.710 0.290 1
1 836 . 8 1 1 A 70 70 GLU H H 70 8.166 8.090 0.076 1
1 837 . 8 1 1 A 70 70 GLU HA H 70 4.082 4.216 -0.134 1
1 842 . 8 1 1 A 70 70 GLU C C 70 179.600 178.925 0.675 1
1 843 . 8 1 1 A 70 70 GLU CA C 70 59.010 58.864 0.146 1
1 844 . 8 1 1 A 70 70 GLU CB C 70 28.900 30.221 -1.321 1
1 846 . 8 1 1 A 70 70 GLU N N 70 120.500 119.381 1.119 1
1 847 . 8 1 1 A 71 71 ILE H H 71 8.415 8.122 0.293 1
1 848 . 8 1 1 A 71 71 ILE HA H 71 3.790 3.496 0.294 1
1 858 . 8 1 1 A 71 71 ILE C C 71 177.400 177.649 -0.249 1
1 859 . 8 1 1 A 71 71 ILE CA C 71 64.890 65.452 -0.562 1
1 860 . 8 1 1 A 71 71 ILE CB C 71 37.680 37.638 0.042 1
1 864 . 8 1 1 A 71 71 ILE N N 71 119.200 120.115 -0.915 1
1 865 . 8 1 1 A 72 72 LYS H H 72 8.248 7.757 0.491 1
1 866 . 8 1 1 A 72 72 LYS HA H 72 3.625 3.286 0.339 1
1 873 . 8 1 1 A 72 72 LYS C C 72 178.400 178.391 0.009 1
1 874 . 8 1 1 A 72 72 LYS CA C 72 59.850 59.403 0.447 1
1 875 . 8 1 1 A 72 72 LYS CB C 72 32.070 32.108 -0.038 1
1 879 . 8 1 1 A 72 72 LYS N N 72 120.800 121.193 -0.393 1
1 880 . 8 1 1 A 73 73 GLN H H 73 7.937 7.998 -0.061 1
1 881 . 8 1 1 A 73 73 GLN HA H 73 4.042 4.078 -0.036 1
1 888 . 8 1 1 A 73 73 GLN C C 73 178.400 179.069 -0.669 1
1 889 . 8 1 1 A 73 73 GLN CA C 73 58.510 59.046 -0.536 1
1 890 . 8 1 1 A 73 73 GLN CB C 73 28.430 28.075 0.355 1
1 892 . 8 1 1 A 73 73 GLN N N 73 117.000 118.248 -1.248 1
1 894 . 8 1 1 A 74 74 GLN H H 74 7.712 8.117 -0.405 1
1 895 . 8 1 1 A 74 74 GLN HA H 74 4.080 3.988 0.092 1
1 902 . 8 1 1 A 74 74 GLN C C 74 177.800 177.878 -0.078 1
1 903 . 8 1 1 A 74 74 GLN CA C 74 57.270 58.499 -1.229 1
1 904 . 8 1 1 A 74 74 GLN CB C 74 28.700 28.009 0.691 1
1 906 . 8 1 1 A 74 74 GLN N N 74 118.200 119.834 -1.634 1
1 908 . 8 1 1 A 75 75 LEU H H 75 7.956 7.448 0.508 1
1 909 . 8 1 1 A 75 75 LEU HA H 75 4.212 4.404 -0.192 1
1 919 . 8 1 1 A 75 75 LEU CA C 75 56.660 54.775 1.885 1
1 920 . 8 1 1 A 75 75 LEU CB C 75 42.000 40.850 1.150 1
1 924 . 8 1 1 A 75 75 LEU N N 75 120.700 118.092 2.608 1
1 925 . 8 1 1 A 76 76 GLN H H 76 8.315 8.650 -0.335 1
1 926 . 8 1 1 A 76 76 GLN HA H 76 4.113 4.370 -0.257 1
1 933 . 8 1 1 A 76 76 GLN C C 76 177.100 176.050 1.050 1
1 934 . 8 1 1 A 76 76 GLN CA C 76 57.400 55.757 1.643 1
1 935 . 8 1 1 A 76 76 GLN CB C 76 28.640 29.304 -0.664 1
1 937 . 8 1 1 A 76 76 GLN N N 76 120.100 119.516 0.584 1
1 939 . 8 1 1 A 77 77 GLY H H 77 8.021 8.305 -0.284 1
1 940 . 8 1 1 A 77 77 GLY HA2 H 77 4.042 4.007 0.035 1
1 941 . 8 1 1 A 77 77 GLY HA3 H 77 3.869 4.020 -0.151 1
1 942 . 8 1 1 A 77 77 GLY C C 77 174.600 174.043 0.557 1
1 943 . 8 1 1 A 77 77 GLY CA C 77 45.430 45.988 -0.558 1
1 944 . 8 1 1 A 77 77 GLY N N 77 107.700 107.682 0.018 1
1 945 . 8 1 1 A 78 78 GLY H H 78 7.819 8.375 -0.556 1
1 946 . 8 1 1 A 78 78 GLY HA2 H 78 4.208 3.977 0.231 1
1 947 . 8 1 1 A 78 78 GLY HA3 H 78 3.801 3.979 -0.178 1
1 948 . 8 1 1 A 78 78 GLY C C 78 173.900 174.063 -0.163 1
1 949 . 8 1 1 A 78 78 GLY CA C 78 45.140 45.444 -0.304 1
1 950 . 8 1 1 A 78 78 GLY N N 78 107.100 107.983 -0.883 1
1 951 . 8 1 1 A 79 79 ASP H H 79 7.912 8.164 -0.252 1
1 952 . 8 1 1 A 79 79 ASP HA H 79 4.722 4.698 0.024 1
1 955 . 8 1 1 A 79 79 ASP C C 79 176.200 176.108 0.092 1
1 956 . 8 1 1 A 79 79 ASP CA C 79 53.210 53.324 -0.114 1
1 957 . 8 1 1 A 79 79 ASP CB C 79 40.160 39.873 0.287 1
1 958 . 8 1 1 A 79 79 ASP N N 79 119.800 119.261 0.539 1
1 959 . 8 1 1 A 80 80 ASN H H 80 8.450 8.240 0.210 1
1 960 . 8 1 1 A 80 80 ASN HA H 80 4.593 4.423 0.170 1
1 965 . 8 1 1 A 80 80 ASN C C 80 177.300 177.224 0.076 1
1 966 . 8 1 1 A 80 80 ASN CA C 80 54.680 54.994 -0.314 1
1 967 . 8 1 1 A 80 80 ASN CB C 80 38.790 37.522 1.268 1
1 968 . 8 1 1 A 80 80 ASN N N 80 121.700 119.055 2.645 1
1 970 . 8 1 1 A 81 81 SER H H 81 8.444 8.003 0.441 1
1 971 . 8 1 1 A 81 81 SER HA H 81 4.263 4.109 0.154 1
1 974 . 8 1 1 A 81 81 SER C C 81 176.100 176.074 0.026 1
1 975 . 8 1 1 A 81 81 SER CA C 81 61.470 61.996 -0.526 1
1 976 . 8 1 1 A 81 81 SER CB C 81 61.470 62.937 -1.467 1
1 977 . 8 1 1 A 81 81 SER N N 81 117.100 117.102 -0.002 1
1 978 . 8 1 1 A 82 82 LEU H H 82 7.929 8.134 -0.205 1
1 979 . 8 1 1 A 82 82 LEU HA H 82 4.332 3.944 0.388 1
1 989 . 8 1 1 A 82 82 LEU C C 82 177.400 178.886 -1.486 1
1 990 . 8 1 1 A 82 82 LEU CA C 82 55.060 57.901 -2.841 1
1 991 . 8 1 1 A 82 82 LEU CB C 82 41.940 41.475 0.465 1
1 995 . 8 1 1 A 82 82 LEU N N 82 120.400 120.930 -0.530 1
1 996 . 8 1 1 A 83 83 HIS H H 83 8.014 7.813 0.201 1
1 997 . 8 1 1 A 83 83 HIS HA H 83 4.173 4.080 0.093 1
1 1000 . 8 1 1 A 83 83 HIS C C 83 176.100 177.037 -0.937 1
1 1001 . 8 1 1 A 83 83 HIS CA C 83 59.940 59.783 0.157 1
1 1002 . 8 1 1 A 83 83 HIS CB C 83 28.050 30.205 -2.155 1
1 1003 . 8 1 1 A 83 83 HIS N N 83 119.400 118.364 1.036 1
1 1004 . 8 1 1 A 84 84 ASN H H 84 8.598 8.582 0.016 1
1 1005 . 8 1 1 A 84 84 ASN HA H 84 4.735 4.660 0.075 1
1 1010 . 8 1 1 A 84 84 ASN C C 84 177.400 177.517 -0.117 1
1 1011 . 8 1 1 A 84 84 ASN CA C 84 55.790 54.230 1.560 1
1 1012 . 8 1 1 A 84 84 ASN CB C 84 37.520 39.373 -1.853 1
1 1013 . 8 1 1 A 84 84 ASN N N 84 118.100 116.632 1.468 1
1 1015 . 8 1 1 A 85 85 VAL H H 85 7.933 7.846 0.087 1
1 1016 . 8 1 1 A 85 85 VAL HA H 85 3.849 3.827 0.022 1
1 1024 . 8 1 1 A 85 85 VAL C C 85 177.100 177.971 -0.871 1
1 1025 . 8 1 1 A 85 85 VAL CA C 85 65.490 65.626 -0.136 1
1 1026 . 8 1 1 A 85 85 VAL CB C 85 31.760 31.943 -0.183 1
1 1029 . 8 1 1 A 85 85 VAL N N 85 120.500 120.504 -0.004 1
1 1030 . 8 1 1 A 86 86 HIS H H 86 8.460 9.336 -0.876 1
1 1031 . 8 1 1 A 86 86 HIS HA H 86 4.054 4.122 -0.068 1
1 1035 . 8 1 1 A 86 86 HIS C C 86 176.300 177.542 -1.242 1
1 1036 . 8 1 1 A 86 86 HIS CA C 86 59.860 59.699 0.161 1
1 1037 . 8 1 1 A 86 86 HIS CB C 86 29.670 30.113 -0.443 1
1 1038 . 8 1 1 A 86 86 HIS N N 86 119.300 119.234 0.066 1
1 1039 . 8 1 1 A 87 87 GLU H H 87 7.897 8.480 -0.583 1
1 1040 . 8 1 1 A 87 87 GLU HA H 87 3.838 3.874 -0.036 1
1 1045 . 8 1 1 A 87 87 GLU C C 87 178.300 179.296 -0.996 1
1 1046 . 8 1 1 A 87 87 GLU CA C 87 58.690 58.758 -0.068 1
1 1047 . 8 1 1 A 87 87 GLU CB C 87 28.460 29.438 -0.978 1
1 1049 . 8 1 1 A 87 87 GLU N N 87 117.100 119.034 -1.934 1
1 1050 . 8 1 1 A 88 88 ASN H H 88 8.103 8.946 -0.843 1
1 1051 . 8 1 1 A 88 88 ASN HA H 88 4.503 4.438 0.065 1
1 1056 . 8 1 1 A 88 88 ASN C C 88 177.700 177.770 -0.070 1
1 1057 . 8 1 1 A 88 88 ASN CA C 88 55.990 56.266 -0.276 1
1 1058 . 8 1 1 A 88 88 ASN CB C 88 39.010 38.411 0.599 1
1 1059 . 8 1 1 A 88 88 ASN N N 88 118.400 116.989 1.411 1
1 1061 . 8 1 1 A 89 89 ILE H H 89 8.501 8.113 0.388 1
1 1062 . 8 1 1 A 89 89 ILE HA H 89 3.670 3.747 -0.077 1
1 1072 . 8 1 1 A 89 89 ILE C C 89 177.000 177.806 -0.806 1
1 1073 . 8 1 1 A 89 89 ILE CA C 89 65.390 65.475 -0.085 1
1 1074 . 8 1 1 A 89 89 ILE CB C 89 37.440 37.710 -0.270 1
1 1078 . 8 1 1 A 89 89 ILE N N 89 118.700 119.711 -1.011 1
1 1079 . 8 1 1 A 90 90 LYS H H 90 8.017 7.970 0.047 1
1 1080 . 8 1 1 A 90 90 LYS HA H 90 3.775 3.897 -0.122 1
1 1089 . 8 1 1 A 90 90 LYS C C 90 178.800 178.977 -0.177 1
1 1090 . 8 1 1 A 90 90 LYS CA C 90 60.450 59.898 0.552 1
1 1091 . 8 1 1 A 90 90 LYS CB C 90 32.110 32.313 -0.203 1
1 1095 . 8 1 1 A 90 90 LYS N N 90 120.900 120.336 0.564 1
1 1096 . 8 1 1 A 91 91 GLU H H 91 7.732 7.640 0.092 1
1 1097 . 8 1 1 A 91 91 GLU HA H 91 4.083 3.996 0.087 1
1 1102 . 8 1 1 A 91 91 GLU C C 91 179.100 179.143 -0.043 1
1 1103 . 8 1 1 A 91 91 GLU CA C 91 59.120 58.929 0.191 1
1 1104 . 8 1 1 A 91 91 GLU CB C 91 28.810 29.954 -1.144 1
1 1106 . 8 1 1 A 91 91 GLU N N 91 119.300 117.600 1.700 1
1 1107 . 8 1 1 A 92 92 ILE H H 92 8.110 8.952 -0.842 1
1 1108 . 8 1 1 A 92 92 ILE HA H 92 3.685 3.771 -0.086 1
1 1118 . 8 1 1 A 92 92 ILE C C 92 178.000 178.100 -0.100 1
1 1119 . 8 1 1 A 92 92 ILE CA C 92 65.900 65.645 0.255 1
1 1120 . 8 1 1 A 92 92 ILE CB C 92 38.400 38.158 0.242 1
1 1124 . 8 1 1 A 92 92 ILE N N 92 121.100 120.868 0.232 1
1 1125 . 8 1 1 A 93 93 PHE H H 93 8.651 9.127 -0.476 1
1 1126 . 8 1 1 A 93 93 PHE HA H 93 3.873 3.212 0.661 1
1 1133 . 8 1 1 A 93 93 PHE C C 93 177.100 177.892 -0.792 1
1 1134 . 8 1 1 A 93 93 PHE CA C 93 61.020 61.147 -0.127 1
1 1135 . 8 1 1 A 93 93 PHE CB C 93 38.560 38.052 0.508 1
1 1138 . 8 1 1 A 93 93 PHE N N 93 119.400 121.157 -1.757 1
1 1139 . 8 1 1 A 94 94 HIS H H 94 8.126 7.517 0.609 1
1 1140 . 8 1 1 A 94 94 HIS HA H 94 4.368 3.824 0.544 1
1 1145 . 8 1 1 A 94 94 HIS C C 94 177.100 176.568 0.532 1
1 1146 . 8 1 1 A 94 94 HIS CA C 94 58.310 58.297 0.013 1
1 1147 . 8 1 1 A 94 94 HIS CB C 94 27.910 29.227 -1.317 1
1 1148 . 8 1 1 A 94 94 HIS N N 94 116.400 117.163 -0.763 1
1 1149 . 8 1 1 A 95 95 HIS H H 95 8.058 7.965 0.093 1
1 1150 . 8 1 1 A 95 95 HIS HA H 95 4.465 4.220 0.245 1
1 1154 . 8 1 1 A 95 95 HIS C C 95 177.300 177.485 -0.185 1
1 1155 . 8 1 1 A 95 95 HIS CA C 95 57.900 58.921 -1.021 1
1 1156 . 8 1 1 A 95 95 HIS CB C 95 28.490 30.728 -2.238 1
1 1157 . 8 1 1 A 95 95 HIS N N 95 117.000 118.074 -1.074 1
1 1158 . 8 1 1 A 96 96 LEU H H 96 8.525 7.928 0.597 1
1 1159 . 8 1 1 A 96 96 LEU HA H 96 3.865 3.894 -0.029 1
1 1169 . 8 1 1 A 96 96 LEU C C 96 178.300 178.427 -0.127 1
1 1170 . 8 1 1 A 96 96 LEU CA C 96 58.250 57.987 0.263 1
1 1171 . 8 1 1 A 96 96 LEU CB C 96 41.720 41.719 0.001 1
1 1175 . 8 1 1 A 96 96 LEU N N 96 121.300 121.094 0.206 1
1 1176 . 8 1 1 A 97 97 GLU H H 97 8.076 8.292 -0.216 1
1 1177 . 8 1 1 A 97 97 GLU HA H 97 3.719 4.124 -0.405 1
1 1182 . 8 1 1 A 97 97 GLU C C 97 178.300 177.906 0.394 1
1 1183 . 8 1 1 A 97 97 GLU CA C 97 59.300 58.657 0.643 1
1 1184 . 8 1 1 A 97 97 GLU CB C 97 28.960 29.651 -0.691 1
1 1186 . 8 1 1 A 97 97 GLU N N 97 117.100 118.636 -1.536 1
1 1187 . 8 1 1 A 98 98 GLU H H 98 7.329 8.048 -0.719 1
1 1188 . 8 1 1 A 98 98 GLU HA H 98 4.024 4.318 -0.294 1
1 1193 . 8 1 1 A 98 98 GLU C C 98 177.900 178.764 -0.864 1
1 1194 . 8 1 1 A 98 98 GLU CA C 98 58.190 58.411 -0.221 1
1 1195 . 8 1 1 A 98 98 GLU CB C 98 29.120 30.248 -1.128 1
1 1197 . 8 1 1 A 98 98 GLU N N 98 116.000 118.469 -2.469 1
1 1198 . 8 1 1 A 99 99 LEU H H 99 7.535 7.950 -0.415 1
1 1199 . 8 1 1 A 99 99 LEU HA H 99 4.183 4.112 0.071 1
1 1209 . 8 1 1 A 99 99 LEU C C 99 178.100 177.543 0.557 1
1 1210 . 8 1 1 A 99 99 LEU CA C 99 56.440 56.608 -0.168 1
1 1211 . 8 1 1 A 99 99 LEU CB C 99 43.010 41.189 1.821 1
1 1215 . 8 1 1 A 99 99 LEU N N 99 118.200 119.800 -1.600 1
1 1216 . 8 1 1 A 100 100 VAL H H 100 7.561 7.268 0.293 1
1 1217 . 8 1 1 A 100 100 VAL HA H 100 4.033 4.626 -0.593 1
1 1225 . 8 1 1 A 100 100 VAL C C 100 175.400 177.134 -1.734 1
1 1226 . 8 1 1 A 100 100 VAL CA C 100 62.430 61.372 1.058 1
1 1227 . 8 1 1 A 100 100 VAL CB C 100 32.050 33.552 -1.502 1
1 1230 . 8 1 1 A 100 100 VAL N N 100 114.800 110.959 3.841 1
1 1231 . 8 1 1 A 101 101 HIS H H 101 7.827 7.919 -0.092 1
1 1232 . 8 1 1 A 101 101 HIS HA H 101 4.630 4.483 0.147 1
1 1237 . 8 1 1 A 101 101 HIS C C 101 173.500 175.689 -2.189 1
1 1238 . 8 1 1 A 101 101 HIS CA C 101 55.410 57.124 -1.714 1
1 1239 . 8 1 1 A 101 101 HIS CB C 101 28.870 29.511 -0.641 1
1 1240 . 8 1 1 A 101 101 HIS N N 101 120.300 121.793 -1.493 1
1 10 . 9 1 1 A 2 2 TYR H H 2 8.688 7.026 1.662 1
1 11 . 9 1 1 A 2 2 TYR HA H 2 4.737 4.231 0.506 1
1 16 . 9 1 1 A 2 2 TYR C C 2 175.900 176.253 -0.353 1
1 17 . 9 1 1 A 2 2 TYR CA C 2 57.920 61.181 -3.261 1
1 18 . 9 1 1 A 2 2 TYR CB C 2 38.340 38.676 -0.336 1
1 19 . 9 1 1 A 2 2 TYR N N 2 122.100 124.262 -2.162 1
1 20 . 9 1 1 A 3 3 GLY H H 3 8.434 8.367 0.067 1
1 21 . 9 1 1 A 3 3 GLY HA2 H 3 3.909 4.126 -0.217 1
1 22 . 9 1 1 A 3 3 GLY HA3 H 3 3.841 4.169 -0.328 1
1 23 . 9 1 1 A 3 3 GLY C C 3 174.300 175.990 -1.690 1
1 24 . 9 1 1 A 3 3 GLY CA C 3 46.050 45.171 0.879 1
1 25 . 9 1 1 A 3 3 GLY N N 3 111.100 108.033 3.067 1
1 26 . 9 1 1 A 4 4 LYS H H 4 8.060 8.401 -0.341 1
1 27 . 9 1 1 A 4 4 LYS HA H 4 4.297 4.138 0.159 1
1 36 . 9 1 1 A 4 4 LYS C C 4 178.000 179.119 -1.119 1
1 37 . 9 1 1 A 4 4 LYS CA C 4 56.930 59.201 -2.271 1
1 38 . 9 1 1 A 4 4 LYS CB C 4 32.680 32.163 0.517 1
1 42 . 9 1 1 A 4 4 LYS N N 4 119.500 121.517 -2.017 1
1 43 . 9 1 1 A 5 5 LEU H H 5 8.243 8.052 0.191 1
1 44 . 9 1 1 A 5 5 LEU HA H 5 3.947 3.867 0.080 1
1 54 . 9 1 1 A 5 5 LEU C C 5 177.900 178.630 -0.730 1
1 55 . 9 1 1 A 5 5 LEU CA C 5 57.930 57.646 0.284 1
1 56 . 9 1 1 A 5 5 LEU CB C 5 41.620 41.760 -0.140 1
1 60 . 9 1 1 A 5 5 LEU N N 5 120.800 119.976 0.824 1
1 61 . 9 1 1 A 6 6 ASN H H 6 8.256 8.310 -0.054 1
1 62 . 9 1 1 A 6 6 ASN HA H 6 4.252 4.308 -0.056 1
1 67 . 9 1 1 A 6 6 ASN C C 6 177.300 177.249 0.051 1
1 68 . 9 1 1 A 6 6 ASN CA C 6 56.900 56.354 0.546 1
1 69 . 9 1 1 A 6 6 ASN CB C 6 38.200 38.448 -0.248 1
1 70 . 9 1 1 A 6 6 ASN N N 6 116.200 117.087 -0.887 1
1 72 . 9 1 1 A 7 7 ASP H H 7 7.699 8.590 -0.891 1
1 73 . 9 1 1 A 7 7 ASP HA H 7 4.320 4.367 -0.047 1
1 76 . 9 1 1 A 7 7 ASP C C 7 178.000 178.538 -0.538 1
1 77 . 9 1 1 A 7 7 ASP CA C 7 56.980 57.519 -0.539 1
1 78 . 9 1 1 A 7 7 ASP CB C 7 39.870 41.062 -1.192 1
1 79 . 9 1 1 A 7 7 ASP N N 7 119.100 120.075 -0.975 1
1 80 . 9 1 1 A 8 8 LEU H H 8 7.580 8.306 -0.726 1
1 81 . 9 1 1 A 8 8 LEU HA H 8 4.091 4.036 0.055 1
1 91 . 9 1 1 A 8 8 LEU C C 8 178.800 178.648 0.152 1
1 92 . 9 1 1 A 8 8 LEU CA C 8 57.790 57.813 -0.023 1
1 93 . 9 1 1 A 8 8 LEU CB C 8 41.880 41.790 0.090 1
1 97 . 9 1 1 A 8 8 LEU N N 8 120.400 119.997 0.403 1
1 98 . 9 1 1 A 9 9 LEU H H 9 8.125 8.980 -0.855 1
1 99 . 9 1 1 A 9 9 LEU HA H 9 3.891 3.867 0.024 1
1 109 . 9 1 1 A 9 9 LEU C C 9 178.900 178.499 0.401 1
1 110 . 9 1 1 A 9 9 LEU CA C 9 58.350 58.752 -0.402 1
1 111 . 9 1 1 A 9 9 LEU CB C 9 41.510 41.838 -0.328 1
1 115 . 9 1 1 A 9 9 LEU N N 9 118.900 119.985 -1.085 1
1 116 . 9 1 1 A 10 10 GLU H H 10 8.011 8.451 -0.440 1
1 117 . 9 1 1 A 10 10 GLU HA H 10 4.072 4.212 -0.140 1
1 122 . 9 1 1 A 10 10 GLU C C 10 179.000 178.801 0.199 1
1 123 . 9 1 1 A 10 10 GLU CA C 10 59.090 59.905 -0.815 1
1 124 . 9 1 1 A 10 10 GLU CB C 10 27.910 29.211 -1.301 1
1 126 . 9 1 1 A 10 10 GLU N N 10 119.300 118.680 0.620 1
1 127 . 9 1 1 A 11 11 ASP H H 11 8.128 7.818 0.310 1
1 128 . 9 1 1 A 11 11 ASP HA H 11 4.383 4.427 -0.044 1
1 131 . 9 1 1 A 11 11 ASP C C 11 178.500 178.602 -0.102 1
1 132 . 9 1 1 A 11 11 ASP CA C 11 56.580 57.276 -0.696 1
1 133 . 9 1 1 A 11 11 ASP CB C 11 38.600 40.645 -2.045 1
1 134 . 9 1 1 A 11 11 ASP N N 11 119.600 120.559 -0.959 1
1 135 . 9 1 1 A 12 12 LEU H H 12 8.394 8.652 -0.258 1
1 136 . 9 1 1 A 12 12 LEU HA H 12 3.923 3.975 -0.052 1
1 146 . 9 1 1 A 12 12 LEU C C 12 178.200 178.210 -0.010 1
1 147 . 9 1 1 A 12 12 LEU CA C 12 57.880 58.314 -0.434 1
1 148 . 9 1 1 A 12 12 LEU CB C 12 41.850 41.646 0.204 1
1 152 . 9 1 1 A 12 12 LEU N N 12 120.500 121.166 -0.666 1
1 153 . 9 1 1 A 13 13 GLN H H 13 8.371 8.690 -0.319 1
1 154 . 9 1 1 A 13 13 GLN HA H 13 3.879 3.991 -0.112 1
1 161 . 9 1 1 A 13 13 GLN C C 13 178.600 178.001 0.599 1
1 162 . 9 1 1 A 13 13 GLN CA C 13 59.570 58.168 1.402 1
1 163 . 9 1 1 A 13 13 GLN CB C 13 28.440 27.775 0.665 1
1 165 . 9 1 1 A 13 13 GLN N N 13 118.400 116.915 1.485 1
1 167 . 9 1 1 A 14 14 GLU H H 14 7.913 7.898 0.015 1
1 168 . 9 1 1 A 14 14 GLU HA H 14 4.021 4.025 -0.004 1
1 173 . 9 1 1 A 14 14 GLU C C 14 179.000 178.839 0.161 1
1 174 . 9 1 1 A 14 14 GLU CA C 14 59.030 58.964 0.066 1
1 175 . 9 1 1 A 14 14 GLU CB C 14 28.720 29.526 -0.806 1
1 177 . 9 1 1 A 14 14 GLU N N 14 119.100 119.776 -0.676 1
1 178 . 9 1 1 A 15 15 VAL H H 15 7.991 7.947 0.044 1
1 179 . 9 1 1 A 15 15 VAL HA H 15 3.696 3.821 -0.125 1
1 187 . 9 1 1 A 15 15 VAL C C 15 178.300 177.955 0.345 1
1 188 . 9 1 1 A 15 15 VAL CA C 15 66.640 65.540 1.100 1
1 189 . 9 1 1 A 15 15 VAL CB C 15 31.470 31.628 -0.158 1
1 192 . 9 1 1 A 15 15 VAL N N 15 120.300 117.554 2.746 1
1 193 . 9 1 1 A 16 16 LEU H H 16 8.172 8.046 0.126 1
1 194 . 9 1 1 A 16 16 LEU HA H 16 3.876 4.075 -0.199 1
1 204 . 9 1 1 A 16 16 LEU C C 16 178.400 178.462 -0.062 1
1 205 . 9 1 1 A 16 16 LEU CA C 16 58.050 58.012 0.038 1
1 206 . 9 1 1 A 16 16 LEU CB C 16 41.420 41.242 0.178 1
1 210 . 9 1 1 A 16 16 LEU N N 16 119.700 125.300 -5.600 1
1 211 . 9 1 1 A 17 17 LYS H H 17 7.755 9.143 -1.388 1
1 212 . 9 1 1 A 17 17 LYS HA H 17 3.951 4.027 -0.076 1
1 221 . 9 1 1 A 17 17 LYS C C 17 178.800 179.269 -0.469 1
1 222 . 9 1 1 A 17 17 LYS CA C 17 59.470 59.008 0.462 1
1 223 . 9 1 1 A 17 17 LYS CB C 17 32.350 32.261 0.089 1
1 227 . 9 1 1 A 17 17 LYS N N 17 117.800 119.962 -2.162 1
1 228 . 9 1 1 A 18 18 HIS H H 18 7.847 8.184 -0.337 1
1 229 . 9 1 1 A 18 18 HIS HA H 18 4.549 4.667 -0.118 1
1 233 . 9 1 1 A 18 18 HIS C C 18 177.200 176.406 0.794 1
1 234 . 9 1 1 A 18 18 HIS CA C 18 57.870 58.065 -0.195 1
1 235 . 9 1 1 A 18 18 HIS CB C 18 28.730 28.992 -0.262 1
1 236 . 9 1 1 A 18 18 HIS N N 18 116.200 117.446 -1.246 1
1 237 . 9 1 1 A 19 19 VAL H H 19 8.415 7.868 0.547 1
1 238 . 9 1 1 A 19 19 VAL HA H 19 3.746 4.156 -0.410 1
1 246 . 9 1 1 A 19 19 VAL CA C 19 65.850 64.293 1.557 1
1 247 . 9 1 1 A 19 19 VAL CB C 19 31.600 32.754 -1.154 1
1 250 . 9 1 1 A 20 20 ASN H H 20 8.041 8.240 -0.199 1
1 251 . 9 1 1 A 20 20 ASN HA H 20 4.545 4.721 -0.176 1
1 256 . 9 1 1 A 20 20 ASN C C 20 176.900 177.568 -0.668 1
1 257 . 9 1 1 A 20 20 ASN CA C 20 55.070 56.613 -1.543 1
1 258 . 9 1 1 A 20 20 ASN CB C 20 38.270 37.967 0.303 1
1 259 . 9 1 1 A 20 20 ASN N N 20 117.900 119.579 -1.679 1
1 261 . 9 1 1 A 21 21 GLN H H 21 7.887 8.267 -0.380 1
1 262 . 9 1 1 A 21 21 GLN HA H 21 4.096 4.242 -0.146 1
1 269 . 9 1 1 A 21 21 GLN C C 21 176.900 177.004 -0.104 1
1 270 . 9 1 1 A 21 21 GLN CA C 21 57.510 56.297 1.213 1
1 271 . 9 1 1 A 21 21 GLN CB C 21 29.100 29.041 0.059 1
1 273 . 9 1 1 A 21 21 GLN N N 21 117.900 115.262 2.638 1
1 275 . 9 1 1 A 22 22 HIS H H 22 7.887 8.294 -0.407 1
1 276 . 9 1 1 A 22 22 HIS HA H 22 4.679 4.853 -0.174 1
1 280 . 9 1 1 A 22 22 HIS C C 22 174.300 175.150 -0.850 1
1 281 . 9 1 1 A 22 22 HIS CA C 22 55.770 55.623 0.147 1
1 282 . 9 1 1 A 22 22 HIS CB C 22 28.630 30.347 -1.717 1
1 283 . 9 1 1 A 22 22 HIS N N 22 116.100 114.115 1.985 1
1 284 . 9 1 1 A 23 23 TRP H H 23 7.929 7.734 0.195 1
1 285 . 9 1 1 A 23 23 TRP HA H 23 4.542 4.518 0.024 1
1 292 . 9 1 1 A 23 23 TRP C C 23 176.600 175.561 1.039 1
1 293 . 9 1 1 A 23 23 TRP CA C 23 58.020 58.885 -0.865 1
1 294 . 9 1 1 A 23 23 TRP CB C 23 29.700 30.236 -0.536 1
1 295 . 9 1 1 A 23 23 TRP N N 23 122.000 123.827 -1.827 1
1 297 . 9 1 1 A 24 24 GLN H H 24 8.258 8.249 0.009 1
1 298 . 9 1 1 A 24 24 GLN HA H 24 4.329 4.904 -0.575 1
1 305 . 9 1 1 A 24 24 GLN C C 24 176.200 175.570 0.630 1
1 306 . 9 1 1 A 24 24 GLN CA C 24 55.960 54.728 1.232 1
1 307 . 9 1 1 A 24 24 GLN CB C 24 29.440 33.049 -3.609 1
1 309 . 9 1 1 A 24 24 GLN N N 24 123.800 125.940 -2.140 1
1 311 . 9 1 1 A 25 25 GLY H H 25 7.470 8.828 -1.358 1
1 312 . 9 1 1 A 25 25 GLY HA2 H 25 3.939 3.911 0.028 1
1 313 . 9 1 1 A 25 25 GLY HA3 H 25 3.800 3.938 -0.138 1
1 314 . 9 1 1 A 25 25 GLY C C 25 174.800 175.281 -0.481 1
1 315 . 9 1 1 A 25 25 GLY CA C 25 45.470 46.755 -1.285 1
1 316 . 9 1 1 A 25 25 GLY N N 25 108.100 111.437 -3.337 1
1 317 . 9 1 1 A 26 26 GLY H H 26 8.332 8.626 -0.294 1
1 318 . 9 1 1 A 26 26 GLY HA2 H 26 4.105 4.169 -0.064 1
1 319 . 9 1 1 A 26 26 GLY HA3 H 26 3.974 4.215 -0.241 1
1 320 . 9 1 1 A 26 26 GLY C C 26 174.900 175.162 -0.262 1
1 321 . 9 1 1 A 26 26 GLY CA C 26 45.410 45.400 0.010 1
1 322 . 9 1 1 A 26 26 GLY N N 26 108.700 106.889 1.811 1
1 323 . 9 1 1 A 27 27 GLN H H 27 8.474 8.371 0.103 1
1 324 . 9 1 1 A 27 27 GLN HA H 27 4.106 4.174 -0.068 1
1 331 . 9 1 1 A 27 27 GLN C C 27 177.100 176.494 0.606 1
1 332 . 9 1 1 A 27 27 GLN CA C 27 57.540 57.012 0.528 1
1 333 . 9 1 1 A 27 27 GLN CB C 27 29.050 28.667 0.383 1
1 335 . 9 1 1 A 27 27 GLN N N 27 121.100 122.702 -1.602 1
1 337 . 9 1 1 A 28 28 LYS H H 28 8.448 8.391 0.057 1
1 338 . 9 1 1 A 28 28 LYS HA H 28 4.068 4.021 0.047 1
1 347 . 9 1 1 A 28 28 LYS C C 28 177.900 178.779 -0.879 1
1 348 . 9 1 1 A 28 28 LYS CA C 28 58.410 58.980 -0.570 1
1 349 . 9 1 1 A 28 28 LYS CB C 28 32.210 32.542 -0.332 1
1 353 . 9 1 1 A 28 28 LYS N N 28 120.500 117.964 2.536 1
1 354 . 9 1 1 A 29 29 ASN H H 29 8.273 7.610 0.663 1
1 355 . 9 1 1 A 29 29 ASN HA H 29 4.584 4.388 0.196 1
1 360 . 9 1 1 A 29 29 ASN C C 29 176.200 177.546 -1.346 1
1 361 . 9 1 1 A 29 29 ASN CA C 29 54.400 56.340 -1.940 1
1 362 . 9 1 1 A 29 29 ASN CB C 29 38.280 37.966 0.314 1
1 363 . 9 1 1 A 29 29 ASN N N 29 117.500 118.350 -0.850 1
1 365 . 9 1 1 A 30 30 MET H H 30 7.870 7.503 0.367 1
1 366 . 9 1 1 A 30 30 MET HA H 30 4.085 3.114 0.971 1
1 371 . 9 1 1 A 30 30 MET C C 30 177.000 177.377 -0.377 1
1 372 . 9 1 1 A 30 30 MET CA C 30 56.880 57.666 -0.786 1
1 373 . 9 1 1 A 30 30 MET CB C 30 32.340 31.947 0.393 1
1 375 . 9 1 1 A 30 30 MET N N 30 121.100 118.798 2.302 1
1 376 . 9 1 1 A 31 31 ASN H H 31 8.186 7.512 0.674 1
1 377 . 9 1 1 A 31 31 ASN HA H 31 4.311 4.560 -0.249 1
1 382 . 9 1 1 A 31 31 ASN C C 31 176.700 177.176 -0.476 1
1 383 . 9 1 1 A 31 31 ASN CA C 31 55.320 55.055 0.265 1
1 384 . 9 1 1 A 31 31 ASN CB C 31 38.410 39.178 -0.768 1
1 385 . 9 1 1 A 31 31 ASN N N 31 117.900 115.620 2.280 1
1 387 . 9 1 1 A 32 32 LYS H H 32 7.792 7.258 0.534 1
1 388 . 9 1 1 A 32 32 LYS HA H 32 3.992 4.041 -0.049 1
1 397 . 9 1 1 A 32 32 LYS C C 32 177.900 178.563 -0.663 1
1 398 . 9 1 1 A 32 32 LYS CA C 32 59.050 58.246 0.804 1
1 399 . 9 1 1 A 32 32 LYS CB C 32 32.460 31.919 0.541 1
1 403 . 9 1 1 A 32 32 LYS N N 32 120.400 118.975 1.425 1
1 404 . 9 1 1 A 33 33 VAL H H 33 7.689 8.480 -0.791 1
1 405 . 9 1 1 A 33 33 VAL HA H 33 3.791 3.397 0.394 1
1 413 . 9 1 1 A 33 33 VAL C C 33 177.100 177.564 -0.464 1
1 414 . 9 1 1 A 33 33 VAL CA C 33 65.360 64.812 0.548 1
1 415 . 9 1 1 A 33 33 VAL CB C 33 31.920 31.595 0.325 1
1 418 . 9 1 1 A 33 33 VAL N N 33 120.200 116.937 3.263 1
1 419 . 9 1 1 A 34 34 ASP H H 34 8.408 7.922 0.486 1
1 420 . 9 1 1 A 34 34 ASP HA H 34 4.303 4.259 0.044 1
1 423 . 9 1 1 A 34 34 ASP C C 34 178.200 178.502 -0.302 1
1 424 . 9 1 1 A 34 34 ASP CA C 34 55.880 56.957 -1.077 1
1 425 . 9 1 1 A 34 34 ASP CB C 34 38.710 40.800 -2.090 1
1 426 . 9 1 1 A 34 34 ASP N N 34 120.100 122.081 -1.981 1
1 427 . 9 1 1 A 35 35 HIS H H 35 8.204 7.915 0.289 1
1 428 . 9 1 1 A 35 35 HIS HA H 35 4.343 4.305 0.038 1
1 431 . 9 1 1 A 35 35 HIS C C 35 176.800 177.206 -0.406 1
1 432 . 9 1 1 A 35 35 HIS CA C 35 58.310 58.673 -0.363 1
1 433 . 9 1 1 A 35 35 HIS CB C 35 28.070 29.930 -1.860 1
1 434 . 9 1 1 A 35 35 HIS N N 35 118.200 118.975 -0.775 1
1 435 . 9 1 1 A 36 36 HIS H H 36 8.067 8.999 -0.932 1
1 436 . 9 1 1 A 36 36 HIS HA H 36 4.602 4.129 0.473 1
1 440 . 9 1 1 A 36 36 HIS C C 36 177.100 177.611 -0.511 1
1 441 . 9 1 1 A 36 36 HIS CA C 36 58.520 59.755 -1.235 1
1 442 . 9 1 1 A 36 36 HIS CB C 36 28.720 30.063 -1.343 1
1 443 . 9 1 1 A 36 36 HIS N N 36 117.100 117.149 -0.049 1
1 444 . 9 1 1 A 37 37 LEU H H 37 8.473 8.202 0.271 1
1 445 . 9 1 1 A 37 37 LEU HA H 37 3.894 3.784 0.110 1
1 455 . 9 1 1 A 37 37 LEU C C 37 178.200 178.673 -0.473 1
1 456 . 9 1 1 A 37 37 LEU CA C 37 58.520 57.861 0.659 1
1 457 . 9 1 1 A 37 37 LEU CB C 37 41.810 41.466 0.344 1
1 461 . 9 1 1 A 37 37 LEU N N 37 119.600 119.599 0.001 1
1 462 . 9 1 1 A 38 38 GLN H H 38 8.337 8.195 0.142 1
1 463 . 9 1 1 A 38 38 GLN HA H 38 3.882 3.934 -0.052 1
1 470 . 9 1 1 A 38 38 GLN C C 38 178.500 177.920 0.580 1
1 471 . 9 1 1 A 38 38 GLN CA C 38 59.200 59.018 0.182 1
1 472 . 9 1 1 A 38 38 GLN CB C 38 27.850 28.123 -0.273 1
1 474 . 9 1 1 A 38 38 GLN N N 38 118.000 117.181 0.819 1
1 476 . 9 1 1 A 39 39 ASN H H 39 7.923 7.527 0.396 1
1 477 . 9 1 1 A 39 39 ASN HA H 39 4.390 4.396 -0.006 1
1 482 . 9 1 1 A 39 39 ASN C C 39 177.500 177.690 -0.190 1
1 483 . 9 1 1 A 39 39 ASN CA C 39 55.780 56.066 -0.286 1
1 484 . 9 1 1 A 39 39 ASN CB C 39 37.450 38.192 -0.742 1
1 485 . 9 1 1 A 39 39 ASN N N 39 118.700 117.893 0.807 1
1 487 . 9 1 1 A 40 40 VAL H H 40 7.907 8.310 -0.403 1
1 488 . 9 1 1 A 40 40 VAL HA H 40 3.629 3.613 0.016 1
1 496 . 9 1 1 A 40 40 VAL C C 40 177.500 177.841 -0.341 1
1 497 . 9 1 1 A 40 40 VAL CA C 40 67.080 66.354 0.726 1
1 498 . 9 1 1 A 40 40 VAL CB C 40 31.390 31.567 -0.177 1
1 501 . 9 1 1 A 40 40 VAL N N 40 120.400 118.779 1.621 1
1 502 . 9 1 1 A 41 41 ILE H H 41 8.103 7.786 0.317 1
1 503 . 9 1 1 A 41 41 ILE HA H 41 3.401 3.685 -0.284 1
1 513 . 9 1 1 A 41 41 ILE C C 41 178.000 178.808 -0.808 1
1 514 . 9 1 1 A 41 41 ILE CA C 41 66.430 64.974 1.456 1
1 515 . 9 1 1 A 41 41 ILE CB C 41 38.050 38.008 0.042 1
1 519 . 9 1 1 A 41 41 ILE N N 41 120.600 119.413 1.187 1
1 520 . 9 1 1 A 42 42 GLU H H 42 8.150 8.162 -0.012 1
1 521 . 9 1 1 A 42 42 GLU HA H 42 4.062 4.064 -0.002 1
1 526 . 9 1 1 A 42 42 GLU C C 42 178.500 179.043 -0.543 1
1 527 . 9 1 1 A 42 42 GLU CA C 42 59.120 59.336 -0.216 1
1 528 . 9 1 1 A 42 42 GLU CB C 42 28.160 29.316 -1.156 1
1 530 . 9 1 1 A 42 42 GLU N N 42 119.900 122.057 -2.157 1
1 531 . 9 1 1 A 43 43 ASP H H 43 8.453 9.134 -0.681 1
1 532 . 9 1 1 A 43 43 ASP HA H 43 4.445 4.492 -0.047 1
1 535 . 9 1 1 A 43 43 ASP C C 43 178.400 178.867 -0.467 1
1 536 . 9 1 1 A 43 43 ASP CA C 43 56.490 57.164 -0.674 1
1 537 . 9 1 1 A 43 43 ASP CB C 43 37.820 41.595 -3.775 1
1 538 . 9 1 1 A 43 43 ASP N N 43 119.700 120.417 -0.717 1
1 539 . 9 1 1 A 44 44 ILE H H 44 8.544 7.696 0.848 1
1 540 . 9 1 1 A 44 44 ILE HA H 44 3.590 3.768 -0.178 1
1 550 . 9 1 1 A 44 44 ILE C C 44 177.800 178.607 -0.807 1
1 551 . 9 1 1 A 44 44 ILE CA C 44 66.320 65.521 0.799 1
1 552 . 9 1 1 A 44 44 ILE CB C 44 37.690 37.840 -0.150 1
1 556 . 9 1 1 A 44 44 ILE N N 44 121.500 120.099 1.401 1
1 557 . 9 1 1 A 45 45 HIS H H 45 8.261 8.088 0.173 1
1 558 . 9 1 1 A 45 45 HIS HA H 45 4.255 4.470 -0.215 1
1 562 . 9 1 1 A 45 45 HIS C C 45 177.200 176.690 0.510 1
1 563 . 9 1 1 A 45 45 HIS CA C 45 59.580 58.926 0.654 1
1 564 . 9 1 1 A 45 45 HIS CB C 45 27.790 29.567 -1.777 1
1 565 . 9 1 1 A 45 45 HIS N N 45 118.800 118.911 -0.111 1
1 566 . 9 1 1 A 46 46 ASP H H 46 8.680 7.893 0.787 1
1 567 . 9 1 1 A 46 46 ASP HA H 46 4.338 4.874 -0.536 1
1 570 . 9 1 1 A 46 46 ASP C C 46 178.700 178.260 0.440 1
1 571 . 9 1 1 A 46 46 ASP CA C 46 57.010 55.575 1.435 1
1 572 . 9 1 1 A 46 46 ASP CB C 46 39.400 40.892 -1.492 1
1 573 . 9 1 1 A 46 46 ASP N N 46 119.200 119.082 0.118 1
1 574 . 9 1 1 A 47 47 PHE H H 47 8.380 9.114 -0.734 1
1 575 . 9 1 1 A 47 47 PHE HA H 47 4.070 4.186 -0.116 1
1 580 . 9 1 1 A 47 47 PHE C C 47 178.600 177.425 1.175 1
1 581 . 9 1 1 A 47 47 PHE CA C 47 61.250 60.984 0.266 1
1 582 . 9 1 1 A 47 47 PHE CB C 47 39.570 38.866 0.704 1
1 583 . 9 1 1 A 47 47 PHE N N 47 121.800 121.549 0.251 1
1 584 . 9 1 1 A 48 48 MET H H 48 8.366 8.470 -0.104 1
1 585 . 9 1 1 A 48 48 MET HA H 48 3.998 4.319 -0.321 1
1 590 . 9 1 1 A 48 48 MET C C 48 177.400 178.099 -0.699 1
1 591 . 9 1 1 A 48 48 MET CA C 48 58.470 59.265 -0.795 1
1 592 . 9 1 1 A 48 48 MET CB C 48 33.170 33.011 0.159 1
1 594 . 9 1 1 A 48 48 MET N N 48 117.700 117.645 0.055 1
1 595 . 9 1 1 A 49 49 GLN H H 49 7.659 8.383 -0.724 1
1 596 . 9 1 1 A 49 49 GLN HA H 49 4.258 4.066 0.192 1
1 603 . 9 1 1 A 49 49 GLN C C 49 176.700 178.160 -1.460 1
1 604 . 9 1 1 A 49 49 GLN CA C 49 56.380 58.270 -1.890 1
1 605 . 9 1 1 A 49 49 GLN CB C 49 28.980 28.074 0.906 1
1 607 . 9 1 1 A 49 49 GLN N N 49 116.700 117.833 -1.133 1
1 609 . 9 1 1 A 50 50 GLY H H 50 7.685 8.217 -0.532 1
1 610 . 9 1 1 A 50 50 GLY HA2 H 50 3.998 3.784 0.214 1
1 611 . 9 1 1 A 50 50 GLY HA3 H 50 3.998 3.835 0.163 1
1 612 . 9 1 1 A 50 50 GLY C C 50 174.900 175.468 -0.568 1
1 613 . 9 1 1 A 50 50 GLY CA C 50 45.460 45.976 -0.516 1
1 614 . 9 1 1 A 50 50 GLY N N 50 106.400 108.791 -2.391 1
1 615 . 9 1 1 A 51 51 GLY H H 51 8.031 8.748 -0.717 1
1 616 . 9 1 1 A 51 51 GLY HA2 H 51 3.817 3.808 0.009 1
1 617 . 9 1 1 A 51 51 GLY HA3 H 51 3.817 3.835 -0.018 1
1 618 . 9 1 1 A 51 51 GLY C C 51 174.500 174.525 -0.025 1
1 619 . 9 1 1 A 51 51 GLY CA C 51 45.190 45.411 -0.221 1
1 620 . 9 1 1 A 51 51 GLY N N 51 108.900 108.620 0.280 1
1 621 . 9 1 1 A 52 52 GLY H H 52 8.126 9.030 -0.904 1
1 622 . 9 1 1 A 52 52 GLY HA2 H 52 3.362 3.626 -0.264 1
1 623 . 9 1 1 A 52 52 GLY HA3 H 52 3.362 4.005 -0.643 1
1 624 . 9 1 1 A 52 52 GLY C C 52 173.300 174.293 -0.993 1
1 625 . 9 1 1 A 52 52 GLY CA C 52 45.120 45.122 -0.002 1
1 626 . 9 1 1 A 52 52 GLY N N 52 108.100 107.474 0.626 1
1 627 . 9 1 1 A 53 53 SER H H 53 7.594 7.788 -0.194 1
1 628 . 9 1 1 A 53 53 SER HA H 53 4.530 4.651 -0.121 1
1 631 . 9 1 1 A 53 53 SER C C 53 175.300 175.185 0.115 1
1 632 . 9 1 1 A 53 53 SER CA C 53 57.770 57.207 0.563 1
1 633 . 9 1 1 A 53 53 SER CB C 53 64.750 61.229 3.521 1
1 634 . 9 1 1 A 53 53 SER N N 53 114.100 116.270 -2.170 1
1 635 . 9 1 1 A 54 54 GLY H H 54 9.003 8.825 0.178 1
1 636 . 9 1 1 A 54 54 GLY HA2 H 54 4.037 3.999 0.038 1
1 637 . 9 1 1 A 54 54 GLY HA3 H 54 3.911 4.133 -0.222 1
1 638 . 9 1 1 A 54 54 GLY C C 54 176.500 175.585 0.915 1
1 639 . 9 1 1 A 54 54 GLY CA C 54 47.040 46.996 0.044 1
1 640 . 9 1 1 A 54 54 GLY N N 54 110.400 112.125 -1.725 1
1 641 . 9 1 1 A 55 55 GLY H H 55 8.617 8.311 0.306 1
1 642 . 9 1 1 A 55 55 GLY HA2 H 55 3.946 3.824 0.122 1
1 643 . 9 1 1 A 55 55 GLY HA3 H 55 3.946 3.836 0.110 1
1 644 . 9 1 1 A 55 55 GLY C C 55 176.400 176.006 0.394 1
1 645 . 9 1 1 A 55 55 GLY CA C 55 46.630 47.057 -0.427 1
1 646 . 9 1 1 A 55 55 GLY N N 55 109.800 109.615 0.185 1
1 647 . 9 1 1 A 56 56 LYS H H 56 7.876 8.377 -0.501 1
1 648 . 9 1 1 A 56 56 LYS HA H 56 4.195 4.082 0.113 1
1 657 . 9 1 1 A 56 56 LYS C C 56 178.600 179.138 -0.538 1
1 658 . 9 1 1 A 56 56 LYS CA C 56 57.960 59.343 -1.383 1
1 659 . 9 1 1 A 56 56 LYS CB C 56 32.110 31.866 0.244 1
1 663 . 9 1 1 A 56 56 LYS N N 56 121.800 122.600 -0.800 1
1 664 . 9 1 1 A 57 57 LEU H H 57 8.153 7.733 0.420 1
1 665 . 9 1 1 A 57 57 LEU HA H 57 3.992 4.456 -0.464 1
1 675 . 9 1 1 A 57 57 LEU C C 57 178.400 178.842 -0.442 1
1 676 . 9 1 1 A 57 57 LEU CA C 57 58.190 58.263 -0.073 1
1 677 . 9 1 1 A 57 57 LEU CB C 57 41.360 41.989 -0.629 1
1 681 . 9 1 1 A 57 57 LEU N N 57 120.700 121.998 -1.298 1
1 682 . 9 1 1 A 58 58 GLN H H 58 8.019 8.111 -0.092 1
1 683 . 9 1 1 A 58 58 GLN HA H 58 3.942 4.086 -0.144 1
1 690 . 9 1 1 A 58 58 GLN C C 58 179.100 178.395 0.705 1
1 691 . 9 1 1 A 58 58 GLN CA C 58 59.360 58.527 0.833 1
1 692 . 9 1 1 A 58 58 GLN CB C 58 28.030 28.321 -0.291 1
1 694 . 9 1 1 A 58 58 GLN N N 58 117.400 117.453 -0.053 1
1 696 . 9 1 1 A 59 59 GLU H H 59 7.838 8.124 -0.286 1
1 697 . 9 1 1 A 59 59 GLU HA H 59 4.030 4.119 -0.089 1
1 702 . 9 1 1 A 59 59 GLU C C 59 178.600 179.278 -0.678 1
1 703 . 9 1 1 A 59 59 GLU CA C 59 59.250 59.016 0.234 1
1 704 . 9 1 1 A 59 59 GLU CB C 59 28.960 29.667 -0.707 1
1 706 . 9 1 1 A 59 59 GLU N N 59 119.900 120.410 -0.510 1
1 707 . 9 1 1 A 60 60 MET H H 60 8.223 8.209 0.014 1
1 708 . 9 1 1 A 60 60 MET HA H 60 3.966 4.291 -0.325 1
1 713 . 9 1 1 A 60 60 MET C C 60 177.900 178.262 -0.362 1
1 714 . 9 1 1 A 60 60 MET CA C 60 59.350 57.325 2.025 1
1 715 . 9 1 1 A 60 60 MET CB C 60 33.210 32.272 0.938 1
1 717 . 9 1 1 A 60 60 MET N N 60 120.100 118.738 1.362 1
1 718 . 9 1 1 A 61 61 MET H H 61 8.134 8.017 0.117 1
1 719 . 9 1 1 A 61 61 MET HA H 61 4.195 4.268 -0.073 1
1 724 . 9 1 1 A 61 61 MET C C 61 179.100 178.286 0.814 1
1 725 . 9 1 1 A 61 61 MET CA C 61 58.210 58.575 -0.365 1
1 726 . 9 1 1 A 61 61 MET CB C 61 31.340 32.286 -0.946 1
1 728 . 9 1 1 A 61 61 MET N N 61 117.000 120.453 -3.453 1
1 729 . 9 1 1 A 62 62 LYS H H 62 7.782 7.790 -0.008 1
1 730 . 9 1 1 A 62 62 LYS HA H 62 4.085 4.096 -0.011 1
1 739 . 9 1 1 A 62 62 LYS C C 62 179.600 179.231 0.369 1
1 740 . 9 1 1 A 62 62 LYS CA C 62 59.610 59.966 -0.356 1
1 741 . 9 1 1 A 62 62 LYS CB C 62 32.180 32.249 -0.069 1
1 745 . 9 1 1 A 62 62 LYS N N 62 120.600 118.974 1.626 1
1 746 . 9 1 1 A 63 63 GLU H H 63 8.041 7.940 0.101 1
1 747 . 9 1 1 A 63 63 GLU HA H 63 4.057 3.998 0.059 1
1 752 . 9 1 1 A 63 63 GLU C C 63 178.900 179.013 -0.113 1
1 753 . 9 1 1 A 63 63 GLU CA C 63 59.170 59.246 -0.076 1
1 754 . 9 1 1 A 63 63 GLU CB C 63 29.000 29.445 -0.445 1
1 756 . 9 1 1 A 63 63 GLU N N 63 120.200 120.087 0.113 1
1 757 . 9 1 1 A 64 64 PHE H H 64 8.604 9.369 -0.765 1
1 758 . 9 1 1 A 64 64 PHE HA H 64 4.155 3.879 0.276 1
1 763 . 9 1 1 A 64 64 PHE C C 64 177.800 178.264 -0.464 1
1 764 . 9 1 1 A 64 64 PHE CA C 64 59.820 61.248 -1.428 1
1 765 . 9 1 1 A 64 64 PHE CB C 64 38.470 38.794 -0.324 1
1 766 . 9 1 1 A 64 64 PHE N N 64 119.700 120.484 -0.784 1
1 767 . 9 1 1 A 65 65 GLN H H 65 8.177 8.588 -0.411 1
1 768 . 9 1 1 A 65 65 GLN HA H 65 3.637 4.496 -0.859 1
1 775 . 9 1 1 A 65 65 GLN C C 65 177.800 178.329 -0.529 1
1 776 . 9 1 1 A 65 65 GLN CA C 65 58.970 58.647 0.323 1
1 777 . 9 1 1 A 65 65 GLN CB C 65 28.280 28.823 -0.543 1
1 779 . 9 1 1 A 65 65 GLN N N 65 118.500 118.887 -0.387 1
1 781 . 9 1 1 A 66 66 GLN H H 66 7.622 7.953 -0.331 1
1 782 . 9 1 1 A 66 66 GLN HA H 66 4.040 4.197 -0.157 1
1 789 . 9 1 1 A 66 66 GLN C C 66 178.600 178.686 -0.086 1
1 790 . 9 1 1 A 66 66 GLN CA C 66 59.150 58.366 0.784 1
1 791 . 9 1 1 A 66 66 GLN CB C 66 28.230 28.377 -0.147 1
1 793 . 9 1 1 A 66 66 GLN N N 66 117.400 118.568 -1.168 1
1 795 . 9 1 1 A 67 67 VAL H H 67 7.744 7.615 0.129 1
1 796 . 9 1 1 A 67 67 VAL HA H 67 3.785 3.698 0.087 1
1 804 . 9 1 1 A 67 67 VAL C C 67 177.500 177.911 -0.411 1
1 805 . 9 1 1 A 67 67 VAL CA C 67 66.220 66.343 -0.123 1
1 806 . 9 1 1 A 67 67 VAL CB C 67 31.390 31.630 -0.240 1
1 809 . 9 1 1 A 67 67 VAL N N 67 119.500 119.975 -0.475 1
1 810 . 9 1 1 A 68 68 LEU H H 68 7.983 7.734 0.249 1
1 811 . 9 1 1 A 68 68 LEU HA H 68 3.825 4.054 -0.229 1
1 821 . 9 1 1 A 68 68 LEU C C 68 179.100 178.184 0.916 1
1 822 . 9 1 1 A 68 68 LEU CA C 68 58.740 58.141 0.599 1
1 823 . 9 1 1 A 68 68 LEU CB C 68 41.090 42.046 -0.956 1
1 827 . 9 1 1 A 68 68 LEU N N 68 120.400 120.391 0.009 1
1 828 . 9 1 1 A 69 69 ASP H H 69 8.179 7.833 0.346 1
1 829 . 9 1 1 A 69 69 ASP HA H 69 4.380 4.446 -0.066 1
1 832 . 9 1 1 A 69 69 ASP C C 69 178.900 178.205 0.695 1
1 833 . 9 1 1 A 69 69 ASP CA C 69 57.320 56.554 0.766 1
1 834 . 9 1 1 A 69 69 ASP CB C 69 40.040 40.796 -0.756 1
1 835 . 9 1 1 A 69 69 ASP N N 69 119.000 118.302 0.698 1
1 836 . 9 1 1 A 70 70 GLU H H 70 8.166 8.298 -0.132 1
1 837 . 9 1 1 A 70 70 GLU HA H 70 4.082 4.169 -0.087 1
1 842 . 9 1 1 A 70 70 GLU C C 70 179.600 178.800 0.800 1
1 843 . 9 1 1 A 70 70 GLU CA C 70 59.010 59.019 -0.009 1
1 844 . 9 1 1 A 70 70 GLU CB C 70 28.900 29.884 -0.984 1
1 846 . 9 1 1 A 70 70 GLU N N 70 120.500 119.397 1.103 1
1 847 . 9 1 1 A 71 71 ILE H H 71 8.415 7.946 0.469 1
1 848 . 9 1 1 A 71 71 ILE HA H 71 3.790 3.361 0.429 1
1 858 . 9 1 1 A 71 71 ILE C C 71 177.400 177.460 -0.060 1
1 859 . 9 1 1 A 71 71 ILE CA C 71 64.890 64.931 -0.041 1
1 860 . 9 1 1 A 71 71 ILE CB C 71 37.680 37.514 0.166 1
1 864 . 9 1 1 A 71 71 ILE N N 71 119.200 120.136 -0.936 1
1 865 . 9 1 1 A 72 72 LYS H H 72 8.248 8.108 0.140 1
1 866 . 9 1 1 A 72 72 LYS HA H 72 3.625 3.252 0.373 1
1 873 . 9 1 1 A 72 72 LYS C C 72 178.400 178.559 -0.159 1
1 874 . 9 1 1 A 72 72 LYS CA C 72 59.850 59.395 0.455 1
1 875 . 9 1 1 A 72 72 LYS CB C 72 32.070 32.074 -0.004 1
1 879 . 9 1 1 A 72 72 LYS N N 72 120.800 121.195 -0.395 1
1 880 . 9 1 1 A 73 73 GLN H H 73 7.937 8.227 -0.290 1
1 881 . 9 1 1 A 73 73 GLN HA H 73 4.042 3.894 0.148 1
1 888 . 9 1 1 A 73 73 GLN C C 73 178.400 178.191 0.209 1
1 889 . 9 1 1 A 73 73 GLN CA C 73 58.510 59.153 -0.643 1
1 890 . 9 1 1 A 73 73 GLN CB C 73 28.430 28.412 0.018 1
1 892 . 9 1 1 A 73 73 GLN N N 73 117.000 117.938 -0.938 1
1 894 . 9 1 1 A 74 74 GLN H H 74 7.712 7.529 0.183 1
1 895 . 9 1 1 A 74 74 GLN HA H 74 4.080 3.912 0.168 1
1 902 . 9 1 1 A 74 74 GLN C C 74 177.800 177.865 -0.065 1
1 903 . 9 1 1 A 74 74 GLN CA C 74 57.270 58.477 -1.207 1
1 904 . 9 1 1 A 74 74 GLN CB C 74 28.700 27.807 0.893 1
1 906 . 9 1 1 A 74 74 GLN N N 74 118.200 118.646 -0.446 1
1 908 . 9 1 1 A 75 75 LEU H H 75 7.956 7.504 0.452 1
1 909 . 9 1 1 A 75 75 LEU HA H 75 4.212 4.122 0.090 1
1 919 . 9 1 1 A 75 75 LEU CA C 75 56.660 54.824 1.836 1
1 920 . 9 1 1 A 75 75 LEU CB C 75 42.000 40.560 1.440 1
1 924 . 9 1 1 A 75 75 LEU N N 75 120.700 117.756 2.944 1
1 925 . 9 1 1 A 76 76 GLN H H 76 8.315 8.653 -0.338 1
1 926 . 9 1 1 A 76 76 GLN HA H 76 4.113 4.088 0.025 1
1 933 . 9 1 1 A 76 76 GLN C C 76 177.100 176.023 1.077 1
1 934 . 9 1 1 A 76 76 GLN CA C 76 57.400 58.612 -1.212 1
1 935 . 9 1 1 A 76 76 GLN CB C 76 28.640 29.585 -0.945 1
1 937 . 9 1 1 A 76 76 GLN N N 76 120.100 120.368 -0.268 1
1 939 . 9 1 1 A 77 77 GLY H H 77 8.021 7.610 0.411 1
1 940 . 9 1 1 A 77 77 GLY HA2 H 77 4.042 4.125 -0.083 1
1 941 . 9 1 1 A 77 77 GLY HA3 H 77 3.869 4.129 -0.260 1
1 942 . 9 1 1 A 77 77 GLY C C 77 174.600 174.097 0.503 1
1 943 . 9 1 1 A 77 77 GLY CA C 77 45.430 45.433 -0.003 1
1 944 . 9 1 1 A 77 77 GLY N N 77 107.700 104.575 3.125 1
1 945 . 9 1 1 A 78 78 GLY H H 78 7.819 8.845 -1.026 1
1 946 . 9 1 1 A 78 78 GLY HA2 H 78 4.208 4.064 0.144 1
1 947 . 9 1 1 A 78 78 GLY HA3 H 78 3.801 4.071 -0.270 1
1 948 . 9 1 1 A 78 78 GLY C C 78 173.900 174.783 -0.883 1
1 949 . 9 1 1 A 78 78 GLY CA C 78 45.140 45.476 -0.336 1
1 950 . 9 1 1 A 78 78 GLY N N 78 107.100 112.507 -5.407 1
1 951 . 9 1 1 A 79 79 ASP H H 79 7.912 8.049 -0.137 1
1 952 . 9 1 1 A 79 79 ASP HA H 79 4.722 4.941 -0.219 1
1 955 . 9 1 1 A 79 79 ASP C C 79 176.200 176.522 -0.322 1
1 956 . 9 1 1 A 79 79 ASP CA C 79 53.210 53.833 -0.623 1
1 957 . 9 1 1 A 79 79 ASP CB C 79 40.160 40.876 -0.716 1
1 958 . 9 1 1 A 79 79 ASP N N 79 119.800 119.631 0.169 1
1 959 . 9 1 1 A 80 80 ASN H H 80 8.450 8.613 -0.163 1
1 960 . 9 1 1 A 80 80 ASN HA H 80 4.593 4.530 0.063 1
1 965 . 9 1 1 A 80 80 ASN C C 80 177.300 177.196 0.104 1
1 966 . 9 1 1 A 80 80 ASN CA C 80 54.680 55.299 -0.619 1
1 967 . 9 1 1 A 80 80 ASN CB C 80 38.790 37.630 1.160 1
1 968 . 9 1 1 A 80 80 ASN N N 80 121.700 118.509 3.191 1
1 970 . 9 1 1 A 81 81 SER H H 81 8.444 8.193 0.251 1
1 971 . 9 1 1 A 81 81 SER HA H 81 4.263 4.176 0.087 1
1 974 . 9 1 1 A 81 81 SER C C 81 176.100 176.427 -0.327 1
1 975 . 9 1 1 A 81 81 SER CA C 81 61.470 62.215 -0.745 1
1 976 . 9 1 1 A 81 81 SER CB C 81 61.470 63.017 -1.547 1
1 977 . 9 1 1 A 81 81 SER N N 81 117.100 116.162 0.938 1
1 978 . 9 1 1 A 82 82 LEU H H 82 7.929 8.195 -0.266 1
1 979 . 9 1 1 A 82 82 LEU HA H 82 4.332 3.948 0.384 1
1 989 . 9 1 1 A 82 82 LEU C C 82 177.400 179.445 -2.045 1
1 990 . 9 1 1 A 82 82 LEU CA C 82 55.060 57.806 -2.746 1
1 991 . 9 1 1 A 82 82 LEU CB C 82 41.940 41.692 0.248 1
1 995 . 9 1 1 A 82 82 LEU N N 82 120.400 120.926 -0.526 1
1 996 . 9 1 1 A 83 83 HIS H H 83 8.014 7.965 0.049 1
1 997 . 9 1 1 A 83 83 HIS HA H 83 4.173 4.327 -0.154 1
1 1000 . 9 1 1 A 83 83 HIS C C 83 176.100 177.013 -0.913 1
1 1001 . 9 1 1 A 83 83 HIS CA C 83 59.940 59.012 0.928 1
1 1002 . 9 1 1 A 83 83 HIS CB C 83 28.050 29.781 -1.731 1
1 1003 . 9 1 1 A 83 83 HIS N N 83 119.400 118.042 1.358 1
1 1004 . 9 1 1 A 84 84 ASN H H 84 8.598 8.349 0.249 1
1 1005 . 9 1 1 A 84 84 ASN HA H 84 4.735 4.680 0.055 1
1 1010 . 9 1 1 A 84 84 ASN C C 84 177.400 177.524 -0.124 1
1 1011 . 9 1 1 A 84 84 ASN CA C 84 55.790 55.136 0.654 1
1 1012 . 9 1 1 A 84 84 ASN CB C 84 37.520 39.069 -1.549 1
1 1013 . 9 1 1 A 84 84 ASN N N 84 118.100 115.238 2.862 1
1 1015 . 9 1 1 A 85 85 VAL H H 85 7.933 7.755 0.178 1
1 1016 . 9 1 1 A 85 85 VAL HA H 85 3.849 3.766 0.083 1
1 1024 . 9 1 1 A 85 85 VAL C C 85 177.100 177.931 -0.831 1
1 1025 . 9 1 1 A 85 85 VAL CA C 85 65.490 65.375 0.115 1
1 1026 . 9 1 1 A 85 85 VAL CB C 85 31.760 31.847 -0.087 1
1 1029 . 9 1 1 A 85 85 VAL N N 85 120.500 120.353 0.147 1
1 1030 . 9 1 1 A 86 86 HIS H H 86 8.460 9.361 -0.901 1
1 1031 . 9 1 1 A 86 86 HIS HA H 86 4.054 3.990 0.064 1
1 1035 . 9 1 1 A 86 86 HIS C C 86 176.300 177.427 -1.127 1
1 1036 . 9 1 1 A 86 86 HIS CA C 86 59.860 60.285 -0.425 1
1 1037 . 9 1 1 A 86 86 HIS CB C 86 29.670 29.794 -0.124 1
1 1038 . 9 1 1 A 86 86 HIS N N 86 119.300 119.169 0.131 1
1 1039 . 9 1 1 A 87 87 GLU H H 87 7.897 8.454 -0.557 1
1 1040 . 9 1 1 A 87 87 GLU HA H 87 3.838 3.569 0.269 1
1 1045 . 9 1 1 A 87 87 GLU C C 87 178.300 178.892 -0.592 1
1 1046 . 9 1 1 A 87 87 GLU CA C 87 58.690 59.245 -0.555 1
1 1047 . 9 1 1 A 87 87 GLU CB C 87 28.460 29.521 -1.061 1
1 1049 . 9 1 1 A 87 87 GLU N N 87 117.100 118.820 -1.720 1
1 1050 . 9 1 1 A 88 88 ASN H H 88 8.103 8.515 -0.412 1
1 1051 . 9 1 1 A 88 88 ASN HA H 88 4.503 4.470 0.033 1
1 1056 . 9 1 1 A 88 88 ASN C C 88 177.700 177.943 -0.243 1
1 1057 . 9 1 1 A 88 88 ASN CA C 88 55.990 56.406 -0.416 1
1 1058 . 9 1 1 A 88 88 ASN CB C 88 39.010 38.607 0.403 1
1 1059 . 9 1 1 A 88 88 ASN N N 88 118.400 117.430 0.970 1
1 1061 . 9 1 1 A 89 89 ILE H H 89 8.501 7.622 0.879 1
1 1062 . 9 1 1 A 89 89 ILE HA H 89 3.670 3.674 -0.004 1
1 1072 . 9 1 1 A 89 89 ILE C C 89 177.000 178.235 -1.235 1
1 1073 . 9 1 1 A 89 89 ILE CA C 89 65.390 65.351 0.039 1
1 1074 . 9 1 1 A 89 89 ILE CB C 89 37.440 37.620 -0.180 1
1 1078 . 9 1 1 A 89 89 ILE N N 89 118.700 120.125 -1.425 1
1 1079 . 9 1 1 A 90 90 LYS H H 90 8.017 7.548 0.469 1
1 1080 . 9 1 1 A 90 90 LYS HA H 90 3.775 4.033 -0.258 1
1 1089 . 9 1 1 A 90 90 LYS C C 90 178.800 179.043 -0.243 1
1 1090 . 9 1 1 A 90 90 LYS CA C 90 60.450 59.798 0.652 1
1 1091 . 9 1 1 A 90 90 LYS CB C 90 32.110 32.377 -0.267 1
1 1095 . 9 1 1 A 90 90 LYS N N 90 120.900 120.150 0.750 1
1 1096 . 9 1 1 A 91 91 GLU H H 91 7.732 7.877 -0.145 1
1 1097 . 9 1 1 A 91 91 GLU HA H 91 4.083 4.118 -0.035 1
1 1102 . 9 1 1 A 91 91 GLU C C 91 179.100 179.533 -0.433 1
1 1103 . 9 1 1 A 91 91 GLU CA C 91 59.120 59.182 -0.062 1
1 1104 . 9 1 1 A 91 91 GLU CB C 91 28.810 29.642 -0.832 1
1 1106 . 9 1 1 A 91 91 GLU N N 91 119.300 118.040 1.260 1
1 1107 . 9 1 1 A 92 92 ILE H H 92 8.110 9.093 -0.983 1
1 1108 . 9 1 1 A 92 92 ILE HA H 92 3.685 3.939 -0.254 1
1 1118 . 9 1 1 A 92 92 ILE C C 92 178.000 178.840 -0.840 1
1 1119 . 9 1 1 A 92 92 ILE CA C 92 65.900 64.478 1.422 1
1 1120 . 9 1 1 A 92 92 ILE CB C 92 38.400 37.676 0.724 1
1 1124 . 9 1 1 A 92 92 ILE N N 92 121.100 120.359 0.741 1
1 1125 . 9 1 1 A 93 93 PHE H H 93 8.651 8.040 0.611 1
1 1126 . 9 1 1 A 93 93 PHE HA H 93 3.873 3.274 0.599 1
1 1133 . 9 1 1 A 93 93 PHE C C 93 177.100 177.200 -0.100 1
1 1134 . 9 1 1 A 93 93 PHE CA C 93 61.020 60.862 0.158 1
1 1135 . 9 1 1 A 93 93 PHE CB C 93 38.560 38.717 -0.157 1
1 1138 . 9 1 1 A 93 93 PHE N N 93 119.400 123.225 -3.825 1
1 1139 . 9 1 1 A 94 94 HIS H H 94 8.126 7.713 0.413 1
1 1140 . 9 1 1 A 94 94 HIS HA H 94 4.368 4.479 -0.111 1
1 1145 . 9 1 1 A 94 94 HIS C C 94 177.100 176.410 0.690 1
1 1146 . 9 1 1 A 94 94 HIS CA C 94 58.310 57.775 0.535 1
1 1147 . 9 1 1 A 94 94 HIS CB C 94 27.910 28.663 -0.753 1
1 1148 . 9 1 1 A 94 94 HIS N N 94 116.400 115.011 1.389 1
1 1149 . 9 1 1 A 95 95 HIS H H 95 8.058 7.446 0.612 1
1 1150 . 9 1 1 A 95 95 HIS HA H 95 4.465 4.348 0.117 1
1 1154 . 9 1 1 A 95 95 HIS C C 95 177.300 176.745 0.555 1
1 1155 . 9 1 1 A 95 95 HIS CA C 95 57.900 59.184 -1.284 1
1 1156 . 9 1 1 A 95 95 HIS CB C 95 28.490 30.843 -2.353 1
1 1157 . 9 1 1 A 95 95 HIS N N 95 117.000 116.719 0.281 1
1 1158 . 9 1 1 A 96 96 LEU H H 96 8.525 7.703 0.822 1
1 1159 . 9 1 1 A 96 96 LEU HA H 96 3.865 4.055 -0.190 1
1 1169 . 9 1 1 A 96 96 LEU C C 96 178.300 178.676 -0.376 1
1 1170 . 9 1 1 A 96 96 LEU CA C 96 58.250 56.819 1.431 1
1 1171 . 9 1 1 A 96 96 LEU CB C 96 41.720 42.629 -0.909 1
1 1175 . 9 1 1 A 96 96 LEU N N 96 121.300 120.668 0.632 1
1 1176 . 9 1 1 A 97 97 GLU H H 97 8.076 7.913 0.163 1
1 1177 . 9 1 1 A 97 97 GLU HA H 97 3.719 4.101 -0.382 1
1 1182 . 9 1 1 A 97 97 GLU C C 97 178.300 178.740 -0.440 1
1 1183 . 9 1 1 A 97 97 GLU CA C 97 59.300 58.767 0.533 1
1 1184 . 9 1 1 A 97 97 GLU CB C 97 28.960 29.779 -0.819 1
1 1186 . 9 1 1 A 97 97 GLU N N 97 117.100 118.350 -1.250 1
1 1187 . 9 1 1 A 98 98 GLU H H 98 7.329 7.722 -0.393 1
1 1188 . 9 1 1 A 98 98 GLU HA H 98 4.024 4.150 -0.126 1
1 1193 . 9 1 1 A 98 98 GLU C C 98 177.900 179.309 -1.409 1
1 1194 . 9 1 1 A 98 98 GLU CA C 98 58.190 58.604 -0.414 1
1 1195 . 9 1 1 A 98 98 GLU CB C 98 29.120 29.636 -0.516 1
1 1197 . 9 1 1 A 98 98 GLU N N 98 116.000 119.968 -3.968 1
1 1198 . 9 1 1 A 99 99 LEU H H 99 7.535 8.045 -0.510 1
1 1199 . 9 1 1 A 99 99 LEU HA H 99 4.183 4.083 0.100 1
1 1209 . 9 1 1 A 99 99 LEU C C 99 178.100 177.528 0.572 1
1 1210 . 9 1 1 A 99 99 LEU CA C 99 56.440 56.909 -0.469 1
1 1211 . 9 1 1 A 99 99 LEU CB C 99 43.010 41.425 1.585 1
1 1215 . 9 1 1 A 99 99 LEU N N 99 118.200 119.396 -1.196 1
1 1216 . 9 1 1 A 100 100 VAL H H 100 7.561 7.421 0.140 1
1 1217 . 9 1 1 A 100 100 VAL HA H 100 4.033 4.483 -0.450 1
1 1225 . 9 1 1 A 100 100 VAL C C 100 175.400 177.712 -2.312 1
1 1226 . 9 1 1 A 100 100 VAL CA C 100 62.430 63.306 -0.876 1
1 1227 . 9 1 1 A 100 100 VAL CB C 100 32.050 33.116 -1.066 1
1 1230 . 9 1 1 A 100 100 VAL N N 100 114.800 111.912 2.888 1
1 1231 . 9 1 1 A 101 101 HIS H H 101 7.827 8.362 -0.535 1
1 1232 . 9 1 1 A 101 101 HIS HA H 101 4.630 4.172 0.458 1
1 1237 . 9 1 1 A 101 101 HIS C C 101 173.500 174.770 -1.270 1
1 1238 . 9 1 1 A 101 101 HIS CA C 101 55.410 59.705 -4.295 1
1 1239 . 9 1 1 A 101 101 HIS CB C 101 28.870 30.308 -1.438 1
1 1240 . 9 1 1 A 101 101 HIS N N 101 120.300 122.254 -1.954 1
1 10 . 10 1 1 A 2 2 TYR H H 2 8.688 7.522 1.166 1
1 11 . 10 1 1 A 2 2 TYR HA H 2 4.737 4.327 0.410 1
1 16 . 10 1 1 A 2 2 TYR C C 2 175.900 176.270 -0.370 1
1 17 . 10 1 1 A 2 2 TYR CA C 2 57.920 60.360 -2.440 1
1 18 . 10 1 1 A 2 2 TYR CB C 2 38.340 38.844 -0.504 1
1 19 . 10 1 1 A 2 2 TYR N N 2 122.100 125.334 -3.234 1
1 20 . 10 1 1 A 3 3 GLY H H 3 8.434 8.352 0.082 1
1 21 . 10 1 1 A 3 3 GLY HA2 H 3 3.909 4.060 -0.151 1
1 22 . 10 1 1 A 3 3 GLY HA3 H 3 3.841 4.084 -0.243 1
1 23 . 10 1 1 A 3 3 GLY C C 3 174.300 176.047 -1.747 1
1 24 . 10 1 1 A 3 3 GLY CA C 3 46.050 45.520 0.530 1
1 25 . 10 1 1 A 3 3 GLY N N 3 111.100 108.689 2.411 1
1 26 . 10 1 1 A 4 4 LYS H H 4 8.060 8.330 -0.270 1
1 27 . 10 1 1 A 4 4 LYS HA H 4 4.297 4.119 0.178 1
1 36 . 10 1 1 A 4 4 LYS C C 4 178.000 179.312 -1.312 1
1 37 . 10 1 1 A 4 4 LYS CA C 4 56.930 59.251 -2.321 1
1 38 . 10 1 1 A 4 4 LYS CB C 4 32.680 32.094 0.586 1
1 42 . 10 1 1 A 4 4 LYS N N 4 119.500 121.135 -1.635 1
1 43 . 10 1 1 A 5 5 LEU H H 5 8.243 8.035 0.208 1
1 44 . 10 1 1 A 5 5 LEU HA H 5 3.947 3.855 0.092 1
1 54 . 10 1 1 A 5 5 LEU C C 5 177.900 178.734 -0.834 1
1 55 . 10 1 1 A 5 5 LEU CA C 5 57.930 57.637 0.293 1
1 56 . 10 1 1 A 5 5 LEU CB C 5 41.620 41.847 -0.227 1
1 60 . 10 1 1 A 5 5 LEU N N 5 120.800 119.999 0.801 1
1 61 . 10 1 1 A 6 6 ASN H H 6 8.256 8.324 -0.068 1
1 62 . 10 1 1 A 6 6 ASN HA H 6 4.252 4.335 -0.083 1
1 67 . 10 1 1 A 6 6 ASN C C 6 177.300 177.111 0.189 1
1 68 . 10 1 1 A 6 6 ASN CA C 6 56.900 56.306 0.594 1
1 69 . 10 1 1 A 6 6 ASN CB C 6 38.200 38.219 -0.019 1
1 70 . 10 1 1 A 6 6 ASN N N 6 116.200 116.929 -0.729 1
1 72 . 10 1 1 A 7 7 ASP H H 7 7.699 8.325 -0.626 1
1 73 . 10 1 1 A 7 7 ASP HA H 7 4.320 4.399 -0.079 1
1 76 . 10 1 1 A 7 7 ASP C C 7 178.000 178.618 -0.618 1
1 77 . 10 1 1 A 7 7 ASP CA C 7 56.980 57.343 -0.363 1
1 78 . 10 1 1 A 7 7 ASP CB C 7 39.870 40.850 -0.980 1
1 79 . 10 1 1 A 7 7 ASP N N 7 119.100 119.721 -0.621 1
1 80 . 10 1 1 A 8 8 LEU H H 8 7.580 8.651 -1.071 1
1 81 . 10 1 1 A 8 8 LEU HA H 8 4.091 4.160 -0.069 1
1 91 . 10 1 1 A 8 8 LEU C C 8 178.800 178.765 0.035 1
1 92 . 10 1 1 A 8 8 LEU CA C 8 57.790 58.034 -0.244 1
1 93 . 10 1 1 A 8 8 LEU CB C 8 41.880 41.654 0.226 1
1 97 . 10 1 1 A 8 8 LEU N N 8 120.400 120.065 0.335 1
1 98 . 10 1 1 A 9 9 LEU H H 9 8.125 8.941 -0.816 1
1 99 . 10 1 1 A 9 9 LEU HA H 9 3.891 3.973 -0.082 1
1 109 . 10 1 1 A 9 9 LEU C C 9 178.900 178.461 0.439 1
1 110 . 10 1 1 A 9 9 LEU CA C 9 58.350 58.833 -0.483 1
1 111 . 10 1 1 A 9 9 LEU CB C 9 41.510 42.038 -0.528 1
1 115 . 10 1 1 A 9 9 LEU N N 9 118.900 120.191 -1.291 1
1 116 . 10 1 1 A 10 10 GLU H H 10 8.011 8.759 -0.748 1
1 117 . 10 1 1 A 10 10 GLU HA H 10 4.072 3.940 0.132 1
1 122 . 10 1 1 A 10 10 GLU C C 10 179.000 178.413 0.587 1
1 123 . 10 1 1 A 10 10 GLU CA C 10 59.090 59.995 -0.905 1
1 124 . 10 1 1 A 10 10 GLU CB C 10 27.910 28.966 -1.056 1
1 126 . 10 1 1 A 10 10 GLU N N 10 119.300 118.708 0.592 1
1 127 . 10 1 1 A 11 11 ASP H H 11 8.128 8.136 -0.008 1
1 128 . 10 1 1 A 11 11 ASP HA H 11 4.383 4.426 -0.043 1
1 131 . 10 1 1 A 11 11 ASP C C 11 178.500 178.290 0.210 1
1 132 . 10 1 1 A 11 11 ASP CA C 11 56.580 57.203 -0.623 1
1 133 . 10 1 1 A 11 11 ASP CB C 11 38.600 42.020 -3.420 1
1 134 . 10 1 1 A 11 11 ASP N N 11 119.600 119.891 -0.291 1
1 135 . 10 1 1 A 12 12 LEU H H 12 8.394 7.946 0.448 1
1 136 . 10 1 1 A 12 12 LEU HA H 12 3.923 4.275 -0.352 1
1 146 . 10 1 1 A 12 12 LEU C C 12 178.200 178.536 -0.336 1
1 147 . 10 1 1 A 12 12 LEU CA C 12 57.880 57.782 0.098 1
1 148 . 10 1 1 A 12 12 LEU CB C 12 41.850 41.922 -0.072 1
1 152 . 10 1 1 A 12 12 LEU N N 12 120.500 120.178 0.322 1
1 153 . 10 1 1 A 13 13 GLN H H 13 8.371 8.848 -0.477 1
1 154 . 10 1 1 A 13 13 GLN HA H 13 3.879 4.073 -0.194 1
1 161 . 10 1 1 A 13 13 GLN C C 13 178.600 178.009 0.591 1
1 162 . 10 1 1 A 13 13 GLN CA C 13 59.570 58.166 1.404 1
1 163 . 10 1 1 A 13 13 GLN CB C 13 28.440 27.753 0.687 1
1 165 . 10 1 1 A 13 13 GLN N N 13 118.400 116.886 1.514 1
1 167 . 10 1 1 A 14 14 GLU H H 14 7.913 8.019 -0.106 1
1 168 . 10 1 1 A 14 14 GLU HA H 14 4.021 4.127 -0.106 1
1 173 . 10 1 1 A 14 14 GLU C C 14 179.000 178.929 0.071 1
1 174 . 10 1 1 A 14 14 GLU CA C 14 59.030 59.050 -0.020 1
1 175 . 10 1 1 A 14 14 GLU CB C 14 28.720 29.738 -1.018 1
1 177 . 10 1 1 A 14 14 GLU N N 14 119.100 119.778 -0.678 1
1 178 . 10 1 1 A 15 15 VAL H H 15 7.991 7.672 0.319 1
1 179 . 10 1 1 A 15 15 VAL HA H 15 3.696 3.889 -0.193 1
1 187 . 10 1 1 A 15 15 VAL C C 15 178.300 178.045 0.255 1
1 188 . 10 1 1 A 15 15 VAL CA C 15 66.640 65.482 1.158 1
1 189 . 10 1 1 A 15 15 VAL CB C 15 31.470 31.542 -0.072 1
1 192 . 10 1 1 A 15 15 VAL N N 15 120.300 117.671 2.629 1
1 193 . 10 1 1 A 16 16 LEU H H 16 8.172 7.997 0.175 1
1 194 . 10 1 1 A 16 16 LEU HA H 16 3.876 4.218 -0.342 1
1 204 . 10 1 1 A 16 16 LEU C C 16 178.400 178.730 -0.330 1
1 205 . 10 1 1 A 16 16 LEU CA C 16 58.050 58.251 -0.201 1
1 206 . 10 1 1 A 16 16 LEU CB C 16 41.420 41.499 -0.079 1
1 210 . 10 1 1 A 16 16 LEU N N 16 119.700 125.015 -5.315 1
1 211 . 10 1 1 A 17 17 LYS H H 17 7.755 8.938 -1.183 1
1 212 . 10 1 1 A 17 17 LYS HA H 17 3.951 4.075 -0.124 1
1 221 . 10 1 1 A 17 17 LYS C C 17 178.800 179.506 -0.706 1
1 222 . 10 1 1 A 17 17 LYS CA C 17 59.470 59.036 0.434 1
1 223 . 10 1 1 A 17 17 LYS CB C 17 32.350 32.426 -0.076 1
1 227 . 10 1 1 A 17 17 LYS N N 17 117.800 120.046 -2.246 1
1 228 . 10 1 1 A 18 18 HIS H H 18 7.847 8.509 -0.662 1
1 229 . 10 1 1 A 18 18 HIS HA H 18 4.549 4.664 -0.115 1
1 233 . 10 1 1 A 18 18 HIS C C 18 177.200 176.505 0.695 1
1 234 . 10 1 1 A 18 18 HIS CA C 18 57.870 58.551 -0.681 1
1 235 . 10 1 1 A 18 18 HIS CB C 18 28.730 29.148 -0.418 1
1 236 . 10 1 1 A 18 18 HIS N N 18 116.200 117.435 -1.235 1
1 237 . 10 1 1 A 19 19 VAL H H 19 8.415 7.956 0.459 1
1 238 . 10 1 1 A 19 19 VAL HA H 19 3.746 4.193 -0.447 1
1 246 . 10 1 1 A 19 19 VAL CA C 19 65.850 64.286 1.564 1
1 247 . 10 1 1 A 19 19 VAL CB C 19 31.600 32.453 -0.853 1
1 250 . 10 1 1 A 20 20 ASN H H 20 8.041 8.467 -0.426 1
1 251 . 10 1 1 A 20 20 ASN HA H 20 4.545 4.455 0.090 1
1 256 . 10 1 1 A 20 20 ASN C C 20 176.900 177.911 -1.011 1
1 257 . 10 1 1 A 20 20 ASN CA C 20 55.070 56.773 -1.703 1
1 258 . 10 1 1 A 20 20 ASN CB C 20 38.270 39.559 -1.289 1
1 259 . 10 1 1 A 20 20 ASN N N 20 117.900 119.555 -1.655 1
1 261 . 10 1 1 A 21 21 GLN H H 21 7.887 7.955 -0.068 1
1 262 . 10 1 1 A 21 21 GLN HA H 21 4.096 4.206 -0.110 1
1 269 . 10 1 1 A 21 21 GLN C C 21 176.900 177.723 -0.823 1
1 270 . 10 1 1 A 21 21 GLN CA C 21 57.510 57.580 -0.070 1
1 271 . 10 1 1 A 21 21 GLN CB C 21 29.100 28.462 0.638 1
1 273 . 10 1 1 A 21 21 GLN N N 21 117.900 117.023 0.877 1
1 275 . 10 1 1 A 22 22 HIS H H 22 7.887 7.907 -0.020 1
1 276 . 10 1 1 A 22 22 HIS HA H 22 4.679 4.668 0.011 1
1 280 . 10 1 1 A 22 22 HIS C C 22 174.300 175.406 -1.106 1
1 281 . 10 1 1 A 22 22 HIS CA C 22 55.770 55.926 -0.156 1
1 282 . 10 1 1 A 22 22 HIS CB C 22 28.630 29.406 -0.776 1
1 283 . 10 1 1 A 22 22 HIS N N 22 116.100 114.180 1.920 1
1 284 . 10 1 1 A 23 23 TRP H H 23 7.929 7.750 0.179 1
1 285 . 10 1 1 A 23 23 TRP HA H 23 4.542 4.627 -0.085 1
1 292 . 10 1 1 A 23 23 TRP C C 23 176.600 175.435 1.165 1
1 293 . 10 1 1 A 23 23 TRP CA C 23 58.020 58.400 -0.380 1
1 294 . 10 1 1 A 23 23 TRP CB C 23 29.700 30.525 -0.825 1
1 295 . 10 1 1 A 23 23 TRP N N 23 122.000 123.613 -1.613 1
1 297 . 10 1 1 A 24 24 GLN H H 24 8.258 8.379 -0.121 1
1 298 . 10 1 1 A 24 24 GLN HA H 24 4.329 4.642 -0.313 1
1 305 . 10 1 1 A 24 24 GLN C C 24 176.200 174.767 1.433 1
1 306 . 10 1 1 A 24 24 GLN CA C 24 55.960 54.774 1.186 1
1 307 . 10 1 1 A 24 24 GLN CB C 24 29.440 31.880 -2.440 1
1 309 . 10 1 1 A 24 24 GLN N N 24 123.800 126.113 -2.313 1
1 311 . 10 1 1 A 25 25 GLY H H 25 7.470 8.895 -1.425 1
1 312 . 10 1 1 A 25 25 GLY HA2 H 25 3.939 3.797 0.142 1
1 313 . 10 1 1 A 25 25 GLY HA3 H 25 3.800 3.816 -0.016 1
1 314 . 10 1 1 A 25 25 GLY C C 25 174.800 175.037 -0.237 1
1 315 . 10 1 1 A 25 25 GLY CA C 25 45.470 47.091 -1.621 1
1 316 . 10 1 1 A 25 25 GLY N N 25 108.100 109.481 -1.381 1
1 317 . 10 1 1 A 26 26 GLY H H 26 8.332 8.617 -0.285 1
1 318 . 10 1 1 A 26 26 GLY HA2 H 26 4.105 4.161 -0.056 1
1 319 . 10 1 1 A 26 26 GLY HA3 H 26 3.974 4.218 -0.244 1
1 320 . 10 1 1 A 26 26 GLY C C 26 174.900 175.228 -0.328 1
1 321 . 10 1 1 A 26 26 GLY CA C 26 45.410 45.302 0.108 1
1 322 . 10 1 1 A 26 26 GLY N N 26 108.700 106.855 1.845 1
1 323 . 10 1 1 A 27 27 GLN H H 27 8.474 8.432 0.042 1
1 324 . 10 1 1 A 27 27 GLN HA H 27 4.106 4.182 -0.076 1
1 331 . 10 1 1 A 27 27 GLN C C 27 177.100 177.179 -0.079 1
1 332 . 10 1 1 A 27 27 GLN CA C 27 57.540 57.195 0.345 1
1 333 . 10 1 1 A 27 27 GLN CB C 27 29.050 28.987 0.063 1
1 335 . 10 1 1 A 27 27 GLN N N 27 121.100 122.617 -1.517 1
1 337 . 10 1 1 A 28 28 LYS H H 28 8.448 8.220 0.228 1
1 338 . 10 1 1 A 28 28 LYS HA H 28 4.068 3.968 0.100 1
1 347 . 10 1 1 A 28 28 LYS C C 28 177.900 178.337 -0.437 1
1 348 . 10 1 1 A 28 28 LYS CA C 28 58.410 59.098 -0.688 1
1 349 . 10 1 1 A 28 28 LYS CB C 28 32.210 31.919 0.291 1
1 353 . 10 1 1 A 28 28 LYS N N 28 120.500 117.751 2.749 1
1 354 . 10 1 1 A 29 29 ASN H H 29 8.273 7.940 0.333 1
1 355 . 10 1 1 A 29 29 ASN HA H 29 4.584 4.358 0.226 1
1 360 . 10 1 1 A 29 29 ASN C C 29 176.200 177.472 -1.272 1
1 361 . 10 1 1 A 29 29 ASN CA C 29 54.400 56.038 -1.638 1
1 362 . 10 1 1 A 29 29 ASN CB C 29 38.280 37.790 0.490 1
1 363 . 10 1 1 A 29 29 ASN N N 29 117.500 118.139 -0.639 1
1 365 . 10 1 1 A 30 30 MET H H 30 7.870 7.337 0.533 1
1 366 . 10 1 1 A 30 30 MET HA H 30 4.085 3.281 0.804 1
1 371 . 10 1 1 A 30 30 MET C C 30 177.000 177.742 -0.742 1
1 372 . 10 1 1 A 30 30 MET CA C 30 56.880 57.820 -0.940 1
1 373 . 10 1 1 A 30 30 MET CB C 30 32.340 31.923 0.417 1
1 375 . 10 1 1 A 30 30 MET N N 30 121.100 119.009 2.091 1
1 376 . 10 1 1 A 31 31 ASN H H 31 8.186 7.392 0.794 1
1 377 . 10 1 1 A 31 31 ASN HA H 31 4.311 4.391 -0.080 1
1 382 . 10 1 1 A 31 31 ASN C C 31 176.700 177.594 -0.894 1
1 383 . 10 1 1 A 31 31 ASN CA C 31 55.320 55.295 0.025 1
1 384 . 10 1 1 A 31 31 ASN CB C 31 38.410 38.498 -0.088 1
1 385 . 10 1 1 A 31 31 ASN N N 31 117.900 116.270 1.630 1
1 387 . 10 1 1 A 32 32 LYS H H 32 7.792 7.186 0.606 1
1 388 . 10 1 1 A 32 32 LYS HA H 32 3.992 4.072 -0.080 1
1 397 . 10 1 1 A 32 32 LYS C C 32 177.900 179.036 -1.136 1
1 398 . 10 1 1 A 32 32 LYS CA C 32 59.050 59.175 -0.125 1
1 399 . 10 1 1 A 32 32 LYS CB C 32 32.460 32.538 -0.078 1
1 403 . 10 1 1 A 32 32 LYS N N 32 120.400 118.616 1.784 1
1 404 . 10 1 1 A 33 33 VAL H H 33 7.689 8.362 -0.673 1
1 405 . 10 1 1 A 33 33 VAL HA H 33 3.791 3.710 0.081 1
1 413 . 10 1 1 A 33 33 VAL C C 33 177.100 177.651 -0.551 1
1 414 . 10 1 1 A 33 33 VAL CA C 33 65.360 64.910 0.450 1
1 415 . 10 1 1 A 33 33 VAL CB C 33 31.920 31.393 0.527 1
1 418 . 10 1 1 A 33 33 VAL N N 33 120.200 115.076 5.124 1
1 419 . 10 1 1 A 34 34 ASP H H 34 8.408 8.073 0.335 1
1 420 . 10 1 1 A 34 34 ASP HA H 34 4.303 4.250 0.053 1
1 423 . 10 1 1 A 34 34 ASP C C 34 178.200 178.430 -0.230 1
1 424 . 10 1 1 A 34 34 ASP CA C 34 55.880 57.135 -1.255 1
1 425 . 10 1 1 A 34 34 ASP CB C 34 38.710 41.622 -2.912 1
1 426 . 10 1 1 A 34 34 ASP N N 34 120.100 121.212 -1.112 1
1 427 . 10 1 1 A 35 35 HIS H H 35 8.204 7.429 0.775 1
1 428 . 10 1 1 A 35 35 HIS HA H 35 4.343 4.119 0.224 1
1 431 . 10 1 1 A 35 35 HIS C C 35 176.800 177.362 -0.562 1
1 432 . 10 1 1 A 35 35 HIS CA C 35 58.310 60.377 -2.067 1
1 433 . 10 1 1 A 35 35 HIS CB C 35 28.070 29.971 -1.901 1
1 434 . 10 1 1 A 35 35 HIS N N 35 118.200 117.875 0.325 1
1 435 . 10 1 1 A 36 36 HIS H H 36 8.067 8.398 -0.331 1
1 436 . 10 1 1 A 36 36 HIS HA H 36 4.602 4.097 0.505 1
1 440 . 10 1 1 A 36 36 HIS C C 36 177.100 177.573 -0.473 1
1 441 . 10 1 1 A 36 36 HIS CA C 36 58.520 59.580 -1.060 1
1 442 . 10 1 1 A 36 36 HIS CB C 36 28.720 30.309 -1.589 1
1 443 . 10 1 1 A 36 36 HIS N N 36 117.100 117.250 -0.150 1
1 444 . 10 1 1 A 37 37 LEU H H 37 8.473 8.411 0.062 1
1 445 . 10 1 1 A 37 37 LEU HA H 37 3.894 3.622 0.272 1
1 455 . 10 1 1 A 37 37 LEU C C 37 178.200 178.717 -0.517 1
1 456 . 10 1 1 A 37 37 LEU CA C 37 58.520 58.089 0.431 1
1 457 . 10 1 1 A 37 37 LEU CB C 37 41.810 41.544 0.266 1
1 461 . 10 1 1 A 37 37 LEU N N 37 119.600 119.592 0.008 1
1 462 . 10 1 1 A 38 38 GLN H H 38 8.337 8.365 -0.028 1
1 463 . 10 1 1 A 38 38 GLN HA H 38 3.882 3.992 -0.110 1
1 470 . 10 1 1 A 38 38 GLN C C 38 178.500 177.968 0.532 1
1 471 . 10 1 1 A 38 38 GLN CA C 38 59.200 59.245 -0.045 1
1 472 . 10 1 1 A 38 38 GLN CB C 38 27.850 28.245 -0.395 1
1 474 . 10 1 1 A 38 38 GLN N N 38 118.000 116.954 1.046 1
1 476 . 10 1 1 A 39 39 ASN H H 39 7.923 7.604 0.319 1
1 477 . 10 1 1 A 39 39 ASN HA H 39 4.390 4.474 -0.084 1
1 482 . 10 1 1 A 39 39 ASN C C 39 177.500 177.861 -0.361 1
1 483 . 10 1 1 A 39 39 ASN CA C 39 55.780 56.094 -0.314 1
1 484 . 10 1 1 A 39 39 ASN CB C 39 37.450 38.410 -0.960 1
1 485 . 10 1 1 A 39 39 ASN N N 39 118.700 117.917 0.783 1
1 487 . 10 1 1 A 40 40 VAL H H 40 7.907 8.204 -0.297 1
1 488 . 10 1 1 A 40 40 VAL HA H 40 3.629 3.477 0.152 1
1 496 . 10 1 1 A 40 40 VAL C C 40 177.500 177.805 -0.305 1
1 497 . 10 1 1 A 40 40 VAL CA C 40 67.080 66.403 0.677 1
1 498 . 10 1 1 A 40 40 VAL CB C 40 31.390 31.323 0.067 1
1 501 . 10 1 1 A 40 40 VAL N N 40 120.400 119.089 1.311 1
1 502 . 10 1 1 A 41 41 ILE H H 41 8.103 7.692 0.411 1
1 503 . 10 1 1 A 41 41 ILE HA H 41 3.401 3.677 -0.276 1
1 513 . 10 1 1 A 41 41 ILE C C 41 178.000 178.774 -0.774 1
1 514 . 10 1 1 A 41 41 ILE CA C 41 66.430 64.785 1.645 1
1 515 . 10 1 1 A 41 41 ILE CB C 41 38.050 38.023 0.027 1
1 519 . 10 1 1 A 41 41 ILE N N 41 120.600 119.371 1.229 1
1 520 . 10 1 1 A 42 42 GLU H H 42 8.150 8.202 -0.052 1
1 521 . 10 1 1 A 42 42 GLU HA H 42 4.062 4.000 0.062 1
1 526 . 10 1 1 A 42 42 GLU C C 42 178.500 178.831 -0.331 1
1 527 . 10 1 1 A 42 42 GLU CA C 42 59.120 59.370 -0.250 1
1 528 . 10 1 1 A 42 42 GLU CB C 42 28.160 29.460 -1.300 1
1 530 . 10 1 1 A 42 42 GLU N N 42 119.900 122.149 -2.249 1
1 531 . 10 1 1 A 43 43 ASP H H 43 8.453 9.118 -0.665 1
1 532 . 10 1 1 A 43 43 ASP HA H 43 4.445 4.409 0.036 1
1 535 . 10 1 1 A 43 43 ASP C C 43 178.400 178.616 -0.216 1
1 536 . 10 1 1 A 43 43 ASP CA C 43 56.490 58.086 -1.596 1
1 537 . 10 1 1 A 43 43 ASP CB C 43 37.820 41.773 -3.953 1
1 538 . 10 1 1 A 43 43 ASP N N 43 119.700 120.065 -0.365 1
1 539 . 10 1 1 A 44 44 ILE H H 44 8.544 7.912 0.632 1
1 540 . 10 1 1 A 44 44 ILE HA H 44 3.590 3.813 -0.223 1
1 550 . 10 1 1 A 44 44 ILE C C 44 177.800 178.061 -0.261 1
1 551 . 10 1 1 A 44 44 ILE CA C 44 66.320 65.533 0.787 1
1 552 . 10 1 1 A 44 44 ILE CB C 44 37.690 38.201 -0.511 1
1 556 . 10 1 1 A 44 44 ILE N N 44 121.500 119.681 1.819 1
1 557 . 10 1 1 A 45 45 HIS H H 45 8.261 8.125 0.136 1
1 558 . 10 1 1 A 45 45 HIS HA H 45 4.255 4.113 0.142 1
1 562 . 10 1 1 A 45 45 HIS C C 45 177.200 176.577 0.623 1
1 563 . 10 1 1 A 45 45 HIS CA C 45 59.580 59.968 -0.388 1
1 564 . 10 1 1 A 45 45 HIS CB C 45 27.790 30.199 -2.409 1
1 565 . 10 1 1 A 45 45 HIS N N 45 118.800 119.669 -0.869 1
1 566 . 10 1 1 A 46 46 ASP H H 46 8.680 8.552 0.128 1
1 567 . 10 1 1 A 46 46 ASP HA H 46 4.338 4.555 -0.217 1
1 570 . 10 1 1 A 46 46 ASP C C 46 178.700 177.944 0.756 1
1 571 . 10 1 1 A 46 46 ASP CA C 46 57.010 55.316 1.694 1
1 572 . 10 1 1 A 46 46 ASP CB C 46 39.400 40.797 -1.397 1
1 573 . 10 1 1 A 46 46 ASP N N 46 119.200 119.244 -0.044 1
1 574 . 10 1 1 A 47 47 PHE H H 47 8.380 9.059 -0.679 1
1 575 . 10 1 1 A 47 47 PHE HA H 47 4.070 4.234 -0.164 1
1 580 . 10 1 1 A 47 47 PHE C C 47 178.600 177.691 0.909 1
1 581 . 10 1 1 A 47 47 PHE CA C 47 61.250 60.175 1.075 1
1 582 . 10 1 1 A 47 47 PHE CB C 47 39.570 39.895 -0.325 1
1 583 . 10 1 1 A 47 47 PHE N N 47 121.800 121.544 0.256 1
1 584 . 10 1 1 A 48 48 MET H H 48 8.366 8.174 0.192 1
1 585 . 10 1 1 A 48 48 MET HA H 48 3.998 4.607 -0.609 1
1 590 . 10 1 1 A 48 48 MET C C 48 177.400 177.606 -0.206 1
1 591 . 10 1 1 A 48 48 MET CA C 48 58.470 58.317 0.153 1
1 592 . 10 1 1 A 48 48 MET CB C 48 33.170 32.256 0.914 1
1 594 . 10 1 1 A 48 48 MET N N 48 117.700 117.765 -0.065 1
1 595 . 10 1 1 A 49 49 GLN H H 49 7.659 8.291 -0.632 1
1 596 . 10 1 1 A 49 49 GLN HA H 49 4.258 4.235 0.023 1
1 603 . 10 1 1 A 49 49 GLN C C 49 176.700 178.506 -1.806 1
1 604 . 10 1 1 A 49 49 GLN CA C 49 56.380 58.557 -2.177 1
1 605 . 10 1 1 A 49 49 GLN CB C 49 28.980 29.073 -0.093 1
1 607 . 10 1 1 A 49 49 GLN N N 49 116.700 118.367 -1.667 1
1 609 . 10 1 1 A 50 50 GLY H H 50 7.685 8.688 -1.003 1
1 610 . 10 1 1 A 50 50 GLY HA2 H 50 3.998 3.777 0.221 1
1 611 . 10 1 1 A 50 50 GLY HA3 H 50 3.998 3.825 0.173 1
1 612 . 10 1 1 A 50 50 GLY C C 50 174.900 174.997 -0.097 1
1 613 . 10 1 1 A 50 50 GLY CA C 50 45.460 46.353 -0.893 1
1 614 . 10 1 1 A 50 50 GLY N N 50 106.400 108.945 -2.545 1
1 615 . 10 1 1 A 51 51 GLY H H 51 8.031 8.806 -0.775 1
1 616 . 10 1 1 A 51 51 GLY HA2 H 51 3.817 3.727 0.090 1
1 617 . 10 1 1 A 51 51 GLY HA3 H 51 3.817 3.758 0.059 1
1 618 . 10 1 1 A 51 51 GLY C C 51 174.500 174.300 0.200 1
1 619 . 10 1 1 A 51 51 GLY CA C 51 45.190 45.855 -0.665 1
1 620 . 10 1 1 A 51 51 GLY N N 51 108.900 109.880 -0.980 1
1 621 . 10 1 1 A 52 52 GLY H H 52 8.126 8.204 -0.078 1
1 622 . 10 1 1 A 52 52 GLY HA2 H 52 3.362 3.826 -0.464 1
1 623 . 10 1 1 A 52 52 GLY HA3 H 52 3.362 4.020 -0.658 1
1 624 . 10 1 1 A 52 52 GLY C C 52 173.300 173.819 -0.519 1
1 625 . 10 1 1 A 52 52 GLY CA C 52 45.120 45.347 -0.227 1
1 626 . 10 1 1 A 52 52 GLY N N 52 108.100 108.690 -0.590 1
1 627 . 10 1 1 A 53 53 SER H H 53 7.594 7.979 -0.385 1
1 628 . 10 1 1 A 53 53 SER HA H 53 4.530 4.939 -0.409 1
1 631 . 10 1 1 A 53 53 SER C C 53 175.300 175.376 -0.076 1
1 632 . 10 1 1 A 53 53 SER CA C 53 57.770 57.340 0.430 1
1 633 . 10 1 1 A 53 53 SER CB C 53 64.750 63.294 1.456 1
1 634 . 10 1 1 A 53 53 SER N N 53 114.100 117.459 -3.359 1
1 635 . 10 1 1 A 54 54 GLY H H 54 9.003 8.473 0.530 1
1 636 . 10 1 1 A 54 54 GLY HA2 H 54 4.037 4.019 0.018 1
1 637 . 10 1 1 A 54 54 GLY HA3 H 54 3.911 4.154 -0.243 1
1 638 . 10 1 1 A 54 54 GLY C C 54 176.500 175.497 1.003 1
1 639 . 10 1 1 A 54 54 GLY CA C 54 47.040 47.159 -0.119 1
1 640 . 10 1 1 A 54 54 GLY N N 54 110.400 110.132 0.268 1
1 641 . 10 1 1 A 55 55 GLY H H 55 8.617 8.261 0.356 1
1 642 . 10 1 1 A 55 55 GLY HA2 H 55 3.946 3.840 0.106 1
1 643 . 10 1 1 A 55 55 GLY HA3 H 55 3.946 3.856 0.090 1
1 644 . 10 1 1 A 55 55 GLY C C 55 176.400 175.695 0.705 1
1 645 . 10 1 1 A 55 55 GLY CA C 55 46.630 47.090 -0.460 1
1 646 . 10 1 1 A 55 55 GLY N N 55 109.800 109.612 0.188 1
1 647 . 10 1 1 A 56 56 LYS H H 56 7.876 8.593 -0.717 1
1 648 . 10 1 1 A 56 56 LYS HA H 56 4.195 4.242 -0.047 1
1 657 . 10 1 1 A 56 56 LYS C C 56 178.600 178.886 -0.286 1
1 658 . 10 1 1 A 56 56 LYS CA C 56 57.960 58.524 -0.564 1
1 659 . 10 1 1 A 56 56 LYS CB C 56 32.110 31.693 0.417 1
1 663 . 10 1 1 A 56 56 LYS N N 56 121.800 121.958 -0.158 1
1 664 . 10 1 1 A 57 57 LEU H H 57 8.153 7.664 0.489 1
1 665 . 10 1 1 A 57 57 LEU HA H 57 3.992 4.273 -0.281 1
1 675 . 10 1 1 A 57 57 LEU C C 57 178.400 178.852 -0.452 1
1 676 . 10 1 1 A 57 57 LEU CA C 57 58.190 57.667 0.523 1
1 677 . 10 1 1 A 57 57 LEU CB C 57 41.360 42.041 -0.681 1
1 681 . 10 1 1 A 57 57 LEU N N 57 120.700 120.905 -0.205 1
1 682 . 10 1 1 A 58 58 GLN H H 58 8.019 8.034 -0.015 1
1 683 . 10 1 1 A 58 58 GLN HA H 58 3.942 4.189 -0.247 1
1 690 . 10 1 1 A 58 58 GLN C C 58 179.100 177.745 1.355 1
1 691 . 10 1 1 A 58 58 GLN CA C 58 59.360 58.205 1.155 1
1 692 . 10 1 1 A 58 58 GLN CB C 58 28.030 28.489 -0.459 1
1 694 . 10 1 1 A 58 58 GLN N N 58 117.400 117.759 -0.359 1
1 696 . 10 1 1 A 59 59 GLU H H 59 7.838 8.112 -0.274 1
1 697 . 10 1 1 A 59 59 GLU HA H 59 4.030 4.252 -0.222 1
1 702 . 10 1 1 A 59 59 GLU C C 59 178.600 178.841 -0.241 1
1 703 . 10 1 1 A 59 59 GLU CA C 59 59.250 58.820 0.430 1
1 704 . 10 1 1 A 59 59 GLU CB C 59 28.960 30.282 -1.322 1
1 706 . 10 1 1 A 59 59 GLU N N 59 119.900 118.691 1.209 1
1 707 . 10 1 1 A 60 60 MET H H 60 8.223 8.082 0.141 1
1 708 . 10 1 1 A 60 60 MET HA H 60 3.966 4.221 -0.255 1
1 713 . 10 1 1 A 60 60 MET C C 60 177.900 178.765 -0.865 1
1 714 . 10 1 1 A 60 60 MET CA C 60 59.350 58.045 1.305 1
1 715 . 10 1 1 A 60 60 MET CB C 60 33.210 32.338 0.872 1
1 717 . 10 1 1 A 60 60 MET N N 60 120.100 119.298 0.802 1
1 718 . 10 1 1 A 61 61 MET H H 61 8.134 8.657 -0.523 1
1 719 . 10 1 1 A 61 61 MET HA H 61 4.195 4.499 -0.304 1
1 724 . 10 1 1 A 61 61 MET C C 61 179.100 178.808 0.292 1
1 725 . 10 1 1 A 61 61 MET CA C 61 58.210 58.708 -0.498 1
1 726 . 10 1 1 A 61 61 MET CB C 61 31.340 32.563 -1.223 1
1 728 . 10 1 1 A 61 61 MET N N 61 117.000 118.989 -1.989 1
1 729 . 10 1 1 A 62 62 LYS H H 62 7.782 8.231 -0.449 1
1 730 . 10 1 1 A 62 62 LYS HA H 62 4.085 4.039 0.046 1
1 739 . 10 1 1 A 62 62 LYS C C 62 179.600 179.316 0.284 1
1 740 . 10 1 1 A 62 62 LYS CA C 62 59.610 60.052 -0.442 1
1 741 . 10 1 1 A 62 62 LYS CB C 62 32.180 32.114 0.066 1
1 745 . 10 1 1 A 62 62 LYS N N 62 120.600 120.482 0.118 1
1 746 . 10 1 1 A 63 63 GLU H H 63 8.041 8.037 0.004 1
1 747 . 10 1 1 A 63 63 GLU HA H 63 4.057 4.061 -0.004 1
1 752 . 10 1 1 A 63 63 GLU C C 63 178.900 178.800 0.100 1
1 753 . 10 1 1 A 63 63 GLU CA C 63 59.170 59.259 -0.089 1
1 754 . 10 1 1 A 63 63 GLU CB C 63 29.000 29.153 -0.153 1
1 756 . 10 1 1 A 63 63 GLU N N 63 120.200 120.062 0.138 1
1 757 . 10 1 1 A 64 64 PHE H H 64 8.604 9.052 -0.448 1
1 758 . 10 1 1 A 64 64 PHE HA H 64 4.155 3.896 0.259 1
1 763 . 10 1 1 A 64 64 PHE C C 64 177.800 177.744 0.056 1
1 764 . 10 1 1 A 64 64 PHE CA C 64 59.820 61.049 -1.229 1
1 765 . 10 1 1 A 64 64 PHE CB C 64 38.470 38.291 0.179 1
1 766 . 10 1 1 A 64 64 PHE N N 64 119.700 120.799 -1.099 1
1 767 . 10 1 1 A 65 65 GLN H H 65 8.177 8.374 -0.197 1
1 768 . 10 1 1 A 65 65 GLN HA H 65 3.637 4.180 -0.543 1
1 775 . 10 1 1 A 65 65 GLN C C 65 177.800 177.912 -0.112 1
1 776 . 10 1 1 A 65 65 GLN CA C 65 58.970 58.385 0.585 1
1 777 . 10 1 1 A 65 65 GLN CB C 65 28.280 28.642 -0.362 1
1 779 . 10 1 1 A 65 65 GLN N N 65 118.500 118.623 -0.123 1
1 781 . 10 1 1 A 66 66 GLN H H 66 7.622 7.743 -0.121 1
1 782 . 10 1 1 A 66 66 GLN HA H 66 4.040 4.286 -0.246 1
1 789 . 10 1 1 A 66 66 GLN C C 66 178.600 177.881 0.719 1
1 790 . 10 1 1 A 66 66 GLN CA C 66 59.150 58.187 0.963 1
1 791 . 10 1 1 A 66 66 GLN CB C 66 28.230 28.478 -0.248 1
1 793 . 10 1 1 A 66 66 GLN N N 66 117.400 118.365 -0.965 1
1 795 . 10 1 1 A 67 67 VAL H H 67 7.744 7.521 0.223 1
1 796 . 10 1 1 A 67 67 VAL HA H 67 3.785 3.846 -0.061 1
1 804 . 10 1 1 A 67 67 VAL C C 67 177.500 177.782 -0.282 1
1 805 . 10 1 1 A 67 67 VAL CA C 67 66.220 65.766 0.454 1
1 806 . 10 1 1 A 67 67 VAL CB C 67 31.390 31.984 -0.594 1
1 809 . 10 1 1 A 67 67 VAL N N 67 119.500 120.497 -0.997 1
1 810 . 10 1 1 A 68 68 LEU H H 68 7.983 7.911 0.072 1
1 811 . 10 1 1 A 68 68 LEU HA H 68 3.825 4.122 -0.297 1
1 821 . 10 1 1 A 68 68 LEU C C 68 179.100 178.099 1.001 1
1 822 . 10 1 1 A 68 68 LEU CA C 68 58.740 58.264 0.476 1
1 823 . 10 1 1 A 68 68 LEU CB C 68 41.090 41.951 -0.861 1
1 827 . 10 1 1 A 68 68 LEU N N 68 120.400 120.104 0.296 1
1 828 . 10 1 1 A 69 69 ASP H H 69 8.179 7.977 0.202 1
1 829 . 10 1 1 A 69 69 ASP HA H 69 4.380 4.402 -0.022 1
1 832 . 10 1 1 A 69 69 ASP C C 69 178.900 178.659 0.241 1
1 833 . 10 1 1 A 69 69 ASP CA C 69 57.320 56.783 0.537 1
1 834 . 10 1 1 A 69 69 ASP CB C 69 40.040 40.801 -0.761 1
1 835 . 10 1 1 A 69 69 ASP N N 69 119.000 118.293 0.707 1
1 836 . 10 1 1 A 70 70 GLU H H 70 8.166 8.063 0.103 1
1 837 . 10 1 1 A 70 70 GLU HA H 70 4.082 4.128 -0.046 1
1 842 . 10 1 1 A 70 70 GLU C C 70 179.600 179.209 0.391 1
1 843 . 10 1 1 A 70 70 GLU CA C 70 59.010 59.191 -0.181 1
1 844 . 10 1 1 A 70 70 GLU CB C 70 28.900 29.886 -0.986 1
1 846 . 10 1 1 A 70 70 GLU N N 70 120.500 118.732 1.768 1
1 847 . 10 1 1 A 71 71 ILE H H 71 8.415 8.383 0.032 1
1 848 . 10 1 1 A 71 71 ILE HA H 71 3.790 3.396 0.394 1
1 858 . 10 1 1 A 71 71 ILE C C 71 177.400 177.577 -0.177 1
1 859 . 10 1 1 A 71 71 ILE CA C 71 64.890 65.013 -0.123 1
1 860 . 10 1 1 A 71 71 ILE CB C 71 37.680 37.320 0.360 1
1 864 . 10 1 1 A 71 71 ILE N N 71 119.200 120.638 -1.438 1
1 865 . 10 1 1 A 72 72 LYS H H 72 8.248 8.034 0.214 1
1 866 . 10 1 1 A 72 72 LYS HA H 72 3.625 3.189 0.436 1
1 873 . 10 1 1 A 72 72 LYS C C 72 178.400 178.342 0.058 1
1 874 . 10 1 1 A 72 72 LYS CA C 72 59.850 59.253 0.597 1
1 875 . 10 1 1 A 72 72 LYS CB C 72 32.070 32.081 -0.011 1
1 879 . 10 1 1 A 72 72 LYS N N 72 120.800 121.007 -0.207 1
1 880 . 10 1 1 A 73 73 GLN H H 73 7.937 7.227 0.710 1
1 881 . 10 1 1 A 73 73 GLN HA H 73 4.042 3.998 0.044 1
1 888 . 10 1 1 A 73 73 GLN C C 73 178.400 178.909 -0.509 1
1 889 . 10 1 1 A 73 73 GLN CA C 73 58.510 59.029 -0.519 1
1 890 . 10 1 1 A 73 73 GLN CB C 73 28.430 28.062 0.368 1
1 892 . 10 1 1 A 73 73 GLN N N 73 117.000 118.142 -1.142 1
1 894 . 10 1 1 A 74 74 GLN H H 74 7.712 8.170 -0.458 1
1 895 . 10 1 1 A 74 74 GLN HA H 74 4.080 3.962 0.118 1
1 902 . 10 1 1 A 74 74 GLN C C 74 177.800 178.026 -0.226 1
1 903 . 10 1 1 A 74 74 GLN CA C 74 57.270 57.970 -0.700 1
1 904 . 10 1 1 A 74 74 GLN CB C 74 28.700 28.018 0.682 1
1 906 . 10 1 1 A 74 74 GLN N N 74 118.200 119.811 -1.611 1
1 908 . 10 1 1 A 75 75 LEU H H 75 7.956 7.562 0.394 1
1 909 . 10 1 1 A 75 75 LEU HA H 75 4.212 4.149 0.063 1
1 919 . 10 1 1 A 75 75 LEU CA C 75 56.660 55.656 1.004 1
1 920 . 10 1 1 A 75 75 LEU CB C 75 42.000 40.988 1.012 1
1 924 . 10 1 1 A 75 75 LEU N N 75 120.700 117.865 2.835 1
1 925 . 10 1 1 A 76 76 GLN H H 76 8.315 7.387 0.928 1
1 926 . 10 1 1 A 76 76 GLN HA H 76 4.113 4.070 0.043 1
1 933 . 10 1 1 A 76 76 GLN C C 76 177.100 176.180 0.920 1
1 934 . 10 1 1 A 76 76 GLN CA C 76 57.400 58.505 -1.105 1
1 935 . 10 1 1 A 76 76 GLN CB C 76 28.640 29.613 -0.973 1
1 937 . 10 1 1 A 76 76 GLN N N 76 120.100 120.949 -0.849 1
1 939 . 10 1 1 A 77 77 GLY H H 77 8.021 7.477 0.544 1
1 940 . 10 1 1 A 77 77 GLY HA2 H 77 4.042 4.113 -0.071 1
1 941 . 10 1 1 A 77 77 GLY HA3 H 77 3.869 4.114 -0.245 1
1 942 . 10 1 1 A 77 77 GLY C C 77 174.600 173.960 0.640 1
1 943 . 10 1 1 A 77 77 GLY CA C 77 45.430 45.595 -0.165 1
1 944 . 10 1 1 A 77 77 GLY N N 77 107.700 104.907 2.793 1
1 945 . 10 1 1 A 78 78 GLY H H 78 7.819 8.688 -0.869 1
1 946 . 10 1 1 A 78 78 GLY HA2 H 78 4.208 4.006 0.202 1
1 947 . 10 1 1 A 78 78 GLY HA3 H 78 3.801 4.008 -0.207 1
1 948 . 10 1 1 A 78 78 GLY C C 78 173.900 174.064 -0.164 1
1 949 . 10 1 1 A 78 78 GLY CA C 78 45.140 45.104 0.036 1
1 950 . 10 1 1 A 78 78 GLY N N 78 107.100 113.439 -6.339 1
1 951 . 10 1 1 A 79 79 ASP H H 79 7.912 7.911 0.001 1
1 952 . 10 1 1 A 79 79 ASP HA H 79 4.722 4.999 -0.277 1
1 955 . 10 1 1 A 79 79 ASP C C 79 176.200 177.385 -1.185 1
1 956 . 10 1 1 A 79 79 ASP CA C 79 53.210 52.805 0.405 1
1 957 . 10 1 1 A 79 79 ASP CB C 79 40.160 40.517 -0.357 1
1 958 . 10 1 1 A 79 79 ASP N N 79 119.800 119.390 0.410 1
1 959 . 10 1 1 A 80 80 ASN H H 80 8.450 8.345 0.105 1
1 960 . 10 1 1 A 80 80 ASN HA H 80 4.593 4.511 0.082 1
1 965 . 10 1 1 A 80 80 ASN C C 80 177.300 177.072 0.228 1
1 966 . 10 1 1 A 80 80 ASN CA C 80 54.680 54.757 -0.077 1
1 967 . 10 1 1 A 80 80 ASN CB C 80 38.790 37.360 1.430 1
1 968 . 10 1 1 A 80 80 ASN N N 80 121.700 119.115 2.585 1
1 970 . 10 1 1 A 81 81 SER H H 81 8.444 8.109 0.335 1
1 971 . 10 1 1 A 81 81 SER HA H 81 4.263 4.073 0.190 1
1 974 . 10 1 1 A 81 81 SER C C 81 176.100 176.417 -0.317 1
1 975 . 10 1 1 A 81 81 SER CA C 81 61.470 61.866 -0.396 1
1 976 . 10 1 1 A 81 81 SER CB C 81 61.470 62.918 -1.448 1
1 977 . 10 1 1 A 81 81 SER N N 81 117.100 117.462 -0.362 1
1 978 . 10 1 1 A 82 82 LEU H H 82 7.929 8.441 -0.512 1
1 979 . 10 1 1 A 82 82 LEU HA H 82 4.332 3.971 0.361 1
1 989 . 10 1 1 A 82 82 LEU C C 82 177.400 179.461 -2.061 1
1 990 . 10 1 1 A 82 82 LEU CA C 82 55.060 57.825 -2.765 1
1 991 . 10 1 1 A 82 82 LEU CB C 82 41.940 41.685 0.255 1
1 995 . 10 1 1 A 82 82 LEU N N 82 120.400 121.241 -0.841 1
1 996 . 10 1 1 A 83 83 HIS H H 83 8.014 7.816 0.198 1
1 997 . 10 1 1 A 83 83 HIS HA H 83 4.173 4.166 0.007 1
1 1000 . 10 1 1 A 83 83 HIS C C 83 176.100 176.846 -0.746 1
1 1001 . 10 1 1 A 83 83 HIS CA C 83 59.940 59.901 0.039 1
1 1002 . 10 1 1 A 83 83 HIS CB C 83 28.050 29.985 -1.935 1
1 1003 . 10 1 1 A 83 83 HIS N N 83 119.400 118.217 1.183 1
1 1004 . 10 1 1 A 84 84 ASN H H 84 8.598 8.255 0.343 1
1 1005 . 10 1 1 A 84 84 ASN HA H 84 4.735 4.708 0.027 1
1 1010 . 10 1 1 A 84 84 ASN C C 84 177.400 177.109 0.291 1
1 1011 . 10 1 1 A 84 84 ASN CA C 84 55.790 55.237 0.553 1
1 1012 . 10 1 1 A 84 84 ASN CB C 84 37.520 39.005 -1.485 1
1 1013 . 10 1 1 A 84 84 ASN N N 84 118.100 117.482 0.618 1
1 1015 . 10 1 1 A 85 85 VAL H H 85 7.933 7.710 0.223 1
1 1016 . 10 1 1 A 85 85 VAL HA H 85 3.849 3.803 0.046 1
1 1024 . 10 1 1 A 85 85 VAL C C 85 177.100 177.884 -0.784 1
1 1025 . 10 1 1 A 85 85 VAL CA C 85 65.490 65.161 0.329 1
1 1026 . 10 1 1 A 85 85 VAL CB C 85 31.760 32.047 -0.287 1
1 1029 . 10 1 1 A 85 85 VAL N N 85 120.500 119.712 0.788 1
1 1030 . 10 1 1 A 86 86 HIS H H 86 8.460 9.457 -0.997 1
1 1031 . 10 1 1 A 86 86 HIS HA H 86 4.054 4.105 -0.051 1
1 1035 . 10 1 1 A 86 86 HIS C C 86 176.300 177.629 -1.329 1
1 1036 . 10 1 1 A 86 86 HIS CA C 86 59.860 59.935 -0.075 1
1 1037 . 10 1 1 A 86 86 HIS CB C 86 29.670 29.953 -0.283 1
1 1038 . 10 1 1 A 86 86 HIS N N 86 119.300 119.249 0.051 1
1 1039 . 10 1 1 A 87 87 GLU H H 87 7.897 7.787 0.110 1
1 1040 . 10 1 1 A 87 87 GLU HA H 87 3.838 3.901 -0.063 1
1 1045 . 10 1 1 A 87 87 GLU C C 87 178.300 179.242 -0.942 1
1 1046 . 10 1 1 A 87 87 GLU CA C 87 58.690 58.946 -0.256 1
1 1047 . 10 1 1 A 87 87 GLU CB C 87 28.460 29.540 -1.080 1
1 1049 . 10 1 1 A 87 87 GLU N N 87 117.100 118.946 -1.846 1
1 1050 . 10 1 1 A 88 88 ASN H H 88 8.103 8.762 -0.659 1
1 1051 . 10 1 1 A 88 88 ASN HA H 88 4.503 4.465 0.038 1
1 1056 . 10 1 1 A 88 88 ASN C C 88 177.700 177.727 -0.027 1
1 1057 . 10 1 1 A 88 88 ASN CA C 88 55.990 56.024 -0.034 1
1 1058 . 10 1 1 A 88 88 ASN CB C 88 39.010 38.352 0.658 1
1 1059 . 10 1 1 A 88 88 ASN N N 88 118.400 117.224 1.176 1
1 1061 . 10 1 1 A 89 89 ILE H H 89 8.501 8.125 0.376 1
1 1062 . 10 1 1 A 89 89 ILE HA H 89 3.670 3.741 -0.071 1
1 1072 . 10 1 1 A 89 89 ILE C C 89 177.000 177.801 -0.801 1
1 1073 . 10 1 1 A 89 89 ILE CA C 89 65.390 65.311 0.079 1
1 1074 . 10 1 1 A 89 89 ILE CB C 89 37.440 37.657 -0.217 1
1 1078 . 10 1 1 A 89 89 ILE N N 89 118.700 119.175 -0.475 1
1 1079 . 10 1 1 A 90 90 LYS H H 90 8.017 7.361 0.656 1
1 1080 . 10 1 1 A 90 90 LYS HA H 90 3.775 3.878 -0.103 1
1 1089 . 10 1 1 A 90 90 LYS C C 90 178.800 178.610 0.190 1
1 1090 . 10 1 1 A 90 90 LYS CA C 90 60.450 59.759 0.691 1
1 1091 . 10 1 1 A 90 90 LYS CB C 90 32.110 31.995 0.115 1
1 1095 . 10 1 1 A 90 90 LYS N N 90 120.900 120.414 0.486 1
1 1096 . 10 1 1 A 91 91 GLU H H 91 7.732 8.480 -0.748 1
1 1097 . 10 1 1 A 91 91 GLU HA H 91 4.083 3.899 0.184 1
1 1102 . 10 1 1 A 91 91 GLU C C 91 179.100 178.699 0.401 1
1 1103 . 10 1 1 A 91 91 GLU CA C 91 59.120 58.305 0.815 1
1 1104 . 10 1 1 A 91 91 GLU CB C 91 28.810 30.172 -1.362 1
1 1106 . 10 1 1 A 91 91 GLU N N 91 119.300 118.323 0.977 1
1 1107 . 10 1 1 A 92 92 ILE H H 92 8.110 9.149 -1.039 1
1 1108 . 10 1 1 A 92 92 ILE HA H 92 3.685 3.818 -0.133 1
1 1118 . 10 1 1 A 92 92 ILE C C 92 178.000 177.949 0.051 1
1 1119 . 10 1 1 A 92 92 ILE CA C 92 65.900 65.500 0.400 1
1 1120 . 10 1 1 A 92 92 ILE CB C 92 38.400 37.982 0.418 1
1 1124 . 10 1 1 A 92 92 ILE N N 92 121.100 120.942 0.158 1
1 1125 . 10 1 1 A 93 93 PHE H H 93 8.651 9.211 -0.560 1
1 1126 . 10 1 1 A 93 93 PHE HA H 93 3.873 3.183 0.690 1
1 1133 . 10 1 1 A 93 93 PHE C C 93 177.100 177.968 -0.868 1
1 1134 . 10 1 1 A 93 93 PHE CA C 93 61.020 60.985 0.035 1
1 1135 . 10 1 1 A 93 93 PHE CB C 93 38.560 38.080 0.480 1
1 1138 . 10 1 1 A 93 93 PHE N N 93 119.400 121.075 -1.675 1
1 1139 . 10 1 1 A 94 94 HIS H H 94 8.126 7.508 0.618 1
1 1140 . 10 1 1 A 94 94 HIS HA H 94 4.368 3.914 0.454 1
1 1145 . 10 1 1 A 94 94 HIS C C 94 177.100 176.671 0.429 1
1 1146 . 10 1 1 A 94 94 HIS CA C 94 58.310 57.078 1.232 1
1 1147 . 10 1 1 A 94 94 HIS CB C 94 27.910 29.415 -1.505 1
1 1148 . 10 1 1 A 94 94 HIS N N 94 116.400 117.586 -1.186 1
1 1149 . 10 1 1 A 95 95 HIS H H 95 8.058 7.593 0.465 1
1 1150 . 10 1 1 A 95 95 HIS HA H 95 4.465 4.326 0.139 1
1 1154 . 10 1 1 A 95 95 HIS C C 95 177.300 177.897 -0.597 1
1 1155 . 10 1 1 A 95 95 HIS CA C 95 57.900 59.312 -1.412 1
1 1156 . 10 1 1 A 95 95 HIS CB C 95 28.490 30.997 -2.507 1
1 1157 . 10 1 1 A 95 95 HIS N N 95 117.000 115.722 1.278 1
1 1158 . 10 1 1 A 96 96 LEU H H 96 8.525 7.826 0.699 1
1 1159 . 10 1 1 A 96 96 LEU HA H 96 3.865 3.899 -0.034 1
1 1169 . 10 1 1 A 96 96 LEU C C 96 178.300 178.563 -0.263 1
1 1170 . 10 1 1 A 96 96 LEU CA C 96 58.250 58.000 0.250 1
1 1171 . 10 1 1 A 96 96 LEU CB C 96 41.720 41.904 -0.184 1
1 1175 . 10 1 1 A 96 96 LEU N N 96 121.300 121.134 0.166 1
1 1176 . 10 1 1 A 97 97 GLU H H 97 8.076 8.345 -0.269 1
1 1177 . 10 1 1 A 97 97 GLU HA H 97 3.719 4.114 -0.395 1
1 1182 . 10 1 1 A 97 97 GLU C C 97 178.300 178.869 -0.569 1
1 1183 . 10 1 1 A 97 97 GLU CA C 97 59.300 58.671 0.629 1
1 1184 . 10 1 1 A 97 97 GLU CB C 97 28.960 29.688 -0.728 1
1 1186 . 10 1 1 A 97 97 GLU N N 97 117.100 118.681 -1.581 1
1 1187 . 10 1 1 A 98 98 GLU H H 98 7.329 7.847 -0.518 1
1 1188 . 10 1 1 A 98 98 GLU HA H 98 4.024 4.201 -0.177 1
1 1193 . 10 1 1 A 98 98 GLU C C 98 177.900 178.975 -1.075 1
1 1194 . 10 1 1 A 98 98 GLU CA C 98 58.190 58.606 -0.416 1
1 1195 . 10 1 1 A 98 98 GLU CB C 98 29.120 29.638 -0.518 1
1 1197 . 10 1 1 A 98 98 GLU N N 98 116.000 119.369 -3.369 1
1 1198 . 10 1 1 A 99 99 LEU H H 99 7.535 8.239 -0.704 1
1 1199 . 10 1 1 A 99 99 LEU HA H 99 4.183 4.154 0.029 1
1 1209 . 10 1 1 A 99 99 LEU C C 99 178.100 177.521 0.579 1
1 1210 . 10 1 1 A 99 99 LEU CA C 99 56.440 56.297 0.143 1
1 1211 . 10 1 1 A 99 99 LEU CB C 99 43.010 41.300 1.710 1
1 1215 . 10 1 1 A 99 99 LEU N N 99 118.200 119.476 -1.276 1
1 1216 . 10 1 1 A 100 100 VAL H H 100 7.561 7.295 0.266 1
1 1217 . 10 1 1 A 100 100 VAL HA H 100 4.033 4.633 -0.600 1
1 1225 . 10 1 1 A 100 100 VAL C C 100 175.400 177.338 -1.938 1
1 1226 . 10 1 1 A 100 100 VAL CA C 100 62.430 61.849 0.581 1
1 1227 . 10 1 1 A 100 100 VAL CB C 100 32.050 33.697 -1.647 1
1 1230 . 10 1 1 A 100 100 VAL N N 100 114.800 110.942 3.858 1
1 1231 . 10 1 1 A 101 101 HIS H H 101 7.827 7.704 0.123 1
1 1232 . 10 1 1 A 101 101 HIS HA H 101 4.630 4.452 0.178 1
1 1237 . 10 1 1 A 101 101 HIS C C 101 173.500 174.471 -0.971 1
1 1238 . 10 1 1 A 101 101 HIS CA C 101 55.410 58.052 -2.642 1
1 1239 . 10 1 1 A 101 101 HIS CB C 101 28.870 29.391 -0.521 1
1 1240 . 10 1 1 A 101 101 HIS N N 101 120.300 121.135 -0.835 1
1 10 . 11 1 1 A 2 2 TYR H H 2 8.688 6.963 1.725 1
1 11 . 11 1 1 A 2 2 TYR HA H 2 4.737 4.211 0.526 1
1 16 . 11 1 1 A 2 2 TYR C C 2 175.900 176.297 -0.397 1
1 17 . 11 1 1 A 2 2 TYR CA C 2 57.920 60.169 -2.249 1
1 18 . 11 1 1 A 2 2 TYR CB C 2 38.340 38.723 -0.383 1
1 19 . 11 1 1 A 2 2 TYR N N 2 122.100 123.789 -1.689 1
1 20 . 11 1 1 A 3 3 GLY H H 3 8.434 8.335 0.099 1
1 21 . 11 1 1 A 3 3 GLY HA2 H 3 3.909 4.035 -0.126 1
1 22 . 11 1 1 A 3 3 GLY HA3 H 3 3.841 4.078 -0.237 1
1 23 . 11 1 1 A 3 3 GLY C C 3 174.300 175.868 -1.568 1
1 24 . 11 1 1 A 3 3 GLY CA C 3 46.050 45.526 0.524 1
1 25 . 11 1 1 A 3 3 GLY N N 3 111.100 108.161 2.939 1
1 26 . 11 1 1 A 4 4 LYS H H 4 8.060 8.427 -0.367 1
1 27 . 11 1 1 A 4 4 LYS HA H 4 4.297 4.101 0.196 1
1 36 . 11 1 1 A 4 4 LYS C C 4 178.000 179.268 -1.268 1
1 37 . 11 1 1 A 4 4 LYS CA C 4 56.930 59.416 -2.486 1
1 38 . 11 1 1 A 4 4 LYS CB C 4 32.680 31.877 0.803 1
1 42 . 11 1 1 A 4 4 LYS N N 4 119.500 121.839 -2.339 1
1 43 . 11 1 1 A 5 5 LEU H H 5 8.243 8.251 -0.008 1
1 44 . 11 1 1 A 5 5 LEU HA H 5 3.947 3.865 0.082 1
1 54 . 11 1 1 A 5 5 LEU C C 5 177.900 178.683 -0.783 1
1 55 . 11 1 1 A 5 5 LEU CA C 5 57.930 57.830 0.100 1
1 56 . 11 1 1 A 5 5 LEU CB C 5 41.620 41.593 0.027 1
1 60 . 11 1 1 A 5 5 LEU N N 5 120.800 119.766 1.034 1
1 61 . 11 1 1 A 6 6 ASN H H 6 8.256 7.975 0.281 1
1 62 . 11 1 1 A 6 6 ASN HA H 6 4.252 4.359 -0.107 1
1 67 . 11 1 1 A 6 6 ASN C C 6 177.300 177.690 -0.390 1
1 68 . 11 1 1 A 6 6 ASN CA C 6 56.900 56.483 0.417 1
1 69 . 11 1 1 A 6 6 ASN CB C 6 38.200 37.997 0.203 1
1 70 . 11 1 1 A 6 6 ASN N N 6 116.200 117.011 -0.811 1
1 72 . 11 1 1 A 7 7 ASP H H 7 7.699 9.026 -1.327 1
1 73 . 11 1 1 A 7 7 ASP HA H 7 4.320 4.351 -0.031 1
1 76 . 11 1 1 A 7 7 ASP C C 7 178.000 178.277 -0.277 1
1 77 . 11 1 1 A 7 7 ASP CA C 7 56.980 57.434 -0.454 1
1 78 . 11 1 1 A 7 7 ASP CB C 7 39.870 42.433 -2.563 1
1 79 . 11 1 1 A 7 7 ASP N N 7 119.100 118.308 0.792 1
1 80 . 11 1 1 A 8 8 LEU H H 8 7.580 8.699 -1.119 1
1 81 . 11 1 1 A 8 8 LEU HA H 8 4.091 4.123 -0.032 1
1 91 . 11 1 1 A 8 8 LEU C C 8 178.800 178.848 -0.048 1
1 92 . 11 1 1 A 8 8 LEU CA C 8 57.790 57.797 -0.007 1
1 93 . 11 1 1 A 8 8 LEU CB C 8 41.880 41.898 -0.018 1
1 97 . 11 1 1 A 8 8 LEU N N 8 120.400 119.699 0.701 1
1 98 . 11 1 1 A 9 9 LEU H H 9 8.125 8.924 -0.799 1
1 99 . 11 1 1 A 9 9 LEU HA H 9 3.891 3.929 -0.038 1
1 109 . 11 1 1 A 9 9 LEU C C 9 178.900 178.258 0.642 1
1 110 . 11 1 1 A 9 9 LEU CA C 9 58.350 58.694 -0.344 1
1 111 . 11 1 1 A 9 9 LEU CB C 9 41.510 41.471 0.039 1
1 115 . 11 1 1 A 9 9 LEU N N 9 118.900 119.962 -1.062 1
1 116 . 11 1 1 A 10 10 GLU H H 10 8.011 8.729 -0.718 1
1 117 . 11 1 1 A 10 10 GLU HA H 10 4.072 4.283 -0.211 1
1 122 . 11 1 1 A 10 10 GLU C C 10 179.000 179.102 -0.102 1
1 123 . 11 1 1 A 10 10 GLU CA C 10 59.090 59.684 -0.594 1
1 124 . 11 1 1 A 10 10 GLU CB C 10 27.910 29.339 -1.429 1
1 126 . 11 1 1 A 10 10 GLU N N 10 119.300 117.857 1.443 1
1 127 . 11 1 1 A 11 11 ASP H H 11 8.128 7.843 0.285 1
1 128 . 11 1 1 A 11 11 ASP HA H 11 4.383 4.448 -0.065 1
1 131 . 11 1 1 A 11 11 ASP C C 11 178.500 178.995 -0.495 1
1 132 . 11 1 1 A 11 11 ASP CA C 11 56.580 57.472 -0.892 1
1 133 . 11 1 1 A 11 11 ASP CB C 11 38.600 40.971 -2.371 1
1 134 . 11 1 1 A 11 11 ASP N N 11 119.600 120.721 -1.121 1
1 135 . 11 1 1 A 12 12 LEU H H 12 8.394 8.426 -0.032 1
1 136 . 11 1 1 A 12 12 LEU HA H 12 3.923 4.194 -0.271 1
1 146 . 11 1 1 A 12 12 LEU C C 12 178.200 178.692 -0.492 1
1 147 . 11 1 1 A 12 12 LEU CA C 12 57.880 57.530 0.350 1
1 148 . 11 1 1 A 12 12 LEU CB C 12 41.850 41.647 0.203 1
1 152 . 11 1 1 A 12 12 LEU N N 12 120.500 121.071 -0.571 1
1 153 . 11 1 1 A 13 13 GLN H H 13 8.371 9.095 -0.724 1
1 154 . 11 1 1 A 13 13 GLN HA H 13 3.879 4.116 -0.237 1
1 161 . 11 1 1 A 13 13 GLN C C 13 178.600 177.228 1.372 1
1 162 . 11 1 1 A 13 13 GLN CA C 13 59.570 57.380 2.190 1
1 163 . 11 1 1 A 13 13 GLN CB C 13 28.440 27.514 0.926 1
1 165 . 11 1 1 A 13 13 GLN N N 13 118.400 116.582 1.818 1
1 167 . 11 1 1 A 14 14 GLU H H 14 7.913 7.719 0.194 1
1 168 . 11 1 1 A 14 14 GLU HA H 14 4.021 4.246 -0.225 1
1 173 . 11 1 1 A 14 14 GLU C C 14 179.000 179.086 -0.086 1
1 174 . 11 1 1 A 14 14 GLU CA C 14 59.030 58.498 0.532 1
1 175 . 11 1 1 A 14 14 GLU CB C 14 28.720 30.293 -1.573 1
1 177 . 11 1 1 A 14 14 GLU N N 14 119.100 118.719 0.381 1
1 178 . 11 1 1 A 15 15 VAL H H 15 7.991 7.861 0.130 1
1 179 . 11 1 1 A 15 15 VAL HA H 15 3.696 3.955 -0.259 1
1 187 . 11 1 1 A 15 15 VAL C C 15 178.300 177.770 0.530 1
1 188 . 11 1 1 A 15 15 VAL CA C 15 66.640 65.494 1.146 1
1 189 . 11 1 1 A 15 15 VAL CB C 15 31.470 31.418 0.052 1
1 192 . 11 1 1 A 15 15 VAL N N 15 120.300 118.620 1.680 1
1 193 . 11 1 1 A 16 16 LEU H H 16 8.172 7.727 0.445 1
1 194 . 11 1 1 A 16 16 LEU HA H 16 3.876 4.141 -0.265 1
1 204 . 11 1 1 A 16 16 LEU C C 16 178.400 179.180 -0.780 1
1 205 . 11 1 1 A 16 16 LEU CA C 16 58.050 57.821 0.229 1
1 206 . 11 1 1 A 16 16 LEU CB C 16 41.420 41.362 0.058 1
1 210 . 11 1 1 A 16 16 LEU N N 16 119.700 120.232 -0.532 1
1 211 . 11 1 1 A 17 17 LYS H H 17 7.755 9.277 -1.522 1
1 212 . 11 1 1 A 17 17 LYS HA H 17 3.951 4.022 -0.071 1
1 221 . 11 1 1 A 17 17 LYS C C 17 178.800 178.457 0.343 1
1 222 . 11 1 1 A 17 17 LYS CA C 17 59.470 58.893 0.577 1
1 223 . 11 1 1 A 17 17 LYS CB C 17 32.350 32.598 -0.248 1
1 227 . 11 1 1 A 17 17 LYS N N 17 117.800 117.992 -0.192 1
1 228 . 11 1 1 A 18 18 HIS H H 18 7.847 7.846 0.001 1
1 229 . 11 1 1 A 18 18 HIS HA H 18 4.549 4.701 -0.152 1
1 233 . 11 1 1 A 18 18 HIS C C 18 177.200 176.452 0.748 1
1 234 . 11 1 1 A 18 18 HIS CA C 18 57.870 57.680 0.190 1
1 235 . 11 1 1 A 18 18 HIS CB C 18 28.730 29.070 -0.340 1
1 236 . 11 1 1 A 18 18 HIS N N 18 116.200 117.528 -1.328 1
1 237 . 11 1 1 A 19 19 VAL H H 19 8.415 7.925 0.490 1
1 238 . 11 1 1 A 19 19 VAL HA H 19 3.746 4.229 -0.483 1
1 246 . 11 1 1 A 19 19 VAL CA C 19 65.850 64.055 1.795 1
1 247 . 11 1 1 A 19 19 VAL CB C 19 31.600 32.773 -1.173 1
1 250 . 11 1 1 A 20 20 ASN H H 20 8.041 8.535 -0.494 1
1 251 . 11 1 1 A 20 20 ASN HA H 20 4.545 4.549 -0.004 1
1 256 . 11 1 1 A 20 20 ASN C C 20 176.900 177.596 -0.696 1
1 257 . 11 1 1 A 20 20 ASN CA C 20 55.070 56.631 -1.561 1
1 258 . 11 1 1 A 20 20 ASN CB C 20 38.270 38.367 -0.097 1
1 259 . 11 1 1 A 20 20 ASN N N 20 117.900 119.478 -1.578 1
1 261 . 11 1 1 A 21 21 GLN H H 21 7.887 7.964 -0.077 1
1 262 . 11 1 1 A 21 21 GLN HA H 21 4.096 4.229 -0.133 1
1 269 . 11 1 1 A 21 21 GLN C C 21 176.900 177.398 -0.498 1
1 270 . 11 1 1 A 21 21 GLN CA C 21 57.510 57.652 -0.142 1
1 271 . 11 1 1 A 21 21 GLN CB C 21 29.100 29.222 -0.122 1
1 273 . 11 1 1 A 21 21 GLN N N 21 117.900 118.501 -0.601 1
1 275 . 11 1 1 A 22 22 HIS H H 22 7.887 8.105 -0.218 1
1 276 . 11 1 1 A 22 22 HIS HA H 22 4.679 4.784 -0.105 1
1 280 . 11 1 1 A 22 22 HIS C C 22 174.300 175.243 -0.943 1
1 281 . 11 1 1 A 22 22 HIS CA C 22 55.770 54.770 1.000 1
1 282 . 11 1 1 A 22 22 HIS CB C 22 28.630 28.759 -0.129 1
1 283 . 11 1 1 A 22 22 HIS N N 22 116.100 115.008 1.092 1
1 284 . 11 1 1 A 23 23 TRP H H 23 7.929 7.912 0.017 1
1 285 . 11 1 1 A 23 23 TRP HA H 23 4.542 5.006 -0.464 1
1 292 . 11 1 1 A 23 23 TRP C C 23 176.600 175.627 0.973 1
1 293 . 11 1 1 A 23 23 TRP CA C 23 58.020 56.890 1.130 1
1 294 . 11 1 1 A 23 23 TRP CB C 23 29.700 31.606 -1.906 1
1 295 . 11 1 1 A 23 23 TRP N N 23 122.000 123.551 -1.551 1
1 297 . 11 1 1 A 24 24 GLN H H 24 8.258 8.341 -0.083 1
1 298 . 11 1 1 A 24 24 GLN HA H 24 4.329 4.761 -0.432 1
1 305 . 11 1 1 A 24 24 GLN C C 24 176.200 175.234 0.966 1
1 306 . 11 1 1 A 24 24 GLN CA C 24 55.960 55.240 0.720 1
1 307 . 11 1 1 A 24 24 GLN CB C 24 29.440 31.921 -2.481 1
1 309 . 11 1 1 A 24 24 GLN N N 24 123.800 126.919 -3.119 1
1 311 . 11 1 1 A 25 25 GLY H H 25 7.470 8.766 -1.296 1
1 312 . 11 1 1 A 25 25 GLY HA2 H 25 3.939 4.022 -0.083 1
1 313 . 11 1 1 A 25 25 GLY HA3 H 25 3.800 4.033 -0.233 1
1 314 . 11 1 1 A 25 25 GLY C C 25 174.800 174.401 0.399 1
1 315 . 11 1 1 A 25 25 GLY CA C 25 45.470 45.475 -0.005 1
1 316 . 11 1 1 A 25 25 GLY N N 25 108.100 112.502 -4.402 1
1 317 . 11 1 1 A 26 26 GLY H H 26 8.332 8.601 -0.269 1
1 318 . 11 1 1 A 26 26 GLY HA2 H 26 4.105 4.168 -0.063 1
1 319 . 11 1 1 A 26 26 GLY HA3 H 26 3.974 4.210 -0.236 1
1 320 . 11 1 1 A 26 26 GLY C C 26 174.900 174.599 0.301 1
1 321 . 11 1 1 A 26 26 GLY CA C 26 45.410 45.375 0.035 1
1 322 . 11 1 1 A 26 26 GLY N N 26 108.700 107.766 0.934 1
1 323 . 11 1 1 A 27 27 GLN H H 27 8.474 8.733 -0.259 1
1 324 . 11 1 1 A 27 27 GLN HA H 27 4.106 4.150 -0.044 1
1 331 . 11 1 1 A 27 27 GLN C C 27 177.100 176.553 0.547 1
1 332 . 11 1 1 A 27 27 GLN CA C 27 57.540 57.293 0.247 1
1 333 . 11 1 1 A 27 27 GLN CB C 27 29.050 28.782 0.268 1
1 335 . 11 1 1 A 27 27 GLN N N 27 121.100 123.180 -2.080 1
1 337 . 11 1 1 A 28 28 LYS H H 28 8.448 8.200 0.248 1
1 338 . 11 1 1 A 28 28 LYS HA H 28 4.068 4.037 0.031 1
1 347 . 11 1 1 A 28 28 LYS C C 28 177.900 178.544 -0.644 1
1 348 . 11 1 1 A 28 28 LYS CA C 28 58.410 58.744 -0.334 1
1 349 . 11 1 1 A 28 28 LYS CB C 28 32.210 32.478 -0.268 1
1 353 . 11 1 1 A 28 28 LYS N N 28 120.500 117.636 2.864 1
1 354 . 11 1 1 A 29 29 ASN H H 29 8.273 7.750 0.523 1
1 355 . 11 1 1 A 29 29 ASN HA H 29 4.584 4.377 0.207 1
1 360 . 11 1 1 A 29 29 ASN C C 29 176.200 177.210 -1.010 1
1 361 . 11 1 1 A 29 29 ASN CA C 29 54.400 55.882 -1.482 1
1 362 . 11 1 1 A 29 29 ASN CB C 29 38.280 38.394 -0.114 1
1 363 . 11 1 1 A 29 29 ASN N N 29 117.500 117.839 -0.339 1
1 365 . 11 1 1 A 30 30 MET H H 30 7.870 7.348 0.522 1
1 366 . 11 1 1 A 30 30 MET HA H 30 4.085 2.762 1.323 1
1 371 . 11 1 1 A 30 30 MET C C 30 177.000 177.333 -0.333 1
1 372 . 11 1 1 A 30 30 MET CA C 30 56.880 57.667 -0.787 1
1 373 . 11 1 1 A 30 30 MET CB C 30 32.340 31.880 0.460 1
1 375 . 11 1 1 A 30 30 MET N N 30 121.100 118.453 2.647 1
1 376 . 11 1 1 A 31 31 ASN H H 31 8.186 7.569 0.617 1
1 377 . 11 1 1 A 31 31 ASN HA H 31 4.311 4.568 -0.257 1
1 382 . 11 1 1 A 31 31 ASN C C 31 176.700 177.407 -0.707 1
1 383 . 11 1 1 A 31 31 ASN CA C 31 55.320 55.126 0.194 1
1 384 . 11 1 1 A 31 31 ASN CB C 31 38.410 38.558 -0.148 1
1 385 . 11 1 1 A 31 31 ASN N N 31 117.900 115.670 2.230 1
1 387 . 11 1 1 A 32 32 LYS H H 32 7.792 7.274 0.518 1
1 388 . 11 1 1 A 32 32 LYS HA H 32 3.992 3.985 0.007 1
1 397 . 11 1 1 A 32 32 LYS C C 32 177.900 178.725 -0.825 1
1 398 . 11 1 1 A 32 32 LYS CA C 32 59.050 58.275 0.775 1
1 399 . 11 1 1 A 32 32 LYS CB C 32 32.460 32.873 -0.413 1
1 403 . 11 1 1 A 32 32 LYS N N 32 120.400 119.368 1.032 1
1 404 . 11 1 1 A 33 33 VAL H H 33 7.689 8.107 -0.418 1
1 405 . 11 1 1 A 33 33 VAL HA H 33 3.791 3.635 0.156 1
1 413 . 11 1 1 A 33 33 VAL C C 33 177.100 177.475 -0.375 1
1 414 . 11 1 1 A 33 33 VAL CA C 33 65.360 65.091 0.269 1
1 415 . 11 1 1 A 33 33 VAL CB C 33 31.920 31.606 0.314 1
1 418 . 11 1 1 A 33 33 VAL N N 33 120.200 116.068 4.132 1
1 419 . 11 1 1 A 34 34 ASP H H 34 8.408 7.843 0.565 1
1 420 . 11 1 1 A 34 34 ASP HA H 34 4.303 4.311 -0.008 1
1 423 . 11 1 1 A 34 34 ASP C C 34 178.200 178.461 -0.261 1
1 424 . 11 1 1 A 34 34 ASP CA C 34 55.880 57.002 -1.122 1
1 425 . 11 1 1 A 34 34 ASP CB C 34 38.710 41.057 -2.347 1
1 426 . 11 1 1 A 34 34 ASP N N 34 120.100 122.681 -2.581 1
1 427 . 11 1 1 A 35 35 HIS H H 35 8.204 7.692 0.512 1
1 428 . 11 1 1 A 35 35 HIS HA H 35 4.343 4.207 0.136 1
1 431 . 11 1 1 A 35 35 HIS C C 35 176.800 177.512 -0.712 1
1 432 . 11 1 1 A 35 35 HIS CA C 35 58.310 60.257 -1.947 1
1 433 . 11 1 1 A 35 35 HIS CB C 35 28.070 30.360 -2.290 1
1 434 . 11 1 1 A 35 35 HIS N N 35 118.200 117.843 0.357 1
1 435 . 11 1 1 A 36 36 HIS H H 36 8.067 8.960 -0.893 1
1 436 . 11 1 1 A 36 36 HIS HA H 36 4.602 4.043 0.559 1
1 440 . 11 1 1 A 36 36 HIS C C 36 177.100 177.638 -0.538 1
1 441 . 11 1 1 A 36 36 HIS CA C 36 58.520 59.429 -0.909 1
1 442 . 11 1 1 A 36 36 HIS CB C 36 28.720 30.165 -1.445 1
1 443 . 11 1 1 A 36 36 HIS N N 36 117.100 117.394 -0.294 1
1 444 . 11 1 1 A 37 37 LEU H H 37 8.473 8.339 0.134 1
1 445 . 11 1 1 A 37 37 LEU HA H 37 3.894 3.580 0.314 1
1 455 . 11 1 1 A 37 37 LEU C C 37 178.200 178.506 -0.306 1
1 456 . 11 1 1 A 37 37 LEU CA C 37 58.520 58.122 0.398 1
1 457 . 11 1 1 A 37 37 LEU CB C 37 41.810 41.581 0.229 1
1 461 . 11 1 1 A 37 37 LEU N N 37 119.600 119.559 0.041 1
1 462 . 11 1 1 A 38 38 GLN H H 38 8.337 8.255 0.082 1
1 463 . 11 1 1 A 38 38 GLN HA H 38 3.882 3.914 -0.032 1
1 470 . 11 1 1 A 38 38 GLN C C 38 178.500 177.917 0.583 1
1 471 . 11 1 1 A 38 38 GLN CA C 38 59.200 59.399 -0.199 1
1 472 . 11 1 1 A 38 38 GLN CB C 38 27.850 28.074 -0.224 1
1 474 . 11 1 1 A 38 38 GLN N N 38 118.000 116.514 1.486 1
1 476 . 11 1 1 A 39 39 ASN H H 39 7.923 7.637 0.286 1
1 477 . 11 1 1 A 39 39 ASN HA H 39 4.390 4.444 -0.054 1
1 482 . 11 1 1 A 39 39 ASN C C 39 177.500 177.233 0.267 1
1 483 . 11 1 1 A 39 39 ASN CA C 39 55.780 56.127 -0.347 1
1 484 . 11 1 1 A 39 39 ASN CB C 39 37.450 38.183 -0.733 1
1 485 . 11 1 1 A 39 39 ASN N N 39 118.700 117.898 0.802 1
1 487 . 11 1 1 A 40 40 VAL H H 40 7.907 8.229 -0.322 1
1 488 . 11 1 1 A 40 40 VAL HA H 40 3.629 3.587 0.042 1
1 496 . 11 1 1 A 40 40 VAL C C 40 177.500 177.890 -0.390 1
1 497 . 11 1 1 A 40 40 VAL CA C 40 67.080 65.865 1.215 1
1 498 . 11 1 1 A 40 40 VAL CB C 40 31.390 31.400 -0.010 1
1 501 . 11 1 1 A 40 40 VAL N N 40 120.400 119.013 1.387 1
1 502 . 11 1 1 A 41 41 ILE H H 41 8.103 8.335 -0.232 1
1 503 . 11 1 1 A 41 41 ILE HA H 41 3.401 3.545 -0.144 1
1 513 . 11 1 1 A 41 41 ILE C C 41 178.000 178.498 -0.498 1
1 514 . 11 1 1 A 41 41 ILE CA C 41 66.430 65.325 1.105 1
1 515 . 11 1 1 A 41 41 ILE CB C 41 38.050 37.659 0.391 1
1 519 . 11 1 1 A 41 41 ILE N N 41 120.600 119.567 1.033 1
1 520 . 11 1 1 A 42 42 GLU H H 42 8.150 7.576 0.574 1
1 521 . 11 1 1 A 42 42 GLU HA H 42 4.062 4.088 -0.026 1
1 526 . 11 1 1 A 42 42 GLU C C 42 178.500 178.942 -0.442 1
1 527 . 11 1 1 A 42 42 GLU CA C 42 59.120 59.191 -0.071 1
1 528 . 11 1 1 A 42 42 GLU CB C 42 28.160 29.205 -1.045 1
1 530 . 11 1 1 A 42 42 GLU N N 42 119.900 121.241 -1.341 1
1 531 . 11 1 1 A 43 43 ASP H H 43 8.453 9.275 -0.822 1
1 532 . 11 1 1 A 43 43 ASP HA H 43 4.445 4.465 -0.020 1
1 535 . 11 1 1 A 43 43 ASP C C 43 178.400 178.020 0.380 1
1 536 . 11 1 1 A 43 43 ASP CA C 43 56.490 56.890 -0.400 1
1 537 . 11 1 1 A 43 43 ASP CB C 43 37.820 41.608 -3.788 1
1 538 . 11 1 1 A 43 43 ASP N N 43 119.700 120.026 -0.326 1
1 539 . 11 1 1 A 44 44 ILE H H 44 8.544 7.489 1.055 1
1 540 . 11 1 1 A 44 44 ILE HA H 44 3.590 4.028 -0.438 1
1 550 . 11 1 1 A 44 44 ILE C C 44 177.800 178.605 -0.805 1
1 551 . 11 1 1 A 44 44 ILE CA C 44 66.320 64.955 1.365 1
1 552 . 11 1 1 A 44 44 ILE CB C 44 37.690 37.862 -0.172 1
1 556 . 11 1 1 A 44 44 ILE N N 44 121.500 118.536 2.964 1
1 557 . 11 1 1 A 45 45 HIS H H 45 8.261 8.357 -0.096 1
1 558 . 11 1 1 A 45 45 HIS HA H 45 4.255 4.484 -0.229 1
1 562 . 11 1 1 A 45 45 HIS C C 45 177.200 177.227 -0.027 1
1 563 . 11 1 1 A 45 45 HIS CA C 45 59.580 59.192 0.388 1
1 564 . 11 1 1 A 45 45 HIS CB C 45 27.790 29.753 -1.963 1
1 565 . 11 1 1 A 45 45 HIS N N 45 118.800 119.079 -0.279 1
1 566 . 11 1 1 A 46 46 ASP H H 46 8.680 7.883 0.797 1
1 567 . 11 1 1 A 46 46 ASP HA H 46 4.338 4.430 -0.092 1
1 570 . 11 1 1 A 46 46 ASP C C 46 178.700 178.088 0.612 1
1 571 . 11 1 1 A 46 46 ASP CA C 46 57.010 56.063 0.947 1
1 572 . 11 1 1 A 46 46 ASP CB C 46 39.400 40.846 -1.446 1
1 573 . 11 1 1 A 46 46 ASP N N 46 119.200 118.953 0.247 1
1 574 . 11 1 1 A 47 47 PHE H H 47 8.380 9.449 -1.069 1
1 575 . 11 1 1 A 47 47 PHE HA H 47 4.070 4.220 -0.150 1
1 580 . 11 1 1 A 47 47 PHE C C 47 178.600 177.720 0.880 1
1 581 . 11 1 1 A 47 47 PHE CA C 47 61.250 60.063 1.187 1
1 582 . 11 1 1 A 47 47 PHE CB C 47 39.570 39.920 -0.350 1
1 583 . 11 1 1 A 47 47 PHE N N 47 121.800 120.703 1.097 1
1 584 . 11 1 1 A 48 48 MET H H 48 8.366 8.214 0.152 1
1 585 . 11 1 1 A 48 48 MET HA H 48 3.998 4.511 -0.513 1
1 590 . 11 1 1 A 48 48 MET C C 48 177.400 177.962 -0.562 1
1 591 . 11 1 1 A 48 48 MET CA C 48 58.470 58.874 -0.404 1
1 592 . 11 1 1 A 48 48 MET CB C 48 33.170 33.815 -0.645 1
1 594 . 11 1 1 A 48 48 MET N N 48 117.700 118.004 -0.304 1
1 595 . 11 1 1 A 49 49 GLN H H 49 7.659 8.384 -0.725 1
1 596 . 11 1 1 A 49 49 GLN HA H 49 4.258 4.069 0.189 1
1 603 . 11 1 1 A 49 49 GLN C C 49 176.700 178.496 -1.796 1
1 604 . 11 1 1 A 49 49 GLN CA C 49 56.380 58.364 -1.984 1
1 605 . 11 1 1 A 49 49 GLN CB C 49 28.980 28.287 0.693 1
1 607 . 11 1 1 A 49 49 GLN N N 49 116.700 117.873 -1.173 1
1 609 . 11 1 1 A 50 50 GLY H H 50 7.685 8.279 -0.594 1
1 610 . 11 1 1 A 50 50 GLY HA2 H 50 3.998 3.808 0.190 1
1 611 . 11 1 1 A 50 50 GLY HA3 H 50 3.998 3.840 0.158 1
1 612 . 11 1 1 A 50 50 GLY C C 50 174.900 174.916 -0.016 1
1 613 . 11 1 1 A 50 50 GLY CA C 50 45.460 46.095 -0.635 1
1 614 . 11 1 1 A 50 50 GLY N N 50 106.400 108.781 -2.381 1
1 615 . 11 1 1 A 51 51 GLY H H 51 8.031 8.645 -0.614 1
1 616 . 11 1 1 A 51 51 GLY HA2 H 51 3.817 3.824 -0.007 1
1 617 . 11 1 1 A 51 51 GLY HA3 H 51 3.817 3.836 -0.019 1
1 618 . 11 1 1 A 51 51 GLY C C 51 174.500 174.752 -0.252 1
1 619 . 11 1 1 A 51 51 GLY CA C 51 45.190 45.350 -0.160 1
1 620 . 11 1 1 A 51 51 GLY N N 51 108.900 109.565 -0.665 1
1 621 . 11 1 1 A 52 52 GLY H H 52 8.126 8.348 -0.222 1
1 622 . 11 1 1 A 52 52 GLY HA2 H 52 3.362 3.397 -0.035 1
1 623 . 11 1 1 A 52 52 GLY HA3 H 52 3.362 3.936 -0.574 1
1 624 . 11 1 1 A 52 52 GLY C C 52 173.300 174.559 -1.259 1
1 625 . 11 1 1 A 52 52 GLY CA C 52 45.120 45.115 0.005 1
1 626 . 11 1 1 A 52 52 GLY N N 52 108.100 108.915 -0.815 1
1 627 . 11 1 1 A 53 53 SER H H 53 7.594 7.720 -0.126 1
1 628 . 11 1 1 A 53 53 SER HA H 53 4.530 4.599 -0.069 1
1 631 . 11 1 1 A 53 53 SER C C 53 175.300 175.218 0.082 1
1 632 . 11 1 1 A 53 53 SER CA C 53 57.770 58.018 -0.248 1
1 633 . 11 1 1 A 53 53 SER CB C 53 64.750 62.095 2.655 1
1 634 . 11 1 1 A 53 53 SER N N 53 114.100 114.000 0.100 1
1 635 . 11 1 1 A 54 54 GLY H H 54 9.003 9.030 -0.027 1
1 636 . 11 1 1 A 54 54 GLY HA2 H 54 4.037 4.012 0.025 1
1 637 . 11 1 1 A 54 54 GLY HA3 H 54 3.911 4.111 -0.200 1
1 638 . 11 1 1 A 54 54 GLY C C 54 176.500 175.472 1.028 1
1 639 . 11 1 1 A 54 54 GLY CA C 54 47.040 47.175 -0.135 1
1 640 . 11 1 1 A 54 54 GLY N N 54 110.400 110.123 0.277 1
1 641 . 11 1 1 A 55 55 GLY H H 55 8.617 8.270 0.347 1
1 642 . 11 1 1 A 55 55 GLY HA2 H 55 3.946 3.918 0.028 1
1 643 . 11 1 1 A 55 55 GLY HA3 H 55 3.946 3.936 0.010 1
1 644 . 11 1 1 A 55 55 GLY C C 55 176.400 175.590 0.810 1
1 645 . 11 1 1 A 55 55 GLY CA C 55 46.630 46.820 -0.190 1
1 646 . 11 1 1 A 55 55 GLY N N 55 109.800 109.537 0.263 1
1 647 . 11 1 1 A 56 56 LYS H H 56 7.876 8.903 -1.027 1
1 648 . 11 1 1 A 56 56 LYS HA H 56 4.195 4.225 -0.030 1
1 657 . 11 1 1 A 56 56 LYS C C 56 178.600 178.838 -0.238 1
1 658 . 11 1 1 A 56 56 LYS CA C 56 57.960 58.769 -0.809 1
1 659 . 11 1 1 A 56 56 LYS CB C 56 32.110 31.923 0.187 1
1 663 . 11 1 1 A 56 56 LYS N N 56 121.800 121.831 -0.031 1
1 664 . 11 1 1 A 57 57 LEU H H 57 8.153 7.767 0.386 1
1 665 . 11 1 1 A 57 57 LEU HA H 57 3.992 4.370 -0.378 1
1 675 . 11 1 1 A 57 57 LEU C C 57 178.400 179.004 -0.604 1
1 676 . 11 1 1 A 57 57 LEU CA C 57 58.190 58.258 -0.068 1
1 677 . 11 1 1 A 57 57 LEU CB C 57 41.360 42.086 -0.726 1
1 681 . 11 1 1 A 57 57 LEU N N 57 120.700 121.128 -0.428 1
1 682 . 11 1 1 A 58 58 GLN H H 58 8.019 8.046 -0.027 1
1 683 . 11 1 1 A 58 58 GLN HA H 58 3.942 4.129 -0.187 1
1 690 . 11 1 1 A 58 58 GLN C C 58 179.100 178.270 0.830 1
1 691 . 11 1 1 A 58 58 GLN CA C 58 59.360 58.341 1.019 1
1 692 . 11 1 1 A 58 58 GLN CB C 58 28.030 28.296 -0.266 1
1 694 . 11 1 1 A 58 58 GLN N N 58 117.400 117.487 -0.087 1
1 696 . 11 1 1 A 59 59 GLU H H 59 7.838 7.980 -0.142 1
1 697 . 11 1 1 A 59 59 GLU HA H 59 4.030 4.106 -0.076 1
1 702 . 11 1 1 A 59 59 GLU C C 59 178.600 179.051 -0.451 1
1 703 . 11 1 1 A 59 59 GLU CA C 59 59.250 58.984 0.266 1
1 704 . 11 1 1 A 59 59 GLU CB C 59 28.960 29.805 -0.845 1
1 706 . 11 1 1 A 59 59 GLU N N 59 119.900 120.327 -0.427 1
1 707 . 11 1 1 A 60 60 MET H H 60 8.223 8.124 0.099 1
1 708 . 11 1 1 A 60 60 MET HA H 60 3.966 4.223 -0.257 1
1 713 . 11 1 1 A 60 60 MET C C 60 177.900 178.509 -0.609 1
1 714 . 11 1 1 A 60 60 MET CA C 60 59.350 57.717 1.633 1
1 715 . 11 1 1 A 60 60 MET CB C 60 33.210 32.290 0.920 1
1 717 . 11 1 1 A 60 60 MET N N 60 120.100 118.827 1.273 1
1 718 . 11 1 1 A 61 61 MET H H 61 8.134 8.390 -0.256 1
1 719 . 11 1 1 A 61 61 MET HA H 61 4.195 4.286 -0.091 1
1 724 . 11 1 1 A 61 61 MET C C 61 179.100 178.484 0.616 1
1 725 . 11 1 1 A 61 61 MET CA C 61 58.210 58.695 -0.485 1
1 726 . 11 1 1 A 61 61 MET CB C 61 31.340 32.211 -0.871 1
1 728 . 11 1 1 A 61 61 MET N N 61 117.000 119.313 -2.313 1
1 729 . 11 1 1 A 62 62 LYS H H 62 7.782 7.795 -0.013 1
1 730 . 11 1 1 A 62 62 LYS HA H 62 4.085 4.145 -0.060 1
1 739 . 11 1 1 A 62 62 LYS C C 62 179.600 179.618 -0.018 1
1 740 . 11 1 1 A 62 62 LYS CA C 62 59.610 59.767 -0.157 1
1 741 . 11 1 1 A 62 62 LYS CB C 62 32.180 32.274 -0.094 1
1 745 . 11 1 1 A 62 62 LYS N N 62 120.600 119.249 1.351 1
1 746 . 11 1 1 A 63 63 GLU H H 63 8.041 8.155 -0.114 1
1 747 . 11 1 1 A 63 63 GLU HA H 63 4.057 4.053 0.004 1
1 752 . 11 1 1 A 63 63 GLU C C 63 178.900 178.997 -0.097 1
1 753 . 11 1 1 A 63 63 GLU CA C 63 59.170 59.022 0.148 1
1 754 . 11 1 1 A 63 63 GLU CB C 63 29.000 28.983 0.017 1
1 756 . 11 1 1 A 63 63 GLU N N 63 120.200 119.576 0.624 1
1 757 . 11 1 1 A 64 64 PHE H H 64 8.604 8.436 0.168 1
1 758 . 11 1 1 A 64 64 PHE HA H 64 4.155 3.833 0.322 1
1 763 . 11 1 1 A 64 64 PHE C C 64 177.800 177.652 0.148 1
1 764 . 11 1 1 A 64 64 PHE CA C 64 59.820 60.918 -1.098 1
1 765 . 11 1 1 A 64 64 PHE CB C 64 38.470 38.498 -0.028 1
1 766 . 11 1 1 A 64 64 PHE N N 64 119.700 120.660 -0.960 1
1 767 . 11 1 1 A 65 65 GLN H H 65 8.177 7.791 0.386 1
1 768 . 11 1 1 A 65 65 GLN HA H 65 3.637 4.191 -0.554 1
1 775 . 11 1 1 A 65 65 GLN C C 65 177.800 177.737 0.063 1
1 776 . 11 1 1 A 65 65 GLN CA C 65 58.970 58.275 0.695 1
1 777 . 11 1 1 A 65 65 GLN CB C 65 28.280 28.856 -0.576 1
1 779 . 11 1 1 A 65 65 GLN N N 65 118.500 118.489 0.011 1
1 781 . 11 1 1 A 66 66 GLN H H 66 7.622 7.882 -0.260 1
1 782 . 11 1 1 A 66 66 GLN HA H 66 4.040 4.289 -0.249 1
1 789 . 11 1 1 A 66 66 GLN C C 66 178.600 178.376 0.224 1
1 790 . 11 1 1 A 66 66 GLN CA C 66 59.150 57.956 1.194 1
1 791 . 11 1 1 A 66 66 GLN CB C 66 28.230 29.340 -1.110 1
1 793 . 11 1 1 A 66 66 GLN N N 66 117.400 118.630 -1.230 1
1 795 . 11 1 1 A 67 67 VAL H H 67 7.744 7.693 0.051 1
1 796 . 11 1 1 A 67 67 VAL HA H 67 3.785 3.641 0.144 1
1 804 . 11 1 1 A 67 67 VAL C C 67 177.500 178.021 -0.521 1
1 805 . 11 1 1 A 67 67 VAL CA C 67 66.220 66.540 -0.320 1
1 806 . 11 1 1 A 67 67 VAL CB C 67 31.390 31.604 -0.214 1
1 809 . 11 1 1 A 67 67 VAL N N 67 119.500 120.236 -0.736 1
1 810 . 11 1 1 A 68 68 LEU H H 68 7.983 7.656 0.327 1
1 811 . 11 1 1 A 68 68 LEU HA H 68 3.825 4.152 -0.327 1
1 821 . 11 1 1 A 68 68 LEU C C 68 179.100 178.052 1.048 1
1 822 . 11 1 1 A 68 68 LEU CA C 68 58.740 57.947 0.793 1
1 823 . 11 1 1 A 68 68 LEU CB C 68 41.090 41.713 -0.623 1
1 827 . 11 1 1 A 68 68 LEU N N 68 120.400 119.740 0.660 1
1 828 . 11 1 1 A 69 69 ASP H H 69 8.179 8.045 0.134 1
1 829 . 11 1 1 A 69 69 ASP HA H 69 4.380 4.441 -0.061 1
1 832 . 11 1 1 A 69 69 ASP C C 69 178.900 178.579 0.321 1
1 833 . 11 1 1 A 69 69 ASP CA C 69 57.320 56.414 0.906 1
1 834 . 11 1 1 A 69 69 ASP CB C 69 40.040 41.273 -1.233 1
1 835 . 11 1 1 A 69 69 ASP N N 69 119.000 119.311 -0.311 1
1 836 . 11 1 1 A 70 70 GLU H H 70 8.166 8.499 -0.333 1
1 837 . 11 1 1 A 70 70 GLU HA H 70 4.082 4.097 -0.015 1
1 842 . 11 1 1 A 70 70 GLU C C 70 179.600 178.968 0.632 1
1 843 . 11 1 1 A 70 70 GLU CA C 70 59.010 59.084 -0.074 1
1 844 . 11 1 1 A 70 70 GLU CB C 70 28.900 29.559 -0.659 1
1 846 . 11 1 1 A 70 70 GLU N N 70 120.500 120.477 0.023 1
1 847 . 11 1 1 A 71 71 ILE H H 71 8.415 7.989 0.426 1
1 848 . 11 1 1 A 71 71 ILE HA H 71 3.790 3.461 0.329 1
1 858 . 11 1 1 A 71 71 ILE C C 71 177.400 177.608 -0.208 1
1 859 . 11 1 1 A 71 71 ILE CA C 71 64.890 64.217 0.673 1
1 860 . 11 1 1 A 71 71 ILE CB C 71 37.680 37.190 0.490 1
1 864 . 11 1 1 A 71 71 ILE N N 71 119.200 120.722 -1.522 1
1 865 . 11 1 1 A 72 72 LYS H H 72 8.248 7.690 0.558 1
1 866 . 11 1 1 A 72 72 LYS HA H 72 3.625 3.361 0.264 1
1 873 . 11 1 1 A 72 72 LYS C C 72 178.400 178.459 -0.059 1
1 874 . 11 1 1 A 72 72 LYS CA C 72 59.850 59.555 0.295 1
1 875 . 11 1 1 A 72 72 LYS CB C 72 32.070 32.305 -0.235 1
1 879 . 11 1 1 A 72 72 LYS N N 72 120.800 121.588 -0.788 1
1 880 . 11 1 1 A 73 73 GLN H H 73 7.937 7.832 0.105 1
1 881 . 11 1 1 A 73 73 GLN HA H 73 4.042 3.990 0.052 1
1 888 . 11 1 1 A 73 73 GLN C C 73 178.400 178.908 -0.508 1
1 889 . 11 1 1 A 73 73 GLN CA C 73 58.510 59.259 -0.749 1
1 890 . 11 1 1 A 73 73 GLN CB C 73 28.430 28.247 0.183 1
1 892 . 11 1 1 A 73 73 GLN N N 73 117.000 118.179 -1.179 1
1 894 . 11 1 1 A 74 74 GLN H H 74 7.712 7.938 -0.226 1
1 895 . 11 1 1 A 74 74 GLN HA H 74 4.080 3.994 0.086 1
1 902 . 11 1 1 A 74 74 GLN C C 74 177.800 178.622 -0.822 1
1 903 . 11 1 1 A 74 74 GLN CA C 74 57.270 58.657 -1.387 1
1 904 . 11 1 1 A 74 74 GLN CB C 74 28.700 27.830 0.870 1
1 906 . 11 1 1 A 74 74 GLN N N 74 118.200 119.251 -1.051 1
1 908 . 11 1 1 A 75 75 LEU H H 75 7.956 7.893 0.063 1
1 909 . 11 1 1 A 75 75 LEU HA H 75 4.212 4.217 -0.005 1
1 919 . 11 1 1 A 75 75 LEU CA C 75 56.660 57.466 -0.806 1
1 920 . 11 1 1 A 75 75 LEU CB C 75 42.000 41.334 0.666 1
1 924 . 11 1 1 A 75 75 LEU N N 75 120.700 119.940 0.760 1
1 925 . 11 1 1 A 76 76 GLN H H 76 8.315 8.076 0.239 1
1 926 . 11 1 1 A 76 76 GLN HA H 76 4.113 4.396 -0.283 1
1 933 . 11 1 1 A 76 76 GLN C C 76 177.100 175.228 1.872 1
1 934 . 11 1 1 A 76 76 GLN CA C 76 57.400 55.616 1.784 1
1 935 . 11 1 1 A 76 76 GLN CB C 76 28.640 26.693 1.947 1
1 937 . 11 1 1 A 76 76 GLN N N 76 120.100 115.957 4.143 1
1 939 . 11 1 1 A 77 77 GLY H H 77 8.021 8.480 -0.459 1
1 940 . 11 1 1 A 77 77 GLY HA2 H 77 4.042 4.204 -0.162 1
1 941 . 11 1 1 A 77 77 GLY HA3 H 77 3.869 4.209 -0.340 1
1 942 . 11 1 1 A 77 77 GLY C C 77 174.600 173.625 0.975 1
1 943 . 11 1 1 A 77 77 GLY CA C 77 45.430 46.201 -0.771 1
1 944 . 11 1 1 A 77 77 GLY N N 77 107.700 107.891 -0.191 1
1 945 . 11 1 1 A 78 78 GLY H H 78 7.819 8.609 -0.790 1
1 946 . 11 1 1 A 78 78 GLY HA2 H 78 4.208 4.033 0.175 1
1 947 . 11 1 1 A 78 78 GLY HA3 H 78 3.801 4.044 -0.243 1
1 948 . 11 1 1 A 78 78 GLY C C 78 173.900 174.253 -0.353 1
1 949 . 11 1 1 A 78 78 GLY CA C 78 45.140 44.935 0.205 1
1 950 . 11 1 1 A 78 78 GLY N N 78 107.100 110.912 -3.812 1
1 951 . 11 1 1 A 79 79 ASP H H 79 7.912 8.291 -0.379 1
1 952 . 11 1 1 A 79 79 ASP HA H 79 4.722 4.656 0.066 1
1 955 . 11 1 1 A 79 79 ASP C C 79 176.200 176.450 -0.250 1
1 956 . 11 1 1 A 79 79 ASP CA C 79 53.210 53.479 -0.269 1
1 957 . 11 1 1 A 79 79 ASP CB C 79 40.160 39.830 0.330 1
1 958 . 11 1 1 A 79 79 ASP N N 79 119.800 119.326 0.474 1
1 959 . 11 1 1 A 80 80 ASN H H 80 8.450 8.373 0.077 1
1 960 . 11 1 1 A 80 80 ASN HA H 80 4.593 4.557 0.036 1
1 965 . 11 1 1 A 80 80 ASN C C 80 177.300 177.263 0.037 1
1 966 . 11 1 1 A 80 80 ASN CA C 80 54.680 55.427 -0.747 1
1 967 . 11 1 1 A 80 80 ASN CB C 80 38.790 38.229 0.561 1
1 968 . 11 1 1 A 80 80 ASN N N 80 121.700 120.657 1.043 1
1 970 . 11 1 1 A 81 81 SER H H 81 8.444 7.797 0.647 1
1 971 . 11 1 1 A 81 81 SER HA H 81 4.263 4.272 -0.009 1
1 974 . 11 1 1 A 81 81 SER C C 81 176.100 176.954 -0.854 1
1 975 . 11 1 1 A 81 81 SER CA C 81 61.470 61.198 0.272 1
1 976 . 11 1 1 A 81 81 SER CB C 81 61.470 62.687 -1.217 1
1 977 . 11 1 1 A 81 81 SER N N 81 117.100 114.721 2.379 1
1 978 . 11 1 1 A 82 82 LEU H H 82 7.929 8.202 -0.273 1
1 979 . 11 1 1 A 82 82 LEU HA H 82 4.332 3.954 0.378 1
1 989 . 11 1 1 A 82 82 LEU C C 82 177.400 178.902 -1.502 1
1 990 . 11 1 1 A 82 82 LEU CA C 82 55.060 57.901 -2.841 1
1 991 . 11 1 1 A 82 82 LEU CB C 82 41.940 41.465 0.475 1
1 995 . 11 1 1 A 82 82 LEU N N 82 120.400 122.070 -1.670 1
1 996 . 11 1 1 A 83 83 HIS H H 83 8.014 7.827 0.187 1
1 997 . 11 1 1 A 83 83 HIS HA H 83 4.173 4.155 0.018 1
1 1000 . 11 1 1 A 83 83 HIS C C 83 176.100 176.577 -0.477 1
1 1001 . 11 1 1 A 83 83 HIS CA C 83 59.940 59.824 0.116 1
1 1002 . 11 1 1 A 83 83 HIS CB C 83 28.050 30.215 -2.165 1
1 1003 . 11 1 1 A 83 83 HIS N N 83 119.400 118.382 1.018 1
1 1004 . 11 1 1 A 84 84 ASN H H 84 8.598 8.593 0.005 1
1 1005 . 11 1 1 A 84 84 ASN HA H 84 4.735 4.698 0.037 1
1 1010 . 11 1 1 A 84 84 ASN C C 84 177.400 177.107 0.293 1
1 1011 . 11 1 1 A 84 84 ASN CA C 84 55.790 55.376 0.414 1
1 1012 . 11 1 1 A 84 84 ASN CB C 84 37.520 38.917 -1.397 1
1 1013 . 11 1 1 A 84 84 ASN N N 84 118.100 117.249 0.851 1
1 1015 . 11 1 1 A 85 85 VAL H H 85 7.933 7.509 0.424 1
1 1016 . 11 1 1 A 85 85 VAL HA H 85 3.849 3.814 0.035 1
1 1024 . 11 1 1 A 85 85 VAL C C 85 177.100 177.945 -0.845 1
1 1025 . 11 1 1 A 85 85 VAL CA C 85 65.490 65.349 0.141 1
1 1026 . 11 1 1 A 85 85 VAL CB C 85 31.760 32.031 -0.271 1
1 1029 . 11 1 1 A 85 85 VAL N N 85 120.500 119.971 0.529 1
1 1030 . 11 1 1 A 86 86 HIS H H 86 8.460 9.389 -0.929 1
1 1031 . 11 1 1 A 86 86 HIS HA H 86 4.054 4.068 -0.014 1
1 1035 . 11 1 1 A 86 86 HIS C C 86 176.300 177.420 -1.120 1
1 1036 . 11 1 1 A 86 86 HIS CA C 86 59.860 59.589 0.271 1
1 1037 . 11 1 1 A 86 86 HIS CB C 86 29.670 30.094 -0.424 1
1 1038 . 11 1 1 A 86 86 HIS N N 86 119.300 119.199 0.101 1
1 1039 . 11 1 1 A 87 87 GLU H H 87 7.897 8.526 -0.629 1
1 1040 . 11 1 1 A 87 87 GLU HA H 87 3.838 3.552 0.286 1
1 1045 . 11 1 1 A 87 87 GLU C C 87 178.300 178.552 -0.252 1
1 1046 . 11 1 1 A 87 87 GLU CA C 87 58.690 58.517 0.173 1
1 1047 . 11 1 1 A 87 87 GLU CB C 87 28.460 28.368 0.092 1
1 1049 . 11 1 1 A 87 87 GLU N N 87 117.100 116.449 0.651 1
1 1050 . 11 1 1 A 88 88 ASN H H 88 8.103 8.577 -0.474 1
1 1051 . 11 1 1 A 88 88 ASN HA H 88 4.503 4.460 0.043 1
1 1056 . 11 1 1 A 88 88 ASN C C 88 177.700 177.866 -0.166 1
1 1057 . 11 1 1 A 88 88 ASN CA C 88 55.990 56.276 -0.286 1
1 1058 . 11 1 1 A 88 88 ASN CB C 88 39.010 38.480 0.530 1
1 1059 . 11 1 1 A 88 88 ASN N N 88 118.400 118.344 0.056 1
1 1061 . 11 1 1 A 89 89 ILE H H 89 8.501 7.710 0.791 1
1 1062 . 11 1 1 A 89 89 ILE HA H 89 3.670 3.719 -0.049 1
1 1072 . 11 1 1 A 89 89 ILE C C 89 177.000 177.794 -0.794 1
1 1073 . 11 1 1 A 89 89 ILE CA C 89 65.390 65.484 -0.094 1
1 1074 . 11 1 1 A 89 89 ILE CB C 89 37.440 37.901 -0.461 1
1 1078 . 11 1 1 A 89 89 ILE N N 89 118.700 119.940 -1.240 1
1 1079 . 11 1 1 A 90 90 LYS H H 90 8.017 8.119 -0.102 1
1 1080 . 11 1 1 A 90 90 LYS HA H 90 3.775 3.874 -0.099 1
1 1089 . 11 1 1 A 90 90 LYS C C 90 178.800 178.797 0.003 1
1 1090 . 11 1 1 A 90 90 LYS CA C 90 60.450 59.848 0.602 1
1 1091 . 11 1 1 A 90 90 LYS CB C 90 32.110 32.323 -0.213 1
1 1095 . 11 1 1 A 90 90 LYS N N 90 120.900 120.282 0.618 1
1 1096 . 11 1 1 A 91 91 GLU H H 91 7.732 7.712 0.020 1
1 1097 . 11 1 1 A 91 91 GLU HA H 91 4.083 3.779 0.304 1
1 1102 . 11 1 1 A 91 91 GLU C C 91 179.100 178.819 0.281 1
1 1103 . 11 1 1 A 91 91 GLU CA C 91 59.120 58.840 0.280 1
1 1104 . 11 1 1 A 91 91 GLU CB C 91 28.810 28.773 0.037 1
1 1106 . 11 1 1 A 91 91 GLU N N 91 119.300 117.826 1.474 1
1 1107 . 11 1 1 A 92 92 ILE H H 92 8.110 8.851 -0.741 1
1 1108 . 11 1 1 A 92 92 ILE HA H 92 3.685 3.710 -0.025 1
1 1118 . 11 1 1 A 92 92 ILE C C 92 178.000 178.099 -0.099 1
1 1119 . 11 1 1 A 92 92 ILE CA C 92 65.900 65.406 0.494 1
1 1120 . 11 1 1 A 92 92 ILE CB C 92 38.400 38.128 0.272 1
1 1124 . 11 1 1 A 92 92 ILE N N 92 121.100 121.768 -0.668 1
1 1125 . 11 1 1 A 93 93 PHE H H 93 8.651 9.354 -0.703 1
1 1126 . 11 1 1 A 93 93 PHE HA H 93 3.873 3.280 0.593 1
1 1133 . 11 1 1 A 93 93 PHE C C 93 177.100 177.934 -0.834 1
1 1134 . 11 1 1 A 93 93 PHE CA C 93 61.020 60.939 0.081 1
1 1135 . 11 1 1 A 93 93 PHE CB C 93 38.560 38.462 0.098 1
1 1138 . 11 1 1 A 93 93 PHE N N 93 119.400 121.189 -1.789 1
1 1139 . 11 1 1 A 94 94 HIS H H 94 8.126 7.269 0.857 1
1 1140 . 11 1 1 A 94 94 HIS HA H 94 4.368 3.928 0.440 1
1 1145 . 11 1 1 A 94 94 HIS C C 94 177.100 176.491 0.609 1
1 1146 . 11 1 1 A 94 94 HIS CA C 94 58.310 57.300 1.010 1
1 1147 . 11 1 1 A 94 94 HIS CB C 94 27.910 29.227 -1.317 1
1 1148 . 11 1 1 A 94 94 HIS N N 94 116.400 117.713 -1.313 1
1 1149 . 11 1 1 A 95 95 HIS H H 95 8.058 7.549 0.509 1
1 1150 . 11 1 1 A 95 95 HIS HA H 95 4.465 4.340 0.125 1
1 1154 . 11 1 1 A 95 95 HIS C C 95 177.300 177.540 -0.240 1
1 1155 . 11 1 1 A 95 95 HIS CA C 95 57.900 59.313 -1.413 1
1 1156 . 11 1 1 A 95 95 HIS CB C 95 28.490 30.330 -1.840 1
1 1157 . 11 1 1 A 95 95 HIS N N 95 117.000 115.724 1.276 1
1 1158 . 11 1 1 A 96 96 LEU H H 96 8.525 7.874 0.651 1
1 1159 . 11 1 1 A 96 96 LEU HA H 96 3.865 3.928 -0.063 1
1 1169 . 11 1 1 A 96 96 LEU C C 96 178.300 178.946 -0.646 1
1 1170 . 11 1 1 A 96 96 LEU CA C 96 58.250 57.959 0.291 1
1 1171 . 11 1 1 A 96 96 LEU CB C 96 41.720 41.907 -0.187 1
1 1175 . 11 1 1 A 96 96 LEU N N 96 121.300 121.308 -0.008 1
1 1176 . 11 1 1 A 97 97 GLU H H 97 8.076 8.306 -0.230 1
1 1177 . 11 1 1 A 97 97 GLU HA H 97 3.719 3.861 -0.142 1
1 1182 . 11 1 1 A 97 97 GLU C C 97 178.300 177.928 0.372 1
1 1183 . 11 1 1 A 97 97 GLU CA C 97 59.300 58.703 0.597 1
1 1184 . 11 1 1 A 97 97 GLU CB C 97 28.960 29.017 -0.057 1
1 1186 . 11 1 1 A 97 97 GLU N N 97 117.100 118.157 -1.057 1
1 1187 . 11 1 1 A 98 98 GLU H H 98 7.329 7.640 -0.311 1
1 1188 . 11 1 1 A 98 98 GLU HA H 98 4.024 3.986 0.038 1
1 1193 . 11 1 1 A 98 98 GLU C C 98 177.900 179.063 -1.163 1
1 1194 . 11 1 1 A 98 98 GLU CA C 98 58.190 58.370 -0.180 1
1 1195 . 11 1 1 A 98 98 GLU CB C 98 29.120 29.832 -0.712 1
1 1197 . 11 1 1 A 98 98 GLU N N 98 116.000 119.928 -3.928 1
1 1198 . 11 1 1 A 99 99 LEU H H 99 7.535 7.916 -0.381 1
1 1199 . 11 1 1 A 99 99 LEU HA H 99 4.183 4.010 0.173 1
1 1209 . 11 1 1 A 99 99 LEU C C 99 178.100 177.391 0.709 1
1 1210 . 11 1 1 A 99 99 LEU CA C 99 56.440 56.408 0.032 1
1 1211 . 11 1 1 A 99 99 LEU CB C 99 43.010 41.162 1.848 1
1 1215 . 11 1 1 A 99 99 LEU N N 99 118.200 119.523 -1.323 1
1 1216 . 11 1 1 A 100 100 VAL H H 100 7.561 6.707 0.854 1
1 1217 . 11 1 1 A 100 100 VAL HA H 100 4.033 4.439 -0.406 1
1 1225 . 11 1 1 A 100 100 VAL C C 100 175.400 177.474 -2.074 1
1 1226 . 11 1 1 A 100 100 VAL CA C 100 62.430 63.074 -0.644 1
1 1227 . 11 1 1 A 100 100 VAL CB C 100 32.050 33.060 -1.010 1
1 1230 . 11 1 1 A 100 100 VAL N N 100 114.800 112.467 2.333 1
1 1231 . 11 1 1 A 101 101 HIS H H 101 7.827 7.794 0.033 1
1 1232 . 11 1 1 A 101 101 HIS HA H 101 4.630 4.497 0.133 1
1 1237 . 11 1 1 A 101 101 HIS C C 101 173.500 176.385 -2.885 1
1 1238 . 11 1 1 A 101 101 HIS CA C 101 55.410 58.650 -3.240 1
1 1239 . 11 1 1 A 101 101 HIS CB C 101 28.870 29.429 -0.559 1
1 1240 . 11 1 1 A 101 101 HIS N N 101 120.300 120.776 -0.476 1
1 10 . 12 1 1 A 2 2 TYR H H 2 8.688 7.326 1.362 1
1 11 . 12 1 1 A 2 2 TYR HA H 2 4.737 4.350 0.387 1
1 16 . 12 1 1 A 2 2 TYR C C 2 175.900 176.464 -0.564 1
1 17 . 12 1 1 A 2 2 TYR CA C 2 57.920 60.130 -2.210 1
1 18 . 12 1 1 A 2 2 TYR CB C 2 38.340 38.467 -0.127 1
1 19 . 12 1 1 A 2 2 TYR N N 2 122.100 125.913 -3.813 1
1 20 . 12 1 1 A 3 3 GLY H H 3 8.434 8.413 0.021 1
1 21 . 12 1 1 A 3 3 GLY HA2 H 3 3.909 4.087 -0.178 1
1 22 . 12 1 1 A 3 3 GLY HA3 H 3 3.841 4.124 -0.283 1
1 23 . 12 1 1 A 3 3 GLY C C 3 174.300 176.012 -1.712 1
1 24 . 12 1 1 A 3 3 GLY CA C 3 46.050 45.435 0.615 1
1 25 . 12 1 1 A 3 3 GLY N N 3 111.100 108.968 2.132 1
1 26 . 12 1 1 A 4 4 LYS H H 4 8.060 8.395 -0.335 1
1 27 . 12 1 1 A 4 4 LYS HA H 4 4.297 4.087 0.210 1
1 36 . 12 1 1 A 4 4 LYS C C 4 178.000 178.915 -0.915 1
1 37 . 12 1 1 A 4 4 LYS CA C 4 56.930 59.410 -2.480 1
1 38 . 12 1 1 A 4 4 LYS CB C 4 32.680 32.372 0.308 1
1 42 . 12 1 1 A 4 4 LYS N N 4 119.500 121.588 -2.088 1
1 43 . 12 1 1 A 5 5 LEU H H 5 8.243 8.201 0.042 1
1 44 . 12 1 1 A 5 5 LEU HA H 5 3.947 3.898 0.049 1
1 54 . 12 1 1 A 5 5 LEU C C 5 177.900 178.900 -1.000 1
1 55 . 12 1 1 A 5 5 LEU CA C 5 57.930 57.885 0.045 1
1 56 . 12 1 1 A 5 5 LEU CB C 5 41.620 41.656 -0.036 1
1 60 . 12 1 1 A 5 5 LEU N N 5 120.800 120.645 0.155 1
1 61 . 12 1 1 A 6 6 ASN H H 6 8.256 8.313 -0.057 1
1 62 . 12 1 1 A 6 6 ASN HA H 6 4.252 4.349 -0.097 1
1 67 . 12 1 1 A 6 6 ASN C C 6 177.300 177.603 -0.303 1
1 68 . 12 1 1 A 6 6 ASN CA C 6 56.900 56.505 0.395 1
1 69 . 12 1 1 A 6 6 ASN CB C 6 38.200 38.224 -0.024 1
1 70 . 12 1 1 A 6 6 ASN N N 6 116.200 117.348 -1.148 1
1 72 . 12 1 1 A 7 7 ASP H H 7 7.699 9.414 -1.715 1
1 73 . 12 1 1 A 7 7 ASP HA H 7 4.320 4.372 -0.052 1
1 76 . 12 1 1 A 7 7 ASP C C 7 178.000 178.635 -0.635 1
1 77 . 12 1 1 A 7 7 ASP CA C 7 56.980 57.275 -0.295 1
1 78 . 12 1 1 A 7 7 ASP CB C 7 39.870 41.250 -1.380 1
1 79 . 12 1 1 A 7 7 ASP N N 7 119.100 119.132 -0.032 1
1 80 . 12 1 1 A 8 8 LEU H H 8 7.580 8.576 -0.996 1
1 81 . 12 1 1 A 8 8 LEU HA H 8 4.091 4.095 -0.004 1
1 91 . 12 1 1 A 8 8 LEU C C 8 178.800 178.919 -0.119 1
1 92 . 12 1 1 A 8 8 LEU CA C 8 57.790 57.838 -0.048 1
1 93 . 12 1 1 A 8 8 LEU CB C 8 41.880 41.511 0.369 1
1 97 . 12 1 1 A 8 8 LEU N N 8 120.400 119.420 0.980 1
1 98 . 12 1 1 A 9 9 LEU H H 9 8.125 9.122 -0.997 1
1 99 . 12 1 1 A 9 9 LEU HA H 9 3.891 3.940 -0.049 1
1 109 . 12 1 1 A 9 9 LEU C C 9 178.900 178.510 0.390 1
1 110 . 12 1 1 A 9 9 LEU CA C 9 58.350 58.560 -0.210 1
1 111 . 12 1 1 A 9 9 LEU CB C 9 41.510 41.954 -0.444 1
1 115 . 12 1 1 A 9 9 LEU N N 9 118.900 120.204 -1.304 1
1 116 . 12 1 1 A 10 10 GLU H H 10 8.011 8.827 -0.816 1
1 117 . 12 1 1 A 10 10 GLU HA H 10 4.072 4.004 0.068 1
1 122 . 12 1 1 A 10 10 GLU C C 10 179.000 179.156 -0.156 1
1 123 . 12 1 1 A 10 10 GLU CA C 10 59.090 59.629 -0.539 1
1 124 . 12 1 1 A 10 10 GLU CB C 10 27.910 29.384 -1.474 1
1 126 . 12 1 1 A 10 10 GLU N N 10 119.300 117.868 1.432 1
1 127 . 12 1 1 A 11 11 ASP H H 11 8.128 7.806 0.322 1
1 128 . 12 1 1 A 11 11 ASP HA H 11 4.383 4.293 0.090 1
1 131 . 12 1 1 A 11 11 ASP C C 11 178.500 178.697 -0.197 1
1 132 . 12 1 1 A 11 11 ASP CA C 11 56.580 57.306 -0.726 1
1 133 . 12 1 1 A 11 11 ASP CB C 11 38.600 40.586 -1.986 1
1 134 . 12 1 1 A 11 11 ASP N N 11 119.600 120.422 -0.822 1
1 135 . 12 1 1 A 12 12 LEU H H 12 8.394 8.405 -0.011 1
1 136 . 12 1 1 A 12 12 LEU HA H 12 3.923 4.091 -0.168 1
1 146 . 12 1 1 A 12 12 LEU C C 12 178.200 178.415 -0.215 1
1 147 . 12 1 1 A 12 12 LEU CA C 12 57.880 58.869 -0.989 1
1 148 . 12 1 1 A 12 12 LEU CB C 12 41.850 41.748 0.102 1
1 152 . 12 1 1 A 12 12 LEU N N 12 120.500 121.284 -0.784 1
1 153 . 12 1 1 A 13 13 GLN H H 13 8.371 9.232 -0.861 1
1 154 . 12 1 1 A 13 13 GLN HA H 13 3.879 4.096 -0.217 1
1 161 . 12 1 1 A 13 13 GLN C C 13 178.600 177.598 1.002 1
1 162 . 12 1 1 A 13 13 GLN CA C 13 59.570 57.871 1.699 1
1 163 . 12 1 1 A 13 13 GLN CB C 13 28.440 27.229 1.211 1
1 165 . 12 1 1 A 13 13 GLN N N 13 118.400 116.919 1.481 1
1 167 . 12 1 1 A 14 14 GLU H H 14 7.913 7.911 0.002 1
1 168 . 12 1 1 A 14 14 GLU HA H 14 4.021 4.315 -0.294 1
1 173 . 12 1 1 A 14 14 GLU C C 14 179.000 178.903 0.097 1
1 174 . 12 1 1 A 14 14 GLU CA C 14 59.030 58.375 0.655 1
1 175 . 12 1 1 A 14 14 GLU CB C 14 28.720 30.269 -1.549 1
1 177 . 12 1 1 A 14 14 GLU N N 14 119.100 118.838 0.262 1
1 178 . 12 1 1 A 15 15 VAL H H 15 7.991 9.605 -1.614 1
1 179 . 12 1 1 A 15 15 VAL HA H 15 3.696 3.942 -0.246 1
1 187 . 12 1 1 A 15 15 VAL C C 15 178.300 177.378 0.922 1
1 188 . 12 1 1 A 15 15 VAL CA C 15 66.640 65.242 1.398 1
1 189 . 12 1 1 A 15 15 VAL CB C 15 31.470 31.718 -0.248 1
1 192 . 12 1 1 A 15 15 VAL N N 15 120.300 121.544 -1.244 1
1 193 . 12 1 1 A 16 16 LEU H H 16 8.172 7.618 0.554 1
1 194 . 12 1 1 A 16 16 LEU HA H 16 3.876 4.272 -0.396 1
1 204 . 12 1 1 A 16 16 LEU C C 16 178.400 178.964 -0.564 1
1 205 . 12 1 1 A 16 16 LEU CA C 16 58.050 56.875 1.175 1
1 206 . 12 1 1 A 16 16 LEU CB C 16 41.420 41.900 -0.480 1
1 210 . 12 1 1 A 16 16 LEU N N 16 119.700 118.576 1.124 1
1 211 . 12 1 1 A 17 17 LYS H H 17 7.755 7.963 -0.208 1
1 212 . 12 1 1 A 17 17 LYS HA H 17 3.951 3.999 -0.048 1
1 221 . 12 1 1 A 17 17 LYS C C 17 178.800 179.077 -0.277 1
1 222 . 12 1 1 A 17 17 LYS CA C 17 59.470 58.993 0.477 1
1 223 . 12 1 1 A 17 17 LYS CB C 17 32.350 32.668 -0.318 1
1 227 . 12 1 1 A 17 17 LYS N N 17 117.800 117.700 0.100 1
1 228 . 12 1 1 A 18 18 HIS H H 18 7.847 8.156 -0.309 1
1 229 . 12 1 1 A 18 18 HIS HA H 18 4.549 4.366 0.183 1
1 233 . 12 1 1 A 18 18 HIS C C 18 177.200 177.569 -0.369 1
1 234 . 12 1 1 A 18 18 HIS CA C 18 57.870 58.965 -1.095 1
1 235 . 12 1 1 A 18 18 HIS CB C 18 28.730 29.450 -0.720 1
1 236 . 12 1 1 A 18 18 HIS N N 18 116.200 118.513 -2.313 1
1 237 . 12 1 1 A 19 19 VAL H H 19 8.415 7.685 0.730 1
1 238 . 12 1 1 A 19 19 VAL HA H 19 3.746 3.792 -0.046 1
1 246 . 12 1 1 A 19 19 VAL CA C 19 65.850 65.664 0.186 1
1 247 . 12 1 1 A 19 19 VAL CB C 19 31.600 31.822 -0.222 1
1 250 . 12 1 1 A 20 20 ASN H H 20 8.041 8.216 -0.175 1
1 251 . 12 1 1 A 20 20 ASN HA H 20 4.545 4.560 -0.015 1
1 256 . 12 1 1 A 20 20 ASN C C 20 176.900 177.405 -0.505 1
1 257 . 12 1 1 A 20 20 ASN CA C 20 55.070 56.433 -1.363 1
1 258 . 12 1 1 A 20 20 ASN CB C 20 38.270 38.033 0.237 1
1 259 . 12 1 1 A 20 20 ASN N N 20 117.900 118.387 -0.487 1
1 261 . 12 1 1 A 21 21 GLN H H 21 7.887 7.362 0.525 1
1 262 . 12 1 1 A 21 21 GLN HA H 21 4.096 4.139 -0.043 1
1 269 . 12 1 1 A 21 21 GLN C C 21 176.900 177.125 -0.225 1
1 270 . 12 1 1 A 21 21 GLN CA C 21 57.510 57.585 -0.075 1
1 271 . 12 1 1 A 21 21 GLN CB C 21 29.100 28.884 0.216 1
1 273 . 12 1 1 A 21 21 GLN N N 21 117.900 119.459 -1.559 1
1 275 . 12 1 1 A 22 22 HIS H H 22 7.887 8.353 -0.466 1
1 276 . 12 1 1 A 22 22 HIS HA H 22 4.679 4.874 -0.195 1
1 280 . 12 1 1 A 22 22 HIS C C 22 174.300 175.180 -0.880 1
1 281 . 12 1 1 A 22 22 HIS CA C 22 55.770 55.736 0.034 1
1 282 . 12 1 1 A 22 22 HIS CB C 22 28.630 30.018 -1.388 1
1 283 . 12 1 1 A 22 22 HIS N N 22 116.100 115.207 0.893 1
1 284 . 12 1 1 A 23 23 TRP H H 23 7.929 7.424 0.505 1
1 285 . 12 1 1 A 23 23 TRP HA H 23 4.542 4.600 -0.058 1
1 292 . 12 1 1 A 23 23 TRP C C 23 176.600 175.444 1.156 1
1 293 . 12 1 1 A 23 23 TRP CA C 23 58.020 58.605 -0.585 1
1 294 . 12 1 1 A 23 23 TRP CB C 23 29.700 30.442 -0.742 1
1 295 . 12 1 1 A 23 23 TRP N N 23 122.000 123.678 -1.678 1
1 297 . 12 1 1 A 24 24 GLN H H 24 8.258 7.721 0.537 1
1 298 . 12 1 1 A 24 24 GLN HA H 24 4.329 4.760 -0.431 1
1 305 . 12 1 1 A 24 24 GLN C C 24 176.200 176.014 0.186 1
1 306 . 12 1 1 A 24 24 GLN CA C 24 55.960 54.900 1.060 1
1 307 . 12 1 1 A 24 24 GLN CB C 24 29.440 31.594 -2.154 1
1 309 . 12 1 1 A 24 24 GLN N N 24 123.800 125.583 -1.783 1
1 311 . 12 1 1 A 25 25 GLY H H 25 7.470 8.691 -1.221 1
1 312 . 12 1 1 A 25 25 GLY HA2 H 25 3.939 3.869 0.070 1
1 313 . 12 1 1 A 25 25 GLY HA3 H 25 3.800 3.874 -0.074 1
1 314 . 12 1 1 A 25 25 GLY C C 25 174.800 174.918 -0.118 1
1 315 . 12 1 1 A 25 25 GLY CA C 25 45.470 47.243 -1.773 1
1 316 . 12 1 1 A 25 25 GLY N N 25 108.100 108.987 -0.887 1
1 317 . 12 1 1 A 26 26 GLY H H 26 8.332 8.727 -0.395 1
1 318 . 12 1 1 A 26 26 GLY HA2 H 26 4.105 4.122 -0.017 1
1 319 . 12 1 1 A 26 26 GLY HA3 H 26 3.974 4.170 -0.196 1
1 320 . 12 1 1 A 26 26 GLY C C 26 174.900 174.379 0.521 1
1 321 . 12 1 1 A 26 26 GLY CA C 26 45.410 45.667 -0.257 1
1 322 . 12 1 1 A 26 26 GLY N N 26 108.700 112.069 -3.369 1
1 323 . 12 1 1 A 27 27 GLN H H 27 8.474 8.746 -0.272 1
1 324 . 12 1 1 A 27 27 GLN HA H 27 4.106 4.082 0.024 1
1 331 . 12 1 1 A 27 27 GLN C C 27 177.100 176.748 0.352 1
1 332 . 12 1 1 A 27 27 GLN CA C 27 57.540 57.311 0.229 1
1 333 . 12 1 1 A 27 27 GLN CB C 27 29.050 28.846 0.204 1
1 335 . 12 1 1 A 27 27 GLN N N 27 121.100 125.024 -3.924 1
1 337 . 12 1 1 A 28 28 LYS H H 28 8.448 8.176 0.272 1
1 338 . 12 1 1 A 28 28 LYS HA H 28 4.068 4.035 0.033 1
1 347 . 12 1 1 A 28 28 LYS C C 28 177.900 178.238 -0.338 1
1 348 . 12 1 1 A 28 28 LYS CA C 28 58.410 58.983 -0.573 1
1 349 . 12 1 1 A 28 28 LYS CB C 28 32.210 32.498 -0.288 1
1 353 . 12 1 1 A 28 28 LYS N N 28 120.500 117.701 2.799 1
1 354 . 12 1 1 A 29 29 ASN H H 29 8.273 8.060 0.213 1
1 355 . 12 1 1 A 29 29 ASN HA H 29 4.584 4.611 -0.027 1
1 360 . 12 1 1 A 29 29 ASN C C 29 176.200 177.609 -1.409 1
1 361 . 12 1 1 A 29 29 ASN CA C 29 54.400 55.406 -1.006 1
1 362 . 12 1 1 A 29 29 ASN CB C 29 38.280 38.229 0.051 1
1 363 . 12 1 1 A 29 29 ASN N N 29 117.500 118.295 -0.795 1
1 365 . 12 1 1 A 30 30 MET H H 30 7.870 7.752 0.118 1
1 366 . 12 1 1 A 30 30 MET HA H 30 4.085 2.584 1.501 1
1 371 . 12 1 1 A 30 30 MET C C 30 177.000 178.083 -1.083 1
1 372 . 12 1 1 A 30 30 MET CA C 30 56.880 57.374 -0.494 1
1 373 . 12 1 1 A 30 30 MET CB C 30 32.340 31.404 0.936 1
1 375 . 12 1 1 A 30 30 MET N N 30 121.100 117.172 3.928 1
1 376 . 12 1 1 A 31 31 ASN H H 31 8.186 7.051 1.135 1
1 377 . 12 1 1 A 31 31 ASN HA H 31 4.311 4.505 -0.194 1
1 382 . 12 1 1 A 31 31 ASN C C 31 176.700 177.693 -0.993 1
1 383 . 12 1 1 A 31 31 ASN CA C 31 55.320 55.451 -0.131 1
1 384 . 12 1 1 A 31 31 ASN CB C 31 38.410 38.564 -0.154 1
1 385 . 12 1 1 A 31 31 ASN N N 31 117.900 119.454 -1.554 1
1 387 . 12 1 1 A 32 32 LYS H H 32 7.792 7.226 0.566 1
1 388 . 12 1 1 A 32 32 LYS HA H 32 3.992 4.046 -0.054 1
1 397 . 12 1 1 A 32 32 LYS C C 32 177.900 179.046 -1.146 1
1 398 . 12 1 1 A 32 32 LYS CA C 32 59.050 59.447 -0.397 1
1 399 . 12 1 1 A 32 32 LYS CB C 32 32.460 32.419 0.041 1
1 403 . 12 1 1 A 32 32 LYS N N 32 120.400 118.754 1.646 1
1 404 . 12 1 1 A 33 33 VAL H H 33 7.689 8.026 -0.337 1
1 405 . 12 1 1 A 33 33 VAL HA H 33 3.791 3.954 -0.163 1
1 413 . 12 1 1 A 33 33 VAL C C 33 177.100 177.515 -0.415 1
1 414 . 12 1 1 A 33 33 VAL CA C 33 65.360 65.332 0.028 1
1 415 . 12 1 1 A 33 33 VAL CB C 33 31.920 31.586 0.334 1
1 418 . 12 1 1 A 33 33 VAL N N 33 120.200 116.051 4.149 1
1 419 . 12 1 1 A 34 34 ASP H H 34 8.408 8.013 0.395 1
1 420 . 12 1 1 A 34 34 ASP HA H 34 4.303 4.334 -0.031 1
1 423 . 12 1 1 A 34 34 ASP C C 34 178.200 178.119 0.081 1
1 424 . 12 1 1 A 34 34 ASP CA C 34 55.880 57.098 -1.218 1
1 425 . 12 1 1 A 34 34 ASP CB C 34 38.710 41.441 -2.731 1
1 426 . 12 1 1 A 34 34 ASP N N 34 120.100 121.946 -1.846 1
1 427 . 12 1 1 A 35 35 HIS H H 35 8.204 8.055 0.149 1
1 428 . 12 1 1 A 35 35 HIS HA H 35 4.343 4.192 0.151 1
1 431 . 12 1 1 A 35 35 HIS C C 35 176.800 177.035 -0.235 1
1 432 . 12 1 1 A 35 35 HIS CA C 35 58.310 58.303 0.007 1
1 433 . 12 1 1 A 35 35 HIS CB C 35 28.070 30.148 -2.078 1
1 434 . 12 1 1 A 35 35 HIS N N 35 118.200 119.479 -1.279 1
1 435 . 12 1 1 A 36 36 HIS H H 36 8.067 8.483 -0.416 1
1 436 . 12 1 1 A 36 36 HIS HA H 36 4.602 4.109 0.493 1
1 440 . 12 1 1 A 36 36 HIS C C 36 177.100 177.634 -0.534 1
1 441 . 12 1 1 A 36 36 HIS CA C 36 58.520 59.750 -1.230 1
1 442 . 12 1 1 A 36 36 HIS CB C 36 28.720 29.952 -1.232 1
1 443 . 12 1 1 A 36 36 HIS N N 36 117.100 117.053 0.047 1
1 444 . 12 1 1 A 37 37 LEU H H 37 8.473 8.525 -0.052 1
1 445 . 12 1 1 A 37 37 LEU HA H 37 3.894 3.618 0.276 1
1 455 . 12 1 1 A 37 37 LEU C C 37 178.200 178.906 -0.706 1
1 456 . 12 1 1 A 37 37 LEU CA C 37 58.520 57.760 0.760 1
1 457 . 12 1 1 A 37 37 LEU CB C 37 41.810 41.309 0.501 1
1 461 . 12 1 1 A 37 37 LEU N N 37 119.600 119.593 0.007 1
1 462 . 12 1 1 A 38 38 GLN H H 38 8.337 8.220 0.117 1
1 463 . 12 1 1 A 38 38 GLN HA H 38 3.882 3.956 -0.074 1
1 470 . 12 1 1 A 38 38 GLN C C 38 178.500 177.964 0.536 1
1 471 . 12 1 1 A 38 38 GLN CA C 38 59.200 59.395 -0.195 1
1 472 . 12 1 1 A 38 38 GLN CB C 38 27.850 28.225 -0.375 1
1 474 . 12 1 1 A 38 38 GLN N N 38 118.000 117.339 0.661 1
1 476 . 12 1 1 A 39 39 ASN H H 39 7.923 7.757 0.166 1
1 477 . 12 1 1 A 39 39 ASN HA H 39 4.390 4.555 -0.165 1
1 482 . 12 1 1 A 39 39 ASN C C 39 177.500 178.107 -0.607 1
1 483 . 12 1 1 A 39 39 ASN CA C 39 55.780 56.033 -0.253 1
1 484 . 12 1 1 A 39 39 ASN CB C 39 37.450 38.112 -0.662 1
1 485 . 12 1 1 A 39 39 ASN N N 39 118.700 118.027 0.673 1
1 487 . 12 1 1 A 40 40 VAL H H 40 7.907 7.829 0.078 1
1 488 . 12 1 1 A 40 40 VAL HA H 40 3.629 3.508 0.121 1
1 496 . 12 1 1 A 40 40 VAL C C 40 177.500 177.789 -0.289 1
1 497 . 12 1 1 A 40 40 VAL CA C 40 67.080 66.489 0.591 1
1 498 . 12 1 1 A 40 40 VAL CB C 40 31.390 31.374 0.016 1
1 501 . 12 1 1 A 40 40 VAL N N 40 120.400 120.432 -0.032 1
1 502 . 12 1 1 A 41 41 ILE H H 41 8.103 8.153 -0.050 1
1 503 . 12 1 1 A 41 41 ILE HA H 41 3.401 3.631 -0.230 1
1 513 . 12 1 1 A 41 41 ILE C C 41 178.000 178.555 -0.555 1
1 514 . 12 1 1 A 41 41 ILE CA C 41 66.430 65.243 1.187 1
1 515 . 12 1 1 A 41 41 ILE CB C 41 38.050 37.648 0.402 1
1 519 . 12 1 1 A 41 41 ILE N N 41 120.600 119.365 1.235 1
1 520 . 12 1 1 A 42 42 GLU H H 42 8.150 8.088 0.062 1
1 521 . 12 1 1 A 42 42 GLU HA H 42 4.062 4.126 -0.064 1
1 526 . 12 1 1 A 42 42 GLU C C 42 178.500 178.496 0.004 1
1 527 . 12 1 1 A 42 42 GLU CA C 42 59.120 59.239 -0.119 1
1 528 . 12 1 1 A 42 42 GLU CB C 42 28.160 29.313 -1.153 1
1 530 . 12 1 1 A 42 42 GLU N N 42 119.900 121.904 -2.004 1
1 531 . 12 1 1 A 43 43 ASP H H 43 8.453 8.999 -0.546 1
1 532 . 12 1 1 A 43 43 ASP HA H 43 4.445 4.453 -0.008 1
1 535 . 12 1 1 A 43 43 ASP C C 43 178.400 178.393 0.007 1
1 536 . 12 1 1 A 43 43 ASP CA C 43 56.490 57.746 -1.256 1
1 537 . 12 1 1 A 43 43 ASP CB C 43 37.820 41.506 -3.686 1
1 538 . 12 1 1 A 43 43 ASP N N 43 119.700 120.135 -0.435 1
1 539 . 12 1 1 A 44 44 ILE H H 44 8.544 7.898 0.646 1
1 540 . 12 1 1 A 44 44 ILE HA H 44 3.590 3.831 -0.241 1
1 550 . 12 1 1 A 44 44 ILE C C 44 177.800 178.134 -0.334 1
1 551 . 12 1 1 A 44 44 ILE CA C 44 66.320 65.523 0.797 1
1 552 . 12 1 1 A 44 44 ILE CB C 44 37.690 37.912 -0.222 1
1 556 . 12 1 1 A 44 44 ILE N N 44 121.500 119.511 1.989 1
1 557 . 12 1 1 A 45 45 HIS H H 45 8.261 8.197 0.064 1
1 558 . 12 1 1 A 45 45 HIS HA H 45 4.255 4.246 0.009 1
1 562 . 12 1 1 A 45 45 HIS C C 45 177.200 176.187 1.013 1
1 563 . 12 1 1 A 45 45 HIS CA C 45 59.580 59.892 -0.312 1
1 564 . 12 1 1 A 45 45 HIS CB C 45 27.790 30.128 -2.338 1
1 565 . 12 1 1 A 45 45 HIS N N 45 118.800 119.845 -1.045 1
1 566 . 12 1 1 A 46 46 ASP H H 46 8.680 8.800 -0.120 1
1 567 . 12 1 1 A 46 46 ASP HA H 46 4.338 4.523 -0.185 1
1 570 . 12 1 1 A 46 46 ASP C C 46 178.700 177.067 1.633 1
1 571 . 12 1 1 A 46 46 ASP CA C 46 57.010 54.781 2.229 1
1 572 . 12 1 1 A 46 46 ASP CB C 46 39.400 40.912 -1.512 1
1 573 . 12 1 1 A 46 46 ASP N N 46 119.200 119.124 0.076 1
1 574 . 12 1 1 A 47 47 PHE H H 47 8.380 9.353 -0.973 1
1 575 . 12 1 1 A 47 47 PHE HA H 47 4.070 4.299 -0.229 1
1 580 . 12 1 1 A 47 47 PHE C C 47 178.600 177.191 1.409 1
1 581 . 12 1 1 A 47 47 PHE CA C 47 61.250 59.975 1.275 1
1 582 . 12 1 1 A 47 47 PHE CB C 47 39.570 39.942 -0.372 1
1 583 . 12 1 1 A 47 47 PHE N N 47 121.800 121.147 0.653 1
1 584 . 12 1 1 A 48 48 MET H H 48 8.366 7.935 0.431 1
1 585 . 12 1 1 A 48 48 MET HA H 48 3.998 4.656 -0.658 1
1 590 . 12 1 1 A 48 48 MET C C 48 177.400 177.528 -0.128 1
1 591 . 12 1 1 A 48 48 MET CA C 48 58.470 57.156 1.314 1
1 592 . 12 1 1 A 48 48 MET CB C 48 33.170 33.095 0.075 1
1 594 . 12 1 1 A 48 48 MET N N 48 117.700 117.441 0.259 1
1 595 . 12 1 1 A 49 49 GLN H H 49 7.659 8.299 -0.640 1
1 596 . 12 1 1 A 49 49 GLN HA H 49 4.258 4.476 -0.218 1
1 603 . 12 1 1 A 49 49 GLN C C 49 176.700 178.407 -1.707 1
1 604 . 12 1 1 A 49 49 GLN CA C 49 56.380 57.872 -1.492 1
1 605 . 12 1 1 A 49 49 GLN CB C 49 28.980 30.019 -1.039 1
1 607 . 12 1 1 A 49 49 GLN N N 49 116.700 118.154 -1.454 1
1 609 . 12 1 1 A 50 50 GLY H H 50 7.685 8.331 -0.646 1
1 610 . 12 1 1 A 50 50 GLY HA2 H 50 3.998 3.795 0.203 1
1 611 . 12 1 1 A 50 50 GLY HA3 H 50 3.998 3.836 0.162 1
1 612 . 12 1 1 A 50 50 GLY C C 50 174.900 175.100 -0.200 1
1 613 . 12 1 1 A 50 50 GLY CA C 50 45.460 46.251 -0.791 1
1 614 . 12 1 1 A 50 50 GLY N N 50 106.400 108.716 -2.316 1
1 615 . 12 1 1 A 51 51 GLY H H 51 8.031 9.106 -1.075 1
1 616 . 12 1 1 A 51 51 GLY HA2 H 51 3.817 3.859 -0.042 1
1 617 . 12 1 1 A 51 51 GLY HA3 H 51 3.817 3.872 -0.055 1
1 618 . 12 1 1 A 51 51 GLY C C 51 174.500 174.232 0.268 1
1 619 . 12 1 1 A 51 51 GLY CA C 51 45.190 45.456 -0.266 1
1 620 . 12 1 1 A 51 51 GLY N N 51 108.900 109.690 -0.790 1
1 621 . 12 1 1 A 52 52 GLY H H 52 8.126 8.275 -0.149 1
1 622 . 12 1 1 A 52 52 GLY HA2 H 52 3.362 3.713 -0.351 1
1 623 . 12 1 1 A 52 52 GLY HA3 H 52 3.362 4.012 -0.650 1
1 624 . 12 1 1 A 52 52 GLY C C 52 173.300 174.110 -0.810 1
1 625 . 12 1 1 A 52 52 GLY CA C 52 45.120 45.301 -0.181 1
1 626 . 12 1 1 A 52 52 GLY N N 52 108.100 109.266 -1.166 1
1 627 . 12 1 1 A 53 53 SER H H 53 7.594 7.944 -0.350 1
1 628 . 12 1 1 A 53 53 SER HA H 53 4.530 4.762 -0.232 1
1 631 . 12 1 1 A 53 53 SER C C 53 175.300 175.424 -0.124 1
1 632 . 12 1 1 A 53 53 SER CA C 53 57.770 57.646 0.124 1
1 633 . 12 1 1 A 53 53 SER CB C 53 64.750 62.675 2.075 1
1 634 . 12 1 1 A 53 53 SER N N 53 114.100 115.653 -1.553 1
1 635 . 12 1 1 A 54 54 GLY H H 54 9.003 8.489 0.514 1
1 636 . 12 1 1 A 54 54 GLY HA2 H 54 4.037 4.029 0.008 1
1 637 . 12 1 1 A 54 54 GLY HA3 H 54 3.911 4.152 -0.241 1
1 638 . 12 1 1 A 54 54 GLY C C 54 176.500 175.466 1.034 1
1 639 . 12 1 1 A 54 54 GLY CA C 54 47.040 46.998 0.042 1
1 640 . 12 1 1 A 54 54 GLY N N 54 110.400 110.174 0.226 1
1 641 . 12 1 1 A 55 55 GLY H H 55 8.617 8.187 0.430 1
1 642 . 12 1 1 A 55 55 GLY HA2 H 55 3.946 3.844 0.102 1
1 643 . 12 1 1 A 55 55 GLY HA3 H 55 3.946 3.856 0.090 1
1 644 . 12 1 1 A 55 55 GLY C C 55 176.400 175.601 0.799 1
1 645 . 12 1 1 A 55 55 GLY CA C 55 46.630 47.059 -0.429 1
1 646 . 12 1 1 A 55 55 GLY N N 55 109.800 109.602 0.198 1
1 647 . 12 1 1 A 56 56 LYS H H 56 7.876 8.544 -0.668 1
1 648 . 12 1 1 A 56 56 LYS HA H 56 4.195 4.228 -0.033 1
1 657 . 12 1 1 A 56 56 LYS C C 56 178.600 178.792 -0.192 1
1 658 . 12 1 1 A 56 56 LYS CA C 56 57.960 58.538 -0.578 1
1 659 . 12 1 1 A 56 56 LYS CB C 56 32.110 31.773 0.337 1
1 663 . 12 1 1 A 56 56 LYS N N 56 121.800 121.808 -0.008 1
1 664 . 12 1 1 A 57 57 LEU H H 57 8.153 8.009 0.144 1
1 665 . 12 1 1 A 57 57 LEU HA H 57 3.992 4.119 -0.127 1
1 675 . 12 1 1 A 57 57 LEU C C 57 178.400 178.728 -0.328 1
1 676 . 12 1 1 A 57 57 LEU CA C 57 58.190 58.468 -0.278 1
1 677 . 12 1 1 A 57 57 LEU CB C 57 41.360 42.136 -0.776 1
1 681 . 12 1 1 A 57 57 LEU N N 57 120.700 121.435 -0.735 1
1 682 . 12 1 1 A 58 58 GLN H H 58 8.019 8.410 -0.391 1
1 683 . 12 1 1 A 58 58 GLN HA H 58 3.942 4.120 -0.178 1
1 690 . 12 1 1 A 58 58 GLN C C 58 179.100 178.188 0.912 1
1 691 . 12 1 1 A 58 58 GLN CA C 58 59.360 58.367 0.993 1
1 692 . 12 1 1 A 58 58 GLN CB C 58 28.030 28.348 -0.318 1
1 694 . 12 1 1 A 58 58 GLN N N 58 117.400 117.508 -0.108 1
1 696 . 12 1 1 A 59 59 GLU H H 59 7.838 7.898 -0.060 1
1 697 . 12 1 1 A 59 59 GLU HA H 59 4.030 4.221 -0.191 1
1 702 . 12 1 1 A 59 59 GLU C C 59 178.600 179.082 -0.482 1
1 703 . 12 1 1 A 59 59 GLU CA C 59 59.250 59.028 0.222 1
1 704 . 12 1 1 A 59 59 GLU CB C 59 28.960 30.032 -1.072 1
1 706 . 12 1 1 A 59 59 GLU N N 59 119.900 120.284 -0.384 1
1 707 . 12 1 1 A 60 60 MET H H 60 8.223 8.133 0.090 1
1 708 . 12 1 1 A 60 60 MET HA H 60 3.966 4.271 -0.305 1
1 713 . 12 1 1 A 60 60 MET C C 60 177.900 178.578 -0.678 1
1 714 . 12 1 1 A 60 60 MET CA C 60 59.350 57.803 1.547 1
1 715 . 12 1 1 A 60 60 MET CB C 60 33.210 32.333 0.877 1
1 717 . 12 1 1 A 60 60 MET N N 60 120.100 118.807 1.293 1
1 718 . 12 1 1 A 61 61 MET H H 61 8.134 8.619 -0.485 1
1 719 . 12 1 1 A 61 61 MET HA H 61 4.195 4.531 -0.336 1
1 724 . 12 1 1 A 61 61 MET C C 61 179.100 178.531 0.569 1
1 725 . 12 1 1 A 61 61 MET CA C 61 58.210 58.505 -0.295 1
1 726 . 12 1 1 A 61 61 MET CB C 61 31.340 32.764 -1.424 1
1 728 . 12 1 1 A 61 61 MET N N 61 117.000 119.938 -2.938 1
1 729 . 12 1 1 A 62 62 LYS H H 62 7.782 7.808 -0.026 1
1 730 . 12 1 1 A 62 62 LYS HA H 62 4.085 3.953 0.132 1
1 739 . 12 1 1 A 62 62 LYS C C 62 179.600 179.731 -0.131 1
1 740 . 12 1 1 A 62 62 LYS CA C 62 59.610 59.769 -0.159 1
1 741 . 12 1 1 A 62 62 LYS CB C 62 32.180 32.254 -0.074 1
1 745 . 12 1 1 A 62 62 LYS N N 62 120.600 120.815 -0.215 1
1 746 . 12 1 1 A 63 63 GLU H H 63 8.041 8.119 -0.078 1
1 747 . 12 1 1 A 63 63 GLU HA H 63 4.057 4.140 -0.083 1
1 752 . 12 1 1 A 63 63 GLU C C 63 178.900 178.711 0.189 1
1 753 . 12 1 1 A 63 63 GLU CA C 63 59.170 59.176 -0.006 1
1 754 . 12 1 1 A 63 63 GLU CB C 63 29.000 29.328 -0.328 1
1 756 . 12 1 1 A 63 63 GLU N N 63 120.200 119.254 0.946 1
1 757 . 12 1 1 A 64 64 PHE H H 64 8.604 8.595 0.009 1
1 758 . 12 1 1 A 64 64 PHE HA H 64 4.155 3.887 0.268 1
1 763 . 12 1 1 A 64 64 PHE C C 64 177.800 177.709 0.091 1
1 764 . 12 1 1 A 64 64 PHE CA C 64 59.820 60.918 -1.098 1
1 765 . 12 1 1 A 64 64 PHE CB C 64 38.470 38.584 -0.114 1
1 766 . 12 1 1 A 64 64 PHE N N 64 119.700 122.170 -2.470 1
1 767 . 12 1 1 A 65 65 GLN H H 65 8.177 8.812 -0.635 1
1 768 . 12 1 1 A 65 65 GLN HA H 65 3.637 3.908 -0.271 1
1 775 . 12 1 1 A 65 65 GLN C C 65 177.800 177.257 0.543 1
1 776 . 12 1 1 A 65 65 GLN CA C 65 58.970 57.887 1.083 1
1 777 . 12 1 1 A 65 65 GLN CB C 65 28.280 28.468 -0.188 1
1 779 . 12 1 1 A 65 65 GLN N N 65 118.500 118.537 -0.037 1
1 781 . 12 1 1 A 66 66 GLN H H 66 7.622 7.543 0.079 1
1 782 . 12 1 1 A 66 66 GLN HA H 66 4.040 4.183 -0.143 1
1 789 . 12 1 1 A 66 66 GLN C C 66 178.600 177.913 0.687 1
1 790 . 12 1 1 A 66 66 GLN CA C 66 59.150 57.375 1.775 1
1 791 . 12 1 1 A 66 66 GLN CB C 66 28.230 28.964 -0.734 1
1 793 . 12 1 1 A 66 66 GLN N N 66 117.400 118.550 -1.150 1
1 795 . 12 1 1 A 67 67 VAL H H 67 7.744 7.556 0.188 1
1 796 . 12 1 1 A 67 67 VAL HA H 67 3.785 3.645 0.140 1
1 804 . 12 1 1 A 67 67 VAL C C 67 177.500 178.030 -0.530 1
1 805 . 12 1 1 A 67 67 VAL CA C 67 66.220 66.004 0.216 1
1 806 . 12 1 1 A 67 67 VAL CB C 67 31.390 31.751 -0.361 1
1 809 . 12 1 1 A 67 67 VAL N N 67 119.500 120.515 -1.015 1
1 810 . 12 1 1 A 68 68 LEU H H 68 7.983 7.677 0.306 1
1 811 . 12 1 1 A 68 68 LEU HA H 68 3.825 4.228 -0.403 1
1 821 . 12 1 1 A 68 68 LEU C C 68 179.100 178.112 0.988 1
1 822 . 12 1 1 A 68 68 LEU CA C 68 58.740 57.966 0.774 1
1 823 . 12 1 1 A 68 68 LEU CB C 68 41.090 41.837 -0.747 1
1 827 . 12 1 1 A 68 68 LEU N N 68 120.400 119.344 1.056 1
1 828 . 12 1 1 A 69 69 ASP H H 69 8.179 8.145 0.034 1
1 829 . 12 1 1 A 69 69 ASP HA H 69 4.380 4.310 0.070 1
1 832 . 12 1 1 A 69 69 ASP C C 69 178.900 178.070 0.830 1
1 833 . 12 1 1 A 69 69 ASP CA C 69 57.320 57.116 0.204 1
1 834 . 12 1 1 A 69 69 ASP CB C 69 40.040 40.949 -0.909 1
1 835 . 12 1 1 A 69 69 ASP N N 69 119.000 119.703 -0.703 1
1 836 . 12 1 1 A 70 70 GLU H H 70 8.166 8.049 0.117 1
1 837 . 12 1 1 A 70 70 GLU HA H 70 4.082 4.033 0.049 1
1 842 . 12 1 1 A 70 70 GLU C C 70 179.600 178.821 0.779 1
1 843 . 12 1 1 A 70 70 GLU CA C 70 59.010 59.086 -0.076 1
1 844 . 12 1 1 A 70 70 GLU CB C 70 28.900 29.521 -0.621 1
1 846 . 12 1 1 A 70 70 GLU N N 70 120.500 119.403 1.097 1
1 847 . 12 1 1 A 71 71 ILE H H 71 8.415 7.833 0.582 1
1 848 . 12 1 1 A 71 71 ILE HA H 71 3.790 3.419 0.371 1
1 858 . 12 1 1 A 71 71 ILE C C 71 177.400 177.518 -0.118 1
1 859 . 12 1 1 A 71 71 ILE CA C 71 64.890 64.541 0.349 1
1 860 . 12 1 1 A 71 71 ILE CB C 71 37.680 37.141 0.539 1
1 864 . 12 1 1 A 71 71 ILE N N 71 119.200 120.320 -1.120 1
1 865 . 12 1 1 A 72 72 LYS H H 72 8.248 7.547 0.701 1
1 866 . 12 1 1 A 72 72 LYS HA H 72 3.625 3.277 0.348 1
1 873 . 12 1 1 A 72 72 LYS C C 72 178.400 178.478 -0.078 1
1 874 . 12 1 1 A 72 72 LYS CA C 72 59.850 59.178 0.672 1
1 875 . 12 1 1 A 72 72 LYS CB C 72 32.070 32.068 0.002 1
1 879 . 12 1 1 A 72 72 LYS N N 72 120.800 121.981 -1.181 1
1 880 . 12 1 1 A 73 73 GLN H H 73 7.937 7.326 0.611 1
1 881 . 12 1 1 A 73 73 GLN HA H 73 4.042 3.871 0.171 1
1 888 . 12 1 1 A 73 73 GLN C C 73 178.400 177.829 0.571 1
1 889 . 12 1 1 A 73 73 GLN CA C 73 58.510 59.166 -0.656 1
1 890 . 12 1 1 A 73 73 GLN CB C 73 28.430 28.245 0.185 1
1 892 . 12 1 1 A 73 73 GLN N N 73 117.000 117.986 -0.986 1
1 894 . 12 1 1 A 74 74 GLN H H 74 7.712 8.050 -0.338 1
1 895 . 12 1 1 A 74 74 GLN HA H 74 4.080 3.878 0.202 1
1 902 . 12 1 1 A 74 74 GLN C C 74 177.800 178.147 -0.347 1
1 903 . 12 1 1 A 74 74 GLN CA C 74 57.270 58.534 -1.264 1
1 904 . 12 1 1 A 74 74 GLN CB C 74 28.700 27.653 1.047 1
1 906 . 12 1 1 A 74 74 GLN N N 74 118.200 119.673 -1.473 1
1 908 . 12 1 1 A 75 75 LEU H H 75 7.956 7.528 0.428 1
1 909 . 12 1 1 A 75 75 LEU HA H 75 4.212 4.485 -0.273 1
1 919 . 12 1 1 A 75 75 LEU CA C 75 56.660 54.724 1.936 1
1 920 . 12 1 1 A 75 75 LEU CB C 75 42.000 40.697 1.303 1
1 924 . 12 1 1 A 75 75 LEU N N 75 120.700 118.917 1.783 1
1 925 . 12 1 1 A 76 76 GLN H H 76 8.315 8.613 -0.298 1
1 926 . 12 1 1 A 76 76 GLN HA H 76 4.113 4.219 -0.106 1
1 933 . 12 1 1 A 76 76 GLN C C 76 177.100 176.250 0.850 1
1 934 . 12 1 1 A 76 76 GLN CA C 76 57.400 56.717 0.683 1
1 935 . 12 1 1 A 76 76 GLN CB C 76 28.640 29.706 -1.066 1
1 937 . 12 1 1 A 76 76 GLN N N 76 120.100 119.608 0.492 1
1 939 . 12 1 1 A 77 77 GLY H H 77 8.021 7.353 0.668 1
1 940 . 12 1 1 A 77 77 GLY HA2 H 77 4.042 4.073 -0.031 1
1 941 . 12 1 1 A 77 77 GLY HA3 H 77 3.869 4.081 -0.212 1
1 942 . 12 1 1 A 77 77 GLY C C 77 174.600 173.749 0.851 1
1 943 . 12 1 1 A 77 77 GLY CA C 77 45.430 45.436 -0.006 1
1 944 . 12 1 1 A 77 77 GLY N N 77 107.700 106.850 0.850 1
1 945 . 12 1 1 A 78 78 GLY H H 78 7.819 8.453 -0.634 1
1 946 . 12 1 1 A 78 78 GLY HA2 H 78 4.208 4.040 0.168 1
1 947 . 12 1 1 A 78 78 GLY HA3 H 78 3.801 4.045 -0.244 1
1 948 . 12 1 1 A 78 78 GLY C C 78 173.900 173.864 0.036 1
1 949 . 12 1 1 A 78 78 GLY CA C 78 45.140 45.847 -0.707 1
1 950 . 12 1 1 A 78 78 GLY N N 78 107.100 111.049 -3.949 1
1 951 . 12 1 1 A 79 79 ASP H H 79 7.912 8.209 -0.297 1
1 952 . 12 1 1 A 79 79 ASP HA H 79 4.722 4.570 0.152 1
1 955 . 12 1 1 A 79 79 ASP C C 79 176.200 176.869 -0.669 1
1 956 . 12 1 1 A 79 79 ASP CA C 79 53.210 53.488 -0.278 1
1 957 . 12 1 1 A 79 79 ASP CB C 79 40.160 39.431 0.729 1
1 958 . 12 1 1 A 79 79 ASP N N 79 119.800 122.715 -2.915 1
1 959 . 12 1 1 A 80 80 ASN H H 80 8.450 8.883 -0.433 1
1 960 . 12 1 1 A 80 80 ASN HA H 80 4.593 4.635 -0.042 1
1 965 . 12 1 1 A 80 80 ASN C C 80 177.300 177.430 -0.130 1
1 966 . 12 1 1 A 80 80 ASN CA C 80 54.680 54.515 0.165 1
1 967 . 12 1 1 A 80 80 ASN CB C 80 38.790 37.397 1.393 1
1 968 . 12 1 1 A 80 80 ASN N N 80 121.700 119.048 2.652 1
1 970 . 12 1 1 A 81 81 SER H H 81 8.444 7.881 0.563 1
1 971 . 12 1 1 A 81 81 SER HA H 81 4.263 4.214 0.049 1
1 974 . 12 1 1 A 81 81 SER C C 81 176.100 177.463 -1.363 1
1 975 . 12 1 1 A 81 81 SER CA C 81 61.470 61.156 0.314 1
1 976 . 12 1 1 A 81 81 SER CB C 81 61.470 62.772 -1.302 1
1 977 . 12 1 1 A 81 81 SER N N 81 117.100 115.930 1.170 1
1 978 . 12 1 1 A 82 82 LEU H H 82 7.929 8.199 -0.270 1
1 979 . 12 1 1 A 82 82 LEU HA H 82 4.332 4.031 0.301 1
1 989 . 12 1 1 A 82 82 LEU C C 82 177.400 179.474 -2.074 1
1 990 . 12 1 1 A 82 82 LEU CA C 82 55.060 57.861 -2.801 1
1 991 . 12 1 1 A 82 82 LEU CB C 82 41.940 41.713 0.227 1
1 995 . 12 1 1 A 82 82 LEU N N 82 120.400 122.118 -1.718 1
1 996 . 12 1 1 A 83 83 HIS H H 83 8.014 8.441 -0.427 1
1 997 . 12 1 1 A 83 83 HIS HA H 83 4.173 4.150 0.023 1
1 1000 . 12 1 1 A 83 83 HIS C C 83 176.100 176.701 -0.601 1
1 1001 . 12 1 1 A 83 83 HIS CA C 83 59.940 59.673 0.267 1
1 1002 . 12 1 1 A 83 83 HIS CB C 83 28.050 30.184 -2.134 1
1 1003 . 12 1 1 A 83 83 HIS N N 83 119.400 118.345 1.055 1
1 1004 . 12 1 1 A 84 84 ASN H H 84 8.598 8.203 0.395 1
1 1005 . 12 1 1 A 84 84 ASN HA H 84 4.735 4.641 0.094 1
1 1010 . 12 1 1 A 84 84 ASN C C 84 177.400 177.242 0.158 1
1 1011 . 12 1 1 A 84 84 ASN CA C 84 55.790 55.235 0.555 1
1 1012 . 12 1 1 A 84 84 ASN CB C 84 37.520 39.040 -1.520 1
1 1013 . 12 1 1 A 84 84 ASN N N 84 118.100 117.138 0.962 1
1 1015 . 12 1 1 A 85 85 VAL H H 85 7.933 7.997 -0.064 1
1 1016 . 12 1 1 A 85 85 VAL HA H 85 3.849 3.855 -0.006 1
1 1024 . 12 1 1 A 85 85 VAL C C 85 177.100 178.007 -0.907 1
1 1025 . 12 1 1 A 85 85 VAL CA C 85 65.490 65.629 -0.139 1
1 1026 . 12 1 1 A 85 85 VAL CB C 85 31.760 32.043 -0.283 1
1 1029 . 12 1 1 A 85 85 VAL N N 85 120.500 119.967 0.533 1
1 1030 . 12 1 1 A 86 86 HIS H H 86 8.460 9.483 -1.023 1
1 1031 . 12 1 1 A 86 86 HIS HA H 86 4.054 4.126 -0.072 1
1 1035 . 12 1 1 A 86 86 HIS C C 86 176.300 177.402 -1.102 1
1 1036 . 12 1 1 A 86 86 HIS CA C 86 59.860 60.147 -0.287 1
1 1037 . 12 1 1 A 86 86 HIS CB C 86 29.670 30.019 -0.349 1
1 1038 . 12 1 1 A 86 86 HIS N N 86 119.300 119.212 0.088 1
1 1039 . 12 1 1 A 87 87 GLU H H 87 7.897 7.608 0.289 1
1 1040 . 12 1 1 A 87 87 GLU HA H 87 3.838 3.700 0.138 1
1 1045 . 12 1 1 A 87 87 GLU C C 87 178.300 179.508 -1.208 1
1 1046 . 12 1 1 A 87 87 GLU CA C 87 58.690 59.360 -0.670 1
1 1047 . 12 1 1 A 87 87 GLU CB C 87 28.460 28.799 -0.339 1
1 1049 . 12 1 1 A 87 87 GLU N N 87 117.100 118.676 -1.576 1
1 1050 . 12 1 1 A 88 88 ASN H H 88 8.103 8.035 0.068 1
1 1051 . 12 1 1 A 88 88 ASN HA H 88 4.503 4.569 -0.066 1
1 1056 . 12 1 1 A 88 88 ASN C C 88 177.700 178.229 -0.529 1
1 1057 . 12 1 1 A 88 88 ASN CA C 88 55.990 56.307 -0.317 1
1 1058 . 12 1 1 A 88 88 ASN CB C 88 39.010 38.099 0.911 1
1 1059 . 12 1 1 A 88 88 ASN N N 88 118.400 118.034 0.366 1
1 1061 . 12 1 1 A 89 89 ILE H H 89 8.501 7.909 0.592 1
1 1062 . 12 1 1 A 89 89 ILE HA H 89 3.670 3.726 -0.056 1
1 1072 . 12 1 1 A 89 89 ILE C C 89 177.000 178.212 -1.212 1
1 1073 . 12 1 1 A 89 89 ILE CA C 89 65.390 65.597 -0.207 1
1 1074 . 12 1 1 A 89 89 ILE CB C 89 37.440 38.119 -0.679 1
1 1078 . 12 1 1 A 89 89 ILE N N 89 118.700 120.580 -1.880 1
1 1079 . 12 1 1 A 90 90 LYS H H 90 8.017 8.110 -0.093 1
1 1080 . 12 1 1 A 90 90 LYS HA H 90 3.775 3.980 -0.205 1
1 1089 . 12 1 1 A 90 90 LYS C C 90 178.800 179.766 -0.966 1
1 1090 . 12 1 1 A 90 90 LYS CA C 90 60.450 60.062 0.388 1
1 1091 . 12 1 1 A 90 90 LYS CB C 90 32.110 32.190 -0.080 1
1 1095 . 12 1 1 A 90 90 LYS N N 90 120.900 118.820 2.080 1
1 1096 . 12 1 1 A 91 91 GLU H H 91 7.732 7.824 -0.092 1
1 1097 . 12 1 1 A 91 91 GLU HA H 91 4.083 4.055 0.028 1
1 1102 . 12 1 1 A 91 91 GLU C C 91 179.100 179.086 0.014 1
1 1103 . 12 1 1 A 91 91 GLU CA C 91 59.120 59.330 -0.210 1
1 1104 . 12 1 1 A 91 91 GLU CB C 91 28.810 29.388 -0.578 1
1 1106 . 12 1 1 A 91 91 GLU N N 91 119.300 119.407 -0.107 1
1 1107 . 12 1 1 A 92 92 ILE H H 92 8.110 8.571 -0.461 1
1 1108 . 12 1 1 A 92 92 ILE HA H 92 3.685 3.687 -0.002 1
1 1118 . 12 1 1 A 92 92 ILE C C 92 178.000 178.228 -0.228 1
1 1119 . 12 1 1 A 92 92 ILE CA C 92 65.900 65.586 0.314 1
1 1120 . 12 1 1 A 92 92 ILE CB C 92 38.400 37.989 0.411 1
1 1124 . 12 1 1 A 92 92 ILE N N 92 121.100 120.839 0.261 1
1 1125 . 12 1 1 A 93 93 PHE H H 93 8.651 9.494 -0.843 1
1 1126 . 12 1 1 A 93 93 PHE HA H 93 3.873 3.299 0.574 1
1 1133 . 12 1 1 A 93 93 PHE C C 93 177.100 177.692 -0.592 1
1 1134 . 12 1 1 A 93 93 PHE CA C 93 61.020 61.235 -0.215 1
1 1135 . 12 1 1 A 93 93 PHE CB C 93 38.560 38.228 0.332 1
1 1138 . 12 1 1 A 93 93 PHE N N 93 119.400 121.056 -1.656 1
1 1139 . 12 1 1 A 94 94 HIS H H 94 8.126 8.522 -0.396 1
1 1140 . 12 1 1 A 94 94 HIS HA H 94 4.368 3.996 0.372 1
1 1145 . 12 1 1 A 94 94 HIS C C 94 177.100 176.315 0.785 1
1 1146 . 12 1 1 A 94 94 HIS CA C 94 58.310 57.348 0.962 1
1 1147 . 12 1 1 A 94 94 HIS CB C 94 27.910 28.547 -0.637 1
1 1148 . 12 1 1 A 94 94 HIS N N 94 116.400 115.071 1.329 1
1 1149 . 12 1 1 A 95 95 HIS H H 95 8.058 9.132 -1.074 1
1 1150 . 12 1 1 A 95 95 HIS HA H 95 4.465 4.188 0.277 1
1 1154 . 12 1 1 A 95 95 HIS C C 95 177.300 177.180 0.120 1
1 1155 . 12 1 1 A 95 95 HIS CA C 95 57.900 58.461 -0.561 1
1 1156 . 12 1 1 A 95 95 HIS CB C 95 28.490 30.154 -1.664 1
1 1157 . 12 1 1 A 95 95 HIS N N 95 117.000 119.137 -2.137 1
1 1158 . 12 1 1 A 96 96 LEU H H 96 8.525 7.881 0.644 1
1 1159 . 12 1 1 A 96 96 LEU HA H 96 3.865 3.803 0.062 1
1 1169 . 12 1 1 A 96 96 LEU C C 96 178.300 178.246 0.054 1
1 1170 . 12 1 1 A 96 96 LEU CA C 96 58.250 57.987 0.263 1
1 1171 . 12 1 1 A 96 96 LEU CB C 96 41.720 41.875 -0.155 1
1 1175 . 12 1 1 A 96 96 LEU N N 96 121.300 120.570 0.730 1
1 1176 . 12 1 1 A 97 97 GLU H H 97 8.076 8.253 -0.177 1
1 1177 . 12 1 1 A 97 97 GLU HA H 97 3.719 4.021 -0.302 1
1 1182 . 12 1 1 A 97 97 GLU C C 97 178.300 178.747 -0.447 1
1 1183 . 12 1 1 A 97 97 GLU CA C 97 59.300 58.519 0.781 1
1 1184 . 12 1 1 A 97 97 GLU CB C 97 28.960 29.554 -0.594 1
1 1186 . 12 1 1 A 97 97 GLU N N 97 117.100 118.469 -1.369 1
1 1187 . 12 1 1 A 98 98 GLU H H 98 7.329 7.714 -0.385 1
1 1188 . 12 1 1 A 98 98 GLU HA H 98 4.024 4.118 -0.094 1
1 1193 . 12 1 1 A 98 98 GLU C C 98 177.900 179.015 -1.115 1
1 1194 . 12 1 1 A 98 98 GLU CA C 98 58.190 58.517 -0.327 1
1 1195 . 12 1 1 A 98 98 GLU CB C 98 29.120 29.455 -0.335 1
1 1197 . 12 1 1 A 98 98 GLU N N 98 116.000 119.166 -3.166 1
1 1198 . 12 1 1 A 99 99 LEU H H 99 7.535 8.142 -0.607 1
1 1199 . 12 1 1 A 99 99 LEU HA H 99 4.183 4.129 0.054 1
1 1209 . 12 1 1 A 99 99 LEU C C 99 178.100 177.660 0.440 1
1 1210 . 12 1 1 A 99 99 LEU CA C 99 56.440 56.453 -0.013 1
1 1211 . 12 1 1 A 99 99 LEU CB C 99 43.010 41.382 1.628 1
1 1215 . 12 1 1 A 99 99 LEU N N 99 118.200 119.270 -1.070 1
1 1216 . 12 1 1 A 100 100 VAL H H 100 7.561 7.324 0.237 1
1 1217 . 12 1 1 A 100 100 VAL HA H 100 4.033 4.613 -0.580 1
1 1225 . 12 1 1 A 100 100 VAL C C 100 175.400 177.815 -2.415 1
1 1226 . 12 1 1 A 100 100 VAL CA C 100 62.430 61.380 1.050 1
1 1227 . 12 1 1 A 100 100 VAL CB C 100 32.050 33.400 -1.350 1
1 1230 . 12 1 1 A 100 100 VAL N N 100 114.800 112.133 2.667 1
1 1231 . 12 1 1 A 101 101 HIS H H 101 7.827 7.992 -0.165 1
1 1232 . 12 1 1 A 101 101 HIS HA H 101 4.630 4.232 0.398 1
1 1237 . 12 1 1 A 101 101 HIS C C 101 173.500 176.282 -2.782 1
1 1238 . 12 1 1 A 101 101 HIS CA C 101 55.410 58.417 -3.007 1
1 1239 . 12 1 1 A 101 101 HIS CB C 101 28.870 30.133 -1.263 1
1 1240 . 12 1 1 A 101 101 HIS N N 101 120.300 122.641 -2.341 1
1 10 . 13 1 1 A 2 2 TYR H H 2 8.688 7.663 1.025 1
1 11 . 13 1 1 A 2 2 TYR HA H 2 4.737 4.170 0.567 1
1 16 . 13 1 1 A 2 2 TYR C C 2 175.900 176.287 -0.387 1
1 17 . 13 1 1 A 2 2 TYR CA C 2 57.920 60.526 -2.606 1
1 18 . 13 1 1 A 2 2 TYR CB C 2 38.340 38.713 -0.373 1
1 19 . 13 1 1 A 2 2 TYR N N 2 122.100 121.385 0.715 1
1 20 . 13 1 1 A 3 3 GLY H H 3 8.434 8.347 0.087 1
1 21 . 13 1 1 A 3 3 GLY HA2 H 3 3.909 4.046 -0.137 1
1 22 . 13 1 1 A 3 3 GLY HA3 H 3 3.841 4.076 -0.235 1
1 23 . 13 1 1 A 3 3 GLY C C 3 174.300 175.775 -1.475 1
1 24 . 13 1 1 A 3 3 GLY CA C 3 46.050 45.532 0.518 1
1 25 . 13 1 1 A 3 3 GLY N N 3 111.100 108.300 2.800 1
1 26 . 13 1 1 A 4 4 LYS H H 4 8.060 8.416 -0.356 1
1 27 . 13 1 1 A 4 4 LYS HA H 4 4.297 4.169 0.128 1
1 36 . 13 1 1 A 4 4 LYS C C 4 178.000 179.103 -1.103 1
1 37 . 13 1 1 A 4 4 LYS CA C 4 56.930 59.202 -2.272 1
1 38 . 13 1 1 A 4 4 LYS CB C 4 32.680 31.947 0.733 1
1 42 . 13 1 1 A 4 4 LYS N N 4 119.500 121.500 -2.000 1
1 43 . 13 1 1 A 5 5 LEU H H 5 8.243 8.090 0.153 1
1 44 . 13 1 1 A 5 5 LEU HA H 5 3.947 3.903 0.044 1
1 54 . 13 1 1 A 5 5 LEU C C 5 177.900 178.788 -0.888 1
1 55 . 13 1 1 A 5 5 LEU CA C 5 57.930 57.785 0.145 1
1 56 . 13 1 1 A 5 5 LEU CB C 5 41.620 41.687 -0.067 1
1 60 . 13 1 1 A 5 5 LEU N N 5 120.800 119.974 0.826 1
1 61 . 13 1 1 A 6 6 ASN H H 6 8.256 8.327 -0.071 1
1 62 . 13 1 1 A 6 6 ASN HA H 6 4.252 4.308 -0.056 1
1 67 . 13 1 1 A 6 6 ASN C C 6 177.300 177.761 -0.461 1
1 68 . 13 1 1 A 6 6 ASN CA C 6 56.900 56.435 0.465 1
1 69 . 13 1 1 A 6 6 ASN CB C 6 38.200 38.186 0.014 1
1 70 . 13 1 1 A 6 6 ASN N N 6 116.200 116.906 -0.706 1
1 72 . 13 1 1 A 7 7 ASP H H 7 7.699 8.410 -0.711 1
1 73 . 13 1 1 A 7 7 ASP HA H 7 4.320 4.490 -0.170 1
1 76 . 13 1 1 A 7 7 ASP C C 7 178.000 178.700 -0.700 1
1 77 . 13 1 1 A 7 7 ASP CA C 7 56.980 57.508 -0.528 1
1 78 . 13 1 1 A 7 7 ASP CB C 7 39.870 40.822 -0.952 1
1 79 . 13 1 1 A 7 7 ASP N N 7 119.100 119.133 -0.033 1
1 80 . 13 1 1 A 8 8 LEU H H 8 7.580 8.737 -1.157 1
1 81 . 13 1 1 A 8 8 LEU HA H 8 4.091 4.172 -0.081 1
1 91 . 13 1 1 A 8 8 LEU C C 8 178.800 178.989 -0.189 1
1 92 . 13 1 1 A 8 8 LEU CA C 8 57.790 57.650 0.140 1
1 93 . 13 1 1 A 8 8 LEU CB C 8 41.880 41.702 0.178 1
1 97 . 13 1 1 A 8 8 LEU N N 8 120.400 120.653 -0.253 1
1 98 . 13 1 1 A 9 9 LEU H H 9 8.125 9.029 -0.904 1
1 99 . 13 1 1 A 9 9 LEU HA H 9 3.891 3.949 -0.058 1
1 109 . 13 1 1 A 9 9 LEU C C 9 178.900 178.487 0.413 1
1 110 . 13 1 1 A 9 9 LEU CA C 9 58.350 58.600 -0.250 1
1 111 . 13 1 1 A 9 9 LEU CB C 9 41.510 41.772 -0.262 1
1 115 . 13 1 1 A 9 9 LEU N N 9 118.900 119.994 -1.094 1
1 116 . 13 1 1 A 10 10 GLU H H 10 8.011 8.890 -0.879 1
1 117 . 13 1 1 A 10 10 GLU HA H 10 4.072 4.058 0.014 1
1 122 . 13 1 1 A 10 10 GLU C C 10 179.000 178.579 0.421 1
1 123 . 13 1 1 A 10 10 GLU CA C 10 59.090 59.757 -0.667 1
1 124 . 13 1 1 A 10 10 GLU CB C 10 27.910 28.827 -0.917 1
1 126 . 13 1 1 A 10 10 GLU N N 10 119.300 118.676 0.624 1
1 127 . 13 1 1 A 11 11 ASP H H 11 8.128 8.041 0.087 1
1 128 . 13 1 1 A 11 11 ASP HA H 11 4.383 4.386 -0.003 1
1 131 . 13 1 1 A 11 11 ASP C C 11 178.500 178.363 0.137 1
1 132 . 13 1 1 A 11 11 ASP CA C 11 56.580 56.964 -0.384 1
1 133 . 13 1 1 A 11 11 ASP CB C 11 38.600 41.694 -3.094 1
1 134 . 13 1 1 A 11 11 ASP N N 11 119.600 119.807 -0.207 1
1 135 . 13 1 1 A 12 12 LEU H H 12 8.394 7.830 0.564 1
1 136 . 13 1 1 A 12 12 LEU HA H 12 3.923 4.212 -0.289 1
1 146 . 13 1 1 A 12 12 LEU C C 12 178.200 178.799 -0.599 1
1 147 . 13 1 1 A 12 12 LEU CA C 12 57.880 57.800 0.080 1
1 148 . 13 1 1 A 12 12 LEU CB C 12 41.850 41.999 -0.149 1
1 152 . 13 1 1 A 12 12 LEU N N 12 120.500 120.303 0.197 1
1 153 . 13 1 1 A 13 13 GLN H H 13 8.371 8.619 -0.248 1
1 154 . 13 1 1 A 13 13 GLN HA H 13 3.879 4.082 -0.203 1
1 161 . 13 1 1 A 13 13 GLN C C 13 178.600 177.917 0.683 1
1 162 . 13 1 1 A 13 13 GLN CA C 13 59.570 58.388 1.182 1
1 163 . 13 1 1 A 13 13 GLN CB C 13 28.440 27.669 0.771 1
1 165 . 13 1 1 A 13 13 GLN N N 13 118.400 117.447 0.953 1
1 167 . 13 1 1 A 14 14 GLU H H 14 7.913 7.871 0.042 1
1 168 . 13 1 1 A 14 14 GLU HA H 14 4.021 4.121 -0.100 1
1 173 . 13 1 1 A 14 14 GLU C C 14 179.000 178.959 0.041 1
1 174 . 13 1 1 A 14 14 GLU CA C 14 59.030 58.955 0.075 1
1 175 . 13 1 1 A 14 14 GLU CB C 14 28.720 29.649 -0.929 1
1 177 . 13 1 1 A 14 14 GLU N N 14 119.100 119.570 -0.470 1
1 178 . 13 1 1 A 15 15 VAL H H 15 7.991 7.789 0.202 1
1 179 . 13 1 1 A 15 15 VAL HA H 15 3.696 3.936 -0.240 1
1 187 . 13 1 1 A 15 15 VAL C C 15 178.300 177.903 0.397 1
1 188 . 13 1 1 A 15 15 VAL CA C 15 66.640 65.604 1.036 1
1 189 . 13 1 1 A 15 15 VAL CB C 15 31.470 31.389 0.081 1
1 192 . 13 1 1 A 15 15 VAL N N 15 120.300 117.653 2.647 1
1 193 . 13 1 1 A 16 16 LEU H H 16 8.172 7.664 0.508 1
1 194 . 13 1 1 A 16 16 LEU HA H 16 3.876 4.250 -0.374 1
1 204 . 13 1 1 A 16 16 LEU C C 16 178.400 178.891 -0.491 1
1 205 . 13 1 1 A 16 16 LEU CA C 16 58.050 57.378 0.672 1
1 206 . 13 1 1 A 16 16 LEU CB C 16 41.420 42.289 -0.869 1
1 210 . 13 1 1 A 16 16 LEU N N 16 119.700 124.216 -4.516 1
1 211 . 13 1 1 A 17 17 LYS H H 17 7.755 8.858 -1.103 1
1 212 . 13 1 1 A 17 17 LYS HA H 17 3.951 4.053 -0.102 1
1 221 . 13 1 1 A 17 17 LYS C C 17 178.800 179.279 -0.479 1
1 222 . 13 1 1 A 17 17 LYS CA C 17 59.470 59.527 -0.057 1
1 223 . 13 1 1 A 17 17 LYS CB C 17 32.350 32.621 -0.271 1
1 227 . 13 1 1 A 17 17 LYS N N 17 117.800 120.123 -2.323 1
1 228 . 13 1 1 A 18 18 HIS H H 18 7.847 8.179 -0.332 1
1 229 . 13 1 1 A 18 18 HIS HA H 18 4.549 4.341 0.208 1
1 233 . 13 1 1 A 18 18 HIS C C 18 177.200 176.063 1.137 1
1 234 . 13 1 1 A 18 18 HIS CA C 18 57.870 58.427 -0.557 1
1 235 . 13 1 1 A 18 18 HIS CB C 18 28.730 29.986 -1.256 1
1 236 . 13 1 1 A 18 18 HIS N N 18 116.200 119.431 -3.231 1
1 237 . 13 1 1 A 19 19 VAL H H 19 8.415 7.781 0.634 1
1 238 . 13 1 1 A 19 19 VAL HA H 19 3.746 4.124 -0.378 1
1 246 . 13 1 1 A 19 19 VAL CA C 19 65.850 63.322 2.528 1
1 247 . 13 1 1 A 19 19 VAL CB C 19 31.600 32.433 -0.833 1
1 250 . 13 1 1 A 20 20 ASN H H 20 8.041 8.434 -0.393 1
1 251 . 13 1 1 A 20 20 ASN HA H 20 4.545 4.642 -0.097 1
1 256 . 13 1 1 A 20 20 ASN C C 20 176.900 176.846 0.054 1
1 257 . 13 1 1 A 20 20 ASN CA C 20 55.070 55.614 -0.544 1
1 258 . 13 1 1 A 20 20 ASN CB C 20 38.270 38.623 -0.353 1
1 259 . 13 1 1 A 20 20 ASN N N 20 117.900 120.225 -2.325 1
1 261 . 13 1 1 A 21 21 GLN H H 21 7.887 7.555 0.332 1
1 262 . 13 1 1 A 21 21 GLN HA H 21 4.096 4.236 -0.140 1
1 269 . 13 1 1 A 21 21 GLN C C 21 176.900 177.021 -0.121 1
1 270 . 13 1 1 A 21 21 GLN CA C 21 57.510 57.069 0.441 1
1 271 . 13 1 1 A 21 21 GLN CB C 21 29.100 29.669 -0.569 1
1 273 . 13 1 1 A 21 21 GLN N N 21 117.900 117.040 0.860 1
1 275 . 13 1 1 A 22 22 HIS H H 22 7.887 8.203 -0.316 1
1 276 . 13 1 1 A 22 22 HIS HA H 22 4.679 4.763 -0.084 1
1 280 . 13 1 1 A 22 22 HIS C C 22 174.300 174.936 -0.636 1
1 281 . 13 1 1 A 22 22 HIS CA C 22 55.770 55.616 0.154 1
1 282 . 13 1 1 A 22 22 HIS CB C 22 28.630 29.630 -1.000 1
1 283 . 13 1 1 A 22 22 HIS N N 22 116.100 113.526 2.574 1
1 284 . 13 1 1 A 23 23 TRP H H 23 7.929 7.745 0.184 1
1 285 . 13 1 1 A 23 23 TRP HA H 23 4.542 4.635 -0.093 1
1 292 . 13 1 1 A 23 23 TRP C C 23 176.600 175.395 1.205 1
1 293 . 13 1 1 A 23 23 TRP CA C 23 58.020 58.380 -0.360 1
1 294 . 13 1 1 A 23 23 TRP CB C 23 29.700 30.482 -0.782 1
1 295 . 13 1 1 A 23 23 TRP N N 23 122.000 123.860 -1.860 1
1 297 . 13 1 1 A 24 24 GLN H H 24 8.258 8.263 -0.005 1
1 298 . 13 1 1 A 24 24 GLN HA H 24 4.329 4.856 -0.527 1
1 305 . 13 1 1 A 24 24 GLN C C 24 176.200 175.220 0.980 1
1 306 . 13 1 1 A 24 24 GLN CA C 24 55.960 54.842 1.118 1
1 307 . 13 1 1 A 24 24 GLN CB C 24 29.440 32.161 -2.721 1
1 309 . 13 1 1 A 24 24 GLN N N 24 123.800 125.572 -1.772 1
1 311 . 13 1 1 A 25 25 GLY H H 25 7.470 8.753 -1.283 1
1 312 . 13 1 1 A 25 25 GLY HA2 H 25 3.939 3.844 0.095 1
1 313 . 13 1 1 A 25 25 GLY HA3 H 25 3.800 3.862 -0.062 1
1 314 . 13 1 1 A 25 25 GLY C C 25 174.800 174.868 -0.068 1
1 315 . 13 1 1 A 25 25 GLY CA C 25 45.470 46.453 -0.983 1
1 316 . 13 1 1 A 25 25 GLY N N 25 108.100 110.078 -1.978 1
1 317 . 13 1 1 A 26 26 GLY H H 26 8.332 8.584 -0.252 1
1 318 . 13 1 1 A 26 26 GLY HA2 H 26 4.105 4.173 -0.068 1
1 319 . 13 1 1 A 26 26 GLY HA3 H 26 3.974 4.205 -0.231 1
1 320 . 13 1 1 A 26 26 GLY C C 26 174.900 174.281 0.619 1
1 321 . 13 1 1 A 26 26 GLY CA C 26 45.410 45.013 0.397 1
1 322 . 13 1 1 A 26 26 GLY N N 26 108.700 107.355 1.345 1
1 323 . 13 1 1 A 27 27 GLN H H 27 8.474 8.728 -0.254 1
1 324 . 13 1 1 A 27 27 GLN HA H 27 4.106 4.205 -0.099 1
1 331 . 13 1 1 A 27 27 GLN C C 27 177.100 176.373 0.727 1
1 332 . 13 1 1 A 27 27 GLN CA C 27 57.540 55.628 1.912 1
1 333 . 13 1 1 A 27 27 GLN CB C 27 29.050 28.548 0.502 1
1 335 . 13 1 1 A 27 27 GLN N N 27 121.100 123.095 -1.995 1
1 337 . 13 1 1 A 28 28 LYS H H 28 8.448 8.121 0.327 1
1 338 . 13 1 1 A 28 28 LYS HA H 28 4.068 4.032 0.036 1
1 347 . 13 1 1 A 28 28 LYS C C 28 177.900 178.601 -0.701 1
1 348 . 13 1 1 A 28 28 LYS CA C 28 58.410 58.646 -0.236 1
1 349 . 13 1 1 A 28 28 LYS CB C 28 32.210 32.706 -0.496 1
1 353 . 13 1 1 A 28 28 LYS N N 28 120.500 118.518 1.982 1
1 354 . 13 1 1 A 29 29 ASN H H 29 8.273 8.276 -0.003 1
1 355 . 13 1 1 A 29 29 ASN HA H 29 4.584 4.356 0.228 1
1 360 . 13 1 1 A 29 29 ASN C C 29 176.200 177.374 -1.174 1
1 361 . 13 1 1 A 29 29 ASN CA C 29 54.400 55.742 -1.342 1
1 362 . 13 1 1 A 29 29 ASN CB C 29 38.280 37.433 0.847 1
1 363 . 13 1 1 A 29 29 ASN N N 29 117.500 116.934 0.566 1
1 365 . 13 1 1 A 30 30 MET H H 30 7.870 7.408 0.462 1
1 366 . 13 1 1 A 30 30 MET HA H 30 4.085 2.982 1.103 1
1 371 . 13 1 1 A 30 30 MET C C 30 177.000 177.737 -0.737 1
1 372 . 13 1 1 A 30 30 MET CA C 30 56.880 57.570 -0.690 1
1 373 . 13 1 1 A 30 30 MET CB C 30 32.340 31.347 0.993 1
1 375 . 13 1 1 A 30 30 MET N N 30 121.100 118.614 2.486 1
1 376 . 13 1 1 A 31 31 ASN H H 31 8.186 7.297 0.889 1
1 377 . 13 1 1 A 31 31 ASN HA H 31 4.311 4.477 -0.166 1
1 382 . 13 1 1 A 31 31 ASN C C 31 176.700 177.648 -0.948 1
1 383 . 13 1 1 A 31 31 ASN CA C 31 55.320 55.396 -0.076 1
1 384 . 13 1 1 A 31 31 ASN CB C 31 38.410 38.584 -0.174 1
1 385 . 13 1 1 A 31 31 ASN N N 31 117.900 115.855 2.045 1
1 387 . 13 1 1 A 32 32 LYS H H 32 7.792 7.164 0.628 1
1 388 . 13 1 1 A 32 32 LYS HA H 32 3.992 4.038 -0.046 1
1 397 . 13 1 1 A 32 32 LYS C C 32 177.900 179.305 -1.405 1
1 398 . 13 1 1 A 32 32 LYS CA C 32 59.050 59.485 -0.435 1
1 399 . 13 1 1 A 32 32 LYS CB C 32 32.460 32.263 0.197 1
1 403 . 13 1 1 A 32 32 LYS N N 32 120.400 119.097 1.303 1
1 404 . 13 1 1 A 33 33 VAL H H 33 7.689 8.223 -0.534 1
1 405 . 13 1 1 A 33 33 VAL HA H 33 3.791 3.659 0.132 1
1 413 . 13 1 1 A 33 33 VAL C C 33 177.100 177.684 -0.584 1
1 414 . 13 1 1 A 33 33 VAL CA C 33 65.360 65.048 0.312 1
1 415 . 13 1 1 A 33 33 VAL CB C 33 31.920 31.624 0.296 1
1 418 . 13 1 1 A 33 33 VAL N N 33 120.200 116.365 3.835 1
1 419 . 13 1 1 A 34 34 ASP H H 34 8.408 8.021 0.387 1
1 420 . 13 1 1 A 34 34 ASP HA H 34 4.303 4.240 0.063 1
1 423 . 13 1 1 A 34 34 ASP C C 34 178.200 178.288 -0.088 1
1 424 . 13 1 1 A 34 34 ASP CA C 34 55.880 56.989 -1.109 1
1 425 . 13 1 1 A 34 34 ASP CB C 34 38.710 40.838 -2.128 1
1 426 . 13 1 1 A 34 34 ASP N N 34 120.100 121.612 -1.512 1
1 427 . 13 1 1 A 35 35 HIS H H 35 8.204 7.633 0.571 1
1 428 . 13 1 1 A 35 35 HIS HA H 35 4.343 4.307 0.036 1
1 431 . 13 1 1 A 35 35 HIS C C 35 176.800 177.774 -0.974 1
1 432 . 13 1 1 A 35 35 HIS CA C 35 58.310 59.699 -1.389 1
1 433 . 13 1 1 A 35 35 HIS CB C 35 28.070 30.304 -2.234 1
1 434 . 13 1 1 A 35 35 HIS N N 35 118.200 117.369 0.831 1
1 435 . 13 1 1 A 36 36 HIS H H 36 8.067 7.891 0.176 1
1 436 . 13 1 1 A 36 36 HIS HA H 36 4.602 4.089 0.513 1
1 440 . 13 1 1 A 36 36 HIS C C 36 177.100 177.561 -0.461 1
1 441 . 13 1 1 A 36 36 HIS CA C 36 58.520 59.236 -0.716 1
1 442 . 13 1 1 A 36 36 HIS CB C 36 28.720 29.896 -1.176 1
1 443 . 13 1 1 A 36 36 HIS N N 36 117.100 117.375 -0.275 1
1 444 . 13 1 1 A 37 37 LEU H H 37 8.473 8.361 0.112 1
1 445 . 13 1 1 A 37 37 LEU HA H 37 3.894 3.574 0.320 1
1 455 . 13 1 1 A 37 37 LEU C C 37 178.200 178.816 -0.616 1
1 456 . 13 1 1 A 37 37 LEU CA C 37 58.520 57.956 0.564 1
1 457 . 13 1 1 A 37 37 LEU CB C 37 41.810 41.529 0.281 1
1 461 . 13 1 1 A 37 37 LEU N N 37 119.600 119.447 0.153 1
1 462 . 13 1 1 A 38 38 GLN H H 38 8.337 8.288 0.049 1
1 463 . 13 1 1 A 38 38 GLN HA H 38 3.882 3.913 -0.031 1
1 470 . 13 1 1 A 38 38 GLN C C 38 178.500 178.556 -0.056 1
1 471 . 13 1 1 A 38 38 GLN CA C 38 59.200 59.516 -0.316 1
1 472 . 13 1 1 A 38 38 GLN CB C 38 27.850 28.183 -0.333 1
1 474 . 13 1 1 A 38 38 GLN N N 38 118.000 116.882 1.118 1
1 476 . 13 1 1 A 39 39 ASN H H 39 7.923 8.162 -0.239 1
1 477 . 13 1 1 A 39 39 ASN HA H 39 4.390 4.607 -0.217 1
1 482 . 13 1 1 A 39 39 ASN C C 39 177.500 176.973 0.527 1
1 483 . 13 1 1 A 39 39 ASN CA C 39 55.780 55.338 0.442 1
1 484 . 13 1 1 A 39 39 ASN CB C 39 37.450 38.525 -1.075 1
1 485 . 13 1 1 A 39 39 ASN N N 39 118.700 117.064 1.636 1
1 487 . 13 1 1 A 40 40 VAL H H 40 7.907 8.412 -0.505 1
1 488 . 13 1 1 A 40 40 VAL HA H 40 3.629 3.648 -0.019 1
1 496 . 13 1 1 A 40 40 VAL C C 40 177.500 177.815 -0.315 1
1 497 . 13 1 1 A 40 40 VAL CA C 40 67.080 65.815 1.265 1
1 498 . 13 1 1 A 40 40 VAL CB C 40 31.390 31.411 -0.021 1
1 501 . 13 1 1 A 40 40 VAL N N 40 120.400 119.854 0.546 1
1 502 . 13 1 1 A 41 41 ILE H H 41 8.103 8.387 -0.284 1
1 503 . 13 1 1 A 41 41 ILE HA H 41 3.401 3.579 -0.178 1
1 513 . 13 1 1 A 41 41 ILE C C 41 178.000 178.585 -0.585 1
1 514 . 13 1 1 A 41 41 ILE CA C 41 66.430 65.580 0.850 1
1 515 . 13 1 1 A 41 41 ILE CB C 41 38.050 37.708 0.342 1
1 519 . 13 1 1 A 41 41 ILE N N 41 120.600 119.577 1.023 1
1 520 . 13 1 1 A 42 42 GLU H H 42 8.150 7.760 0.390 1
1 521 . 13 1 1 A 42 42 GLU HA H 42 4.062 4.106 -0.044 1
1 526 . 13 1 1 A 42 42 GLU C C 42 178.500 178.323 0.177 1
1 527 . 13 1 1 A 42 42 GLU CA C 42 59.120 59.259 -0.139 1
1 528 . 13 1 1 A 42 42 GLU CB C 42 28.160 29.253 -1.093 1
1 530 . 13 1 1 A 42 42 GLU N N 42 119.900 120.964 -1.064 1
1 531 . 13 1 1 A 43 43 ASP H H 43 8.453 8.821 -0.368 1
1 532 . 13 1 1 A 43 43 ASP HA H 43 4.445 4.403 0.042 1
1 535 . 13 1 1 A 43 43 ASP C C 43 178.400 178.487 -0.087 1
1 536 . 13 1 1 A 43 43 ASP CA C 43 56.490 58.147 -1.657 1
1 537 . 13 1 1 A 43 43 ASP CB C 43 37.820 41.815 -3.995 1
1 538 . 13 1 1 A 43 43 ASP N N 43 119.700 120.062 -0.362 1
1 539 . 13 1 1 A 44 44 ILE H H 44 8.544 7.877 0.667 1
1 540 . 13 1 1 A 44 44 ILE HA H 44 3.590 3.704 -0.114 1
1 550 . 13 1 1 A 44 44 ILE C C 44 177.800 178.069 -0.269 1
1 551 . 13 1 1 A 44 44 ILE CA C 44 66.320 65.433 0.887 1
1 552 . 13 1 1 A 44 44 ILE CB C 44 37.690 37.823 -0.133 1
1 556 . 13 1 1 A 44 44 ILE N N 44 121.500 119.569 1.931 1
1 557 . 13 1 1 A 45 45 HIS H H 45 8.261 8.379 -0.118 1
1 558 . 13 1 1 A 45 45 HIS HA H 45 4.255 4.167 0.088 1
1 562 . 13 1 1 A 45 45 HIS C C 45 177.200 176.129 1.071 1
1 563 . 13 1 1 A 45 45 HIS CA C 45 59.580 60.085 -0.505 1
1 564 . 13 1 1 A 45 45 HIS CB C 45 27.790 30.131 -2.341 1
1 565 . 13 1 1 A 45 45 HIS N N 45 118.800 119.513 -0.713 1
1 566 . 13 1 1 A 46 46 ASP H H 46 8.680 8.282 0.398 1
1 567 . 13 1 1 A 46 46 ASP HA H 46 4.338 4.496 -0.158 1
1 570 . 13 1 1 A 46 46 ASP C C 46 178.700 177.808 0.892 1
1 571 . 13 1 1 A 46 46 ASP CA C 46 57.010 54.871 2.139 1
1 572 . 13 1 1 A 46 46 ASP CB C 46 39.400 41.132 -1.732 1
1 573 . 13 1 1 A 46 46 ASP N N 46 119.200 119.511 -0.311 1
1 574 . 13 1 1 A 47 47 PHE H H 47 8.380 9.199 -0.819 1
1 575 . 13 1 1 A 47 47 PHE HA H 47 4.070 4.192 -0.122 1
1 580 . 13 1 1 A 47 47 PHE C C 47 178.600 177.676 0.924 1
1 581 . 13 1 1 A 47 47 PHE CA C 47 61.250 60.175 1.075 1
1 582 . 13 1 1 A 47 47 PHE CB C 47 39.570 39.706 -0.136 1
1 583 . 13 1 1 A 47 47 PHE N N 47 121.800 121.372 0.428 1
1 584 . 13 1 1 A 48 48 MET H H 48 8.366 8.181 0.185 1
1 585 . 13 1 1 A 48 48 MET HA H 48 3.998 4.582 -0.584 1
1 590 . 13 1 1 A 48 48 MET C C 48 177.400 178.803 -1.403 1
1 591 . 13 1 1 A 48 48 MET CA C 48 58.470 57.334 1.136 1
1 592 . 13 1 1 A 48 48 MET CB C 48 33.170 32.164 1.006 1
1 594 . 13 1 1 A 48 48 MET N N 48 117.700 117.936 -0.236 1
1 595 . 13 1 1 A 49 49 GLN H H 49 7.659 7.938 -0.279 1
1 596 . 13 1 1 A 49 49 GLN HA H 49 4.258 4.059 0.199 1
1 603 . 13 1 1 A 49 49 GLN C C 49 176.700 179.365 -2.665 1
1 604 . 13 1 1 A 49 49 GLN CA C 49 56.380 58.831 -2.451 1
1 605 . 13 1 1 A 49 49 GLN CB C 49 28.980 28.663 0.317 1
1 607 . 13 1 1 A 49 49 GLN N N 49 116.700 119.300 -2.600 1
1 609 . 13 1 1 A 50 50 GLY H H 50 7.685 7.917 -0.232 1
1 610 . 13 1 1 A 50 50 GLY HA2 H 50 3.998 3.786 0.212 1
1 611 . 13 1 1 A 50 50 GLY HA3 H 50 3.998 3.837 0.161 1
1 612 . 13 1 1 A 50 50 GLY C C 50 174.900 174.779 0.121 1
1 613 . 13 1 1 A 50 50 GLY CA C 50 45.460 46.332 -0.872 1
1 614 . 13 1 1 A 50 50 GLY N N 50 106.400 108.569 -2.169 1
1 615 . 13 1 1 A 51 51 GLY H H 51 8.031 8.981 -0.950 1
1 616 . 13 1 1 A 51 51 GLY HA2 H 51 3.817 3.865 -0.048 1
1 617 . 13 1 1 A 51 51 GLY HA3 H 51 3.817 3.961 -0.144 1
1 618 . 13 1 1 A 51 51 GLY C C 51 174.500 174.690 -0.190 1
1 619 . 13 1 1 A 51 51 GLY CA C 51 45.190 45.997 -0.807 1
1 620 . 13 1 1 A 51 51 GLY N N 51 108.900 110.174 -1.274 1
1 621 . 13 1 1 A 52 52 GLY H H 52 8.126 8.113 0.013 1
1 622 . 13 1 1 A 52 52 GLY HA2 H 52 3.362 3.590 -0.228 1
1 623 . 13 1 1 A 52 52 GLY HA3 H 52 3.362 3.981 -0.619 1
1 624 . 13 1 1 A 52 52 GLY C C 52 173.300 174.269 -0.969 1
1 625 . 13 1 1 A 52 52 GLY CA C 52 45.120 45.451 -0.331 1
1 626 . 13 1 1 A 52 52 GLY N N 52 108.100 108.498 -0.398 1
1 627 . 13 1 1 A 53 53 SER H H 53 7.594 7.539 0.055 1
1 628 . 13 1 1 A 53 53 SER HA H 53 4.530 4.704 -0.174 1
1 631 . 13 1 1 A 53 53 SER C C 53 175.300 175.254 0.046 1
1 632 . 13 1 1 A 53 53 SER CA C 53 57.770 57.591 0.179 1
1 633 . 13 1 1 A 53 53 SER CB C 53 64.750 62.175 2.575 1
1 634 . 13 1 1 A 53 53 SER N N 53 114.100 115.188 -1.088 1
1 635 . 13 1 1 A 54 54 GLY H H 54 9.003 8.496 0.507 1
1 636 . 13 1 1 A 54 54 GLY HA2 H 54 4.037 4.021 0.016 1
1 637 . 13 1 1 A 54 54 GLY HA3 H 54 3.911 4.107 -0.196 1
1 638 . 13 1 1 A 54 54 GLY C C 54 176.500 175.555 0.945 1
1 639 . 13 1 1 A 54 54 GLY CA C 54 47.040 46.943 0.097 1
1 640 . 13 1 1 A 54 54 GLY N N 54 110.400 110.282 0.118 1
1 641 . 13 1 1 A 55 55 GLY H H 55 8.617 8.254 0.363 1
1 642 . 13 1 1 A 55 55 GLY HA2 H 55 3.946 3.840 0.106 1
1 643 . 13 1 1 A 55 55 GLY HA3 H 55 3.946 3.854 0.092 1
1 644 . 13 1 1 A 55 55 GLY C C 55 176.400 175.888 0.512 1
1 645 . 13 1 1 A 55 55 GLY CA C 55 46.630 47.002 -0.372 1
1 646 . 13 1 1 A 55 55 GLY N N 55 109.800 109.592 0.208 1
1 647 . 13 1 1 A 56 56 LYS H H 56 7.876 8.577 -0.701 1
1 648 . 13 1 1 A 56 56 LYS HA H 56 4.195 4.136 0.059 1
1 657 . 13 1 1 A 56 56 LYS C C 56 178.600 179.207 -0.607 1
1 658 . 13 1 1 A 56 56 LYS CA C 56 57.960 59.272 -1.312 1
1 659 . 13 1 1 A 56 56 LYS CB C 56 32.110 32.123 -0.013 1
1 663 . 13 1 1 A 56 56 LYS N N 56 121.800 122.577 -0.777 1
1 664 . 13 1 1 A 57 57 LEU H H 57 8.153 8.003 0.150 1
1 665 . 13 1 1 A 57 57 LEU HA H 57 3.992 4.288 -0.296 1
1 675 . 13 1 1 A 57 57 LEU C C 57 178.400 178.714 -0.314 1
1 676 . 13 1 1 A 57 57 LEU CA C 57 58.190 58.328 -0.138 1
1 677 . 13 1 1 A 57 57 LEU CB C 57 41.360 42.114 -0.754 1
1 681 . 13 1 1 A 57 57 LEU N N 57 120.700 122.299 -1.599 1
1 682 . 13 1 1 A 58 58 GLN H H 58 8.019 8.479 -0.460 1
1 683 . 13 1 1 A 58 58 GLN HA H 58 3.942 4.120 -0.178 1
1 690 . 13 1 1 A 58 58 GLN C C 58 179.100 178.469 0.631 1
1 691 . 13 1 1 A 58 58 GLN CA C 58 59.360 58.419 0.941 1
1 692 . 13 1 1 A 58 58 GLN CB C 58 28.030 28.264 -0.234 1
1 694 . 13 1 1 A 58 58 GLN N N 58 117.400 117.442 -0.042 1
1 696 . 13 1 1 A 59 59 GLU H H 59 7.838 8.049 -0.211 1
1 697 . 13 1 1 A 59 59 GLU HA H 59 4.030 4.096 -0.066 1
1 702 . 13 1 1 A 59 59 GLU C C 59 178.600 179.330 -0.730 1
1 703 . 13 1 1 A 59 59 GLU CA C 59 59.250 59.022 0.228 1
1 704 . 13 1 1 A 59 59 GLU CB C 59 28.960 29.824 -0.864 1
1 706 . 13 1 1 A 59 59 GLU N N 59 119.900 120.656 -0.756 1
1 707 . 13 1 1 A 60 60 MET H H 60 8.223 8.154 0.069 1
1 708 . 13 1 1 A 60 60 MET HA H 60 3.966 4.152 -0.186 1
1 713 . 13 1 1 A 60 60 MET C C 60 177.900 178.490 -0.590 1
1 714 . 13 1 1 A 60 60 MET CA C 60 59.350 57.981 1.369 1
1 715 . 13 1 1 A 60 60 MET CB C 60 33.210 32.356 0.854 1
1 717 . 13 1 1 A 60 60 MET N N 60 120.100 118.771 1.329 1
1 718 . 13 1 1 A 61 61 MET H H 61 8.134 8.323 -0.189 1
1 719 . 13 1 1 A 61 61 MET HA H 61 4.195 4.216 -0.021 1
1 724 . 13 1 1 A 61 61 MET C C 61 179.100 178.227 0.873 1
1 725 . 13 1 1 A 61 61 MET CA C 61 58.210 59.063 -0.853 1
1 726 . 13 1 1 A 61 61 MET CB C 61 31.340 32.401 -1.061 1
1 728 . 13 1 1 A 61 61 MET N N 61 117.000 119.228 -2.228 1
1 729 . 13 1 1 A 62 62 LYS H H 62 7.782 7.803 -0.021 1
1 730 . 13 1 1 A 62 62 LYS HA H 62 4.085 4.038 0.047 1
1 739 . 13 1 1 A 62 62 LYS C C 62 179.600 179.642 -0.042 1
1 740 . 13 1 1 A 62 62 LYS CA C 62 59.610 59.863 -0.253 1
1 741 . 13 1 1 A 62 62 LYS CB C 62 32.180 32.021 0.159 1
1 745 . 13 1 1 A 62 62 LYS N N 62 120.600 118.916 1.684 1
1 746 . 13 1 1 A 63 63 GLU H H 63 8.041 8.146 -0.105 1
1 747 . 13 1 1 A 63 63 GLU HA H 63 4.057 3.820 0.237 1
1 752 . 13 1 1 A 63 63 GLU C C 63 178.900 178.623 0.277 1
1 753 . 13 1 1 A 63 63 GLU CA C 63 59.170 58.884 0.286 1
1 754 . 13 1 1 A 63 63 GLU CB C 63 29.000 29.303 -0.303 1
1 756 . 13 1 1 A 63 63 GLU N N 63 120.200 120.118 0.082 1
1 757 . 13 1 1 A 64 64 PHE H H 64 8.604 8.867 -0.263 1
1 758 . 13 1 1 A 64 64 PHE HA H 64 4.155 3.806 0.349 1
1 763 . 13 1 1 A 64 64 PHE C C 64 177.800 177.657 0.143 1
1 764 . 13 1 1 A 64 64 PHE CA C 64 59.820 60.565 -0.745 1
1 765 . 13 1 1 A 64 64 PHE CB C 64 38.470 37.871 0.599 1
1 766 . 13 1 1 A 64 64 PHE N N 64 119.700 120.884 -1.184 1
1 767 . 13 1 1 A 65 65 GLN H H 65 8.177 8.216 -0.039 1
1 768 . 13 1 1 A 65 65 GLN HA H 65 3.637 4.284 -0.647 1
1 775 . 13 1 1 A 65 65 GLN C C 65 177.800 177.455 0.345 1
1 776 . 13 1 1 A 65 65 GLN CA C 65 58.970 58.309 0.661 1
1 777 . 13 1 1 A 65 65 GLN CB C 65 28.280 28.726 -0.446 1
1 779 . 13 1 1 A 65 65 GLN N N 65 118.500 118.281 0.219 1
1 781 . 13 1 1 A 66 66 GLN H H 66 7.622 7.842 -0.220 1
1 782 . 13 1 1 A 66 66 GLN HA H 66 4.040 4.295 -0.255 1
1 789 . 13 1 1 A 66 66 GLN C C 66 178.600 178.406 0.194 1
1 790 . 13 1 1 A 66 66 GLN CA C 66 59.150 58.136 1.014 1
1 791 . 13 1 1 A 66 66 GLN CB C 66 28.230 28.857 -0.627 1
1 793 . 13 1 1 A 66 66 GLN N N 66 117.400 118.176 -0.776 1
1 795 . 13 1 1 A 67 67 VAL H H 67 7.744 7.769 -0.025 1
1 796 . 13 1 1 A 67 67 VAL HA H 67 3.785 3.792 -0.007 1
1 804 . 13 1 1 A 67 67 VAL C C 67 177.500 177.769 -0.269 1
1 805 . 13 1 1 A 67 67 VAL CA C 67 66.220 66.422 -0.202 1
1 806 . 13 1 1 A 67 67 VAL CB C 67 31.390 31.913 -0.523 1
1 809 . 13 1 1 A 67 67 VAL N N 67 119.500 121.112 -1.612 1
1 810 . 13 1 1 A 68 68 LEU H H 68 7.983 8.147 -0.164 1
1 811 . 13 1 1 A 68 68 LEU HA H 68 3.825 4.075 -0.250 1
1 821 . 13 1 1 A 68 68 LEU C C 68 179.100 178.292 0.808 1
1 822 . 13 1 1 A 68 68 LEU CA C 68 58.740 58.168 0.572 1
1 823 . 13 1 1 A 68 68 LEU CB C 68 41.090 42.010 -0.920 1
1 827 . 13 1 1 A 68 68 LEU N N 68 120.400 120.297 0.103 1
1 828 . 13 1 1 A 69 69 ASP H H 69 8.179 8.276 -0.097 1
1 829 . 13 1 1 A 69 69 ASP HA H 69 4.380 4.446 -0.066 1
1 832 . 13 1 1 A 69 69 ASP C C 69 178.900 178.642 0.258 1
1 833 . 13 1 1 A 69 69 ASP CA C 69 57.320 57.039 0.281 1
1 834 . 13 1 1 A 69 69 ASP CB C 69 40.040 40.649 -0.609 1
1 835 . 13 1 1 A 69 69 ASP N N 69 119.000 118.343 0.657 1
1 836 . 13 1 1 A 70 70 GLU H H 70 8.166 7.805 0.361 1
1 837 . 13 1 1 A 70 70 GLU HA H 70 4.082 4.097 -0.015 1
1 842 . 13 1 1 A 70 70 GLU C C 70 179.600 178.908 0.692 1
1 843 . 13 1 1 A 70 70 GLU CA C 70 59.010 59.299 -0.289 1
1 844 . 13 1 1 A 70 70 GLU CB C 70 28.900 29.291 -0.391 1
1 846 . 13 1 1 A 70 70 GLU N N 70 120.500 119.483 1.017 1
1 847 . 13 1 1 A 71 71 ILE H H 71 8.415 8.159 0.256 1
1 848 . 13 1 1 A 71 71 ILE HA H 71 3.790 3.310 0.480 1
1 858 . 13 1 1 A 71 71 ILE C C 71 177.400 177.620 -0.220 1
1 859 . 13 1 1 A 71 71 ILE CA C 71 64.890 65.318 -0.428 1
1 860 . 13 1 1 A 71 71 ILE CB C 71 37.680 37.752 -0.072 1
1 864 . 13 1 1 A 71 71 ILE N N 71 119.200 119.768 -0.568 1
1 865 . 13 1 1 A 72 72 LYS H H 72 8.248 8.207 0.041 1
1 866 . 13 1 1 A 72 72 LYS HA H 72 3.625 3.459 0.166 1
1 873 . 13 1 1 A 72 72 LYS C C 72 178.400 178.699 -0.299 1
1 874 . 13 1 1 A 72 72 LYS CA C 72 59.850 59.434 0.416 1
1 875 . 13 1 1 A 72 72 LYS CB C 72 32.070 32.281 -0.211 1
1 879 . 13 1 1 A 72 72 LYS N N 72 120.800 120.500 0.300 1
1 880 . 13 1 1 A 73 73 GLN H H 73 7.937 7.752 0.185 1
1 881 . 13 1 1 A 73 73 GLN HA H 73 4.042 3.899 0.143 1
1 888 . 13 1 1 A 73 73 GLN C C 73 178.400 177.925 0.475 1
1 889 . 13 1 1 A 73 73 GLN CA C 73 58.510 59.194 -0.684 1
1 890 . 13 1 1 A 73 73 GLN CB C 73 28.430 28.535 -0.105 1
1 892 . 13 1 1 A 73 73 GLN N N 73 117.000 118.156 -1.156 1
1 894 . 13 1 1 A 74 74 GLN H H 74 7.712 8.113 -0.401 1
1 895 . 13 1 1 A 74 74 GLN HA H 74 4.080 3.927 0.153 1
1 902 . 13 1 1 A 74 74 GLN C C 74 177.800 178.345 -0.545 1
1 903 . 13 1 1 A 74 74 GLN CA C 74 57.270 58.580 -1.310 1
1 904 . 13 1 1 A 74 74 GLN CB C 74 28.700 27.896 0.804 1
1 906 . 13 1 1 A 74 74 GLN N N 74 118.200 118.287 -0.087 1
1 908 . 13 1 1 A 75 75 LEU H H 75 7.956 7.940 0.016 1
1 909 . 13 1 1 A 75 75 LEU HA H 75 4.212 3.753 0.459 1
1 919 . 13 1 1 A 75 75 LEU CA C 75 56.660 57.126 -0.466 1
1 920 . 13 1 1 A 75 75 LEU CB C 75 42.000 41.084 0.916 1
1 924 . 13 1 1 A 75 75 LEU N N 75 120.700 120.353 0.347 1
1 925 . 13 1 1 A 76 76 GLN H H 76 8.315 7.507 0.808 1
1 926 . 13 1 1 A 76 76 GLN HA H 76 4.113 4.303 -0.190 1
1 933 . 13 1 1 A 76 76 GLN C C 76 177.100 174.633 2.467 1
1 934 . 13 1 1 A 76 76 GLN CA C 76 57.400 54.906 2.494 1
1 935 . 13 1 1 A 76 76 GLN CB C 76 28.640 27.318 1.322 1
1 937 . 13 1 1 A 76 76 GLN N N 76 120.100 119.054 1.046 1
1 939 . 13 1 1 A 77 77 GLY H H 77 8.021 8.139 -0.118 1
1 940 . 13 1 1 A 77 77 GLY HA2 H 77 4.042 4.139 -0.097 1
1 941 . 13 1 1 A 77 77 GLY HA3 H 77 3.869 4.148 -0.279 1
1 942 . 13 1 1 A 77 77 GLY C C 77 174.600 173.785 0.815 1
1 943 . 13 1 1 A 77 77 GLY CA C 77 45.430 45.955 -0.525 1
1 944 . 13 1 1 A 77 77 GLY N N 77 107.700 110.415 -2.715 1
1 945 . 13 1 1 A 78 78 GLY H H 78 7.819 8.810 -0.991 1
1 946 . 13 1 1 A 78 78 GLY HA2 H 78 4.208 3.995 0.213 1
1 947 . 13 1 1 A 78 78 GLY HA3 H 78 3.801 3.999 -0.198 1
1 948 . 13 1 1 A 78 78 GLY C C 78 173.900 174.097 -0.197 1
1 949 . 13 1 1 A 78 78 GLY CA C 78 45.140 45.030 0.110 1
1 950 . 13 1 1 A 78 78 GLY N N 78 107.100 110.357 -3.257 1
1 951 . 13 1 1 A 79 79 ASP H H 79 7.912 8.280 -0.368 1
1 952 . 13 1 1 A 79 79 ASP HA H 79 4.722 4.540 0.182 1
1 955 . 13 1 1 A 79 79 ASP C C 79 176.200 176.475 -0.275 1
1 956 . 13 1 1 A 79 79 ASP CA C 79 53.210 54.288 -1.078 1
1 957 . 13 1 1 A 79 79 ASP CB C 79 40.160 39.829 0.331 1
1 958 . 13 1 1 A 79 79 ASP N N 79 119.800 119.881 -0.081 1
1 959 . 13 1 1 A 80 80 ASN H H 80 8.450 9.126 -0.676 1
1 960 . 13 1 1 A 80 80 ASN HA H 80 4.593 4.571 0.022 1
1 965 . 13 1 1 A 80 80 ASN C C 80 177.300 177.286 0.014 1
1 966 . 13 1 1 A 80 80 ASN CA C 80 54.680 55.504 -0.824 1
1 967 . 13 1 1 A 80 80 ASN CB C 80 38.790 38.199 0.591 1
1 968 . 13 1 1 A 80 80 ASN N N 80 121.700 119.223 2.477 1
1 970 . 13 1 1 A 81 81 SER H H 81 8.444 7.947 0.497 1
1 971 . 13 1 1 A 81 81 SER HA H 81 4.263 4.231 0.032 1
1 974 . 13 1 1 A 81 81 SER C C 81 176.100 176.772 -0.672 1
1 975 . 13 1 1 A 81 81 SER CA C 81 61.470 61.562 -0.092 1
1 976 . 13 1 1 A 81 81 SER CB C 81 61.470 62.752 -1.282 1
1 977 . 13 1 1 A 81 81 SER N N 81 117.100 115.527 1.573 1
1 978 . 13 1 1 A 82 82 LEU H H 82 7.929 8.155 -0.226 1
1 979 . 13 1 1 A 82 82 LEU HA H 82 4.332 3.867 0.465 1
1 989 . 13 1 1 A 82 82 LEU C C 82 177.400 178.820 -1.420 1
1 990 . 13 1 1 A 82 82 LEU CA C 82 55.060 57.897 -2.837 1
1 991 . 13 1 1 A 82 82 LEU CB C 82 41.940 41.506 0.434 1
1 995 . 13 1 1 A 82 82 LEU N N 82 120.400 121.570 -1.170 1
1 996 . 13 1 1 A 83 83 HIS H H 83 8.014 7.811 0.203 1
1 997 . 13 1 1 A 83 83 HIS HA H 83 4.173 4.272 -0.099 1
1 1000 . 13 1 1 A 83 83 HIS C C 83 176.100 176.807 -0.707 1
1 1001 . 13 1 1 A 83 83 HIS CA C 83 59.940 58.948 0.992 1
1 1002 . 13 1 1 A 83 83 HIS CB C 83 28.050 29.688 -1.638 1
1 1003 . 13 1 1 A 83 83 HIS N N 83 119.400 118.014 1.386 1
1 1004 . 13 1 1 A 84 84 ASN H H 84 8.598 8.750 -0.152 1
1 1005 . 13 1 1 A 84 84 ASN HA H 84 4.735 4.724 0.011 1
1 1010 . 13 1 1 A 84 84 ASN C C 84 177.400 177.185 0.215 1
1 1011 . 13 1 1 A 84 84 ASN CA C 84 55.790 54.884 0.906 1
1 1012 . 13 1 1 A 84 84 ASN CB C 84 37.520 38.989 -1.469 1
1 1013 . 13 1 1 A 84 84 ASN N N 84 118.100 117.988 0.112 1
1 1015 . 13 1 1 A 85 85 VAL H H 85 7.933 7.705 0.228 1
1 1016 . 13 1 1 A 85 85 VAL HA H 85 3.849 3.831 0.018 1
1 1024 . 13 1 1 A 85 85 VAL C C 85 177.100 177.908 -0.808 1
1 1025 . 13 1 1 A 85 85 VAL CA C 85 65.490 65.570 -0.080 1
1 1026 . 13 1 1 A 85 85 VAL CB C 85 31.760 31.890 -0.130 1
1 1029 . 13 1 1 A 85 85 VAL N N 85 120.500 120.238 0.262 1
1 1030 . 13 1 1 A 86 86 HIS H H 86 8.460 9.383 -0.923 1
1 1031 . 13 1 1 A 86 86 HIS HA H 86 4.054 4.014 0.040 1
1 1035 . 13 1 1 A 86 86 HIS C C 86 176.300 177.480 -1.180 1
1 1036 . 13 1 1 A 86 86 HIS CA C 86 59.860 60.320 -0.460 1
1 1037 . 13 1 1 A 86 86 HIS CB C 86 29.670 29.777 -0.107 1
1 1038 . 13 1 1 A 86 86 HIS N N 86 119.300 119.233 0.067 1
1 1039 . 13 1 1 A 87 87 GLU H H 87 7.897 8.512 -0.615 1
1 1040 . 13 1 1 A 87 87 GLU HA H 87 3.838 3.706 0.132 1
1 1045 . 13 1 1 A 87 87 GLU C C 87 178.300 179.544 -1.244 1
1 1046 . 13 1 1 A 87 87 GLU CA C 87 58.690 59.320 -0.630 1
1 1047 . 13 1 1 A 87 87 GLU CB C 87 28.460 29.785 -1.325 1
1 1049 . 13 1 1 A 87 87 GLU N N 87 117.100 119.256 -2.156 1
1 1050 . 13 1 1 A 88 88 ASN H H 88 8.103 8.824 -0.721 1
1 1051 . 13 1 1 A 88 88 ASN HA H 88 4.503 4.364 0.139 1
1 1056 . 13 1 1 A 88 88 ASN C C 88 177.700 177.768 -0.068 1
1 1057 . 13 1 1 A 88 88 ASN CA C 88 55.990 56.252 -0.262 1
1 1058 . 13 1 1 A 88 88 ASN CB C 88 39.010 38.456 0.554 1
1 1059 . 13 1 1 A 88 88 ASN N N 88 118.400 116.825 1.575 1
1 1061 . 13 1 1 A 89 89 ILE H H 89 8.501 8.156 0.345 1
1 1062 . 13 1 1 A 89 89 ILE HA H 89 3.670 3.712 -0.042 1
1 1072 . 13 1 1 A 89 89 ILE C C 89 177.000 177.996 -0.996 1
1 1073 . 13 1 1 A 89 89 ILE CA C 89 65.390 65.311 0.079 1
1 1074 . 13 1 1 A 89 89 ILE CB C 89 37.440 37.687 -0.247 1
1 1078 . 13 1 1 A 89 89 ILE N N 89 118.700 119.215 -0.515 1
1 1079 . 13 1 1 A 90 90 LYS H H 90 8.017 7.399 0.618 1
1 1080 . 13 1 1 A 90 90 LYS HA H 90 3.775 3.921 -0.146 1
1 1089 . 13 1 1 A 90 90 LYS C C 90 178.800 178.814 -0.014 1
1 1090 . 13 1 1 A 90 90 LYS CA C 90 60.450 59.743 0.707 1
1 1091 . 13 1 1 A 90 90 LYS CB C 90 32.110 32.249 -0.139 1
1 1095 . 13 1 1 A 90 90 LYS N N 90 120.900 120.136 0.764 1
1 1096 . 13 1 1 A 91 91 GLU H H 91 7.732 7.931 -0.199 1
1 1097 . 13 1 1 A 91 91 GLU HA H 91 4.083 4.091 -0.008 1
1 1102 . 13 1 1 A 91 91 GLU C C 91 179.100 178.915 0.185 1
1 1103 . 13 1 1 A 91 91 GLU CA C 91 59.120 58.917 0.203 1
1 1104 . 13 1 1 A 91 91 GLU CB C 91 28.810 29.920 -1.110 1
1 1106 . 13 1 1 A 91 91 GLU N N 91 119.300 118.334 0.966 1
1 1107 . 13 1 1 A 92 92 ILE H H 92 8.110 9.002 -0.892 1
1 1108 . 13 1 1 A 92 92 ILE HA H 92 3.685 3.543 0.142 1
1 1118 . 13 1 1 A 92 92 ILE C C 92 178.000 178.137 -0.137 1
1 1119 . 13 1 1 A 92 92 ILE CA C 92 65.900 65.201 0.699 1
1 1120 . 13 1 1 A 92 92 ILE CB C 92 38.400 37.941 0.459 1
1 1124 . 13 1 1 A 92 92 ILE N N 92 121.100 120.681 0.419 1
1 1125 . 13 1 1 A 93 93 PHE H H 93 8.651 8.965 -0.314 1
1 1126 . 13 1 1 A 93 93 PHE HA H 93 3.873 3.115 0.758 1
1 1133 . 13 1 1 A 93 93 PHE C C 93 177.100 177.794 -0.694 1
1 1134 . 13 1 1 A 93 93 PHE CA C 93 61.020 61.230 -0.210 1
1 1135 . 13 1 1 A 93 93 PHE CB C 93 38.560 38.156 0.404 1
1 1138 . 13 1 1 A 93 93 PHE N N 93 119.400 120.981 -1.581 1
1 1139 . 13 1 1 A 94 94 HIS H H 94 8.126 7.312 0.814 1
1 1140 . 13 1 1 A 94 94 HIS HA H 94 4.368 3.850 0.518 1
1 1145 . 13 1 1 A 94 94 HIS C C 94 177.100 177.138 -0.038 1
1 1146 . 13 1 1 A 94 94 HIS CA C 94 58.310 57.468 0.842 1
1 1147 . 13 1 1 A 94 94 HIS CB C 94 27.910 29.610 -1.700 1
1 1148 . 13 1 1 A 94 94 HIS N N 94 116.400 117.847 -1.447 1
1 1149 . 13 1 1 A 95 95 HIS H H 95 8.058 8.241 -0.183 1
1 1150 . 13 1 1 A 95 95 HIS HA H 95 4.465 4.246 0.219 1
1 1154 . 13 1 1 A 95 95 HIS C C 95 177.300 177.680 -0.380 1
1 1155 . 13 1 1 A 95 95 HIS CA C 95 57.900 59.355 -1.455 1
1 1156 . 13 1 1 A 95 95 HIS CB C 95 28.490 30.595 -2.105 1
1 1157 . 13 1 1 A 95 95 HIS N N 95 117.000 116.678 0.322 1
1 1158 . 13 1 1 A 96 96 LEU H H 96 8.525 7.925 0.600 1
1 1159 . 13 1 1 A 96 96 LEU HA H 96 3.865 3.762 0.103 1
1 1169 . 13 1 1 A 96 96 LEU C C 96 178.300 178.642 -0.342 1
1 1170 . 13 1 1 A 96 96 LEU CA C 96 58.250 58.063 0.187 1
1 1171 . 13 1 1 A 96 96 LEU CB C 96 41.720 41.829 -0.109 1
1 1175 . 13 1 1 A 96 96 LEU N N 96 121.300 120.683 0.617 1
1 1176 . 13 1 1 A 97 97 GLU H H 97 8.076 8.239 -0.163 1
1 1177 . 13 1 1 A 97 97 GLU HA H 97 3.719 4.085 -0.366 1
1 1182 . 13 1 1 A 97 97 GLU C C 97 178.300 177.995 0.305 1
1 1183 . 13 1 1 A 97 97 GLU CA C 97 59.300 58.653 0.647 1
1 1184 . 13 1 1 A 97 97 GLU CB C 97 28.960 29.595 -0.635 1
1 1186 . 13 1 1 A 97 97 GLU N N 97 117.100 118.524 -1.424 1
1 1187 . 13 1 1 A 98 98 GLU H H 98 7.329 7.645 -0.316 1
1 1188 . 13 1 1 A 98 98 GLU HA H 98 4.024 4.274 -0.250 1
1 1193 . 13 1 1 A 98 98 GLU C C 98 177.900 178.732 -0.832 1
1 1194 . 13 1 1 A 98 98 GLU CA C 98 58.190 58.172 0.018 1
1 1195 . 13 1 1 A 98 98 GLU CB C 98 29.120 30.090 -0.970 1
1 1197 . 13 1 1 A 98 98 GLU N N 98 116.000 118.412 -2.412 1
1 1198 . 13 1 1 A 99 99 LEU H H 99 7.535 7.934 -0.399 1
1 1199 . 13 1 1 A 99 99 LEU HA H 99 4.183 4.124 0.059 1
1 1209 . 13 1 1 A 99 99 LEU C C 99 178.100 177.439 0.661 1
1 1210 . 13 1 1 A 99 99 LEU CA C 99 56.440 56.453 -0.013 1
1 1211 . 13 1 1 A 99 99 LEU CB C 99 43.010 41.279 1.731 1
1 1215 . 13 1 1 A 99 99 LEU N N 99 118.200 119.673 -1.473 1
1 1216 . 13 1 1 A 100 100 VAL H H 100 7.561 7.392 0.169 1
1 1217 . 13 1 1 A 100 100 VAL HA H 100 4.033 4.461 -0.428 1
1 1225 . 13 1 1 A 100 100 VAL C C 100 175.400 177.501 -2.101 1
1 1226 . 13 1 1 A 100 100 VAL CA C 100 62.430 63.021 -0.591 1
1 1227 . 13 1 1 A 100 100 VAL CB C 100 32.050 33.286 -1.236 1
1 1230 . 13 1 1 A 100 100 VAL N N 100 114.800 113.680 1.120 1
1 1231 . 13 1 1 A 101 101 HIS H H 101 7.827 7.951 -0.124 1
1 1232 . 13 1 1 A 101 101 HIS HA H 101 4.630 4.270 0.360 1
1 1237 . 13 1 1 A 101 101 HIS C C 101 173.500 176.247 -2.747 1
1 1238 . 13 1 1 A 101 101 HIS CA C 101 55.410 58.910 -3.500 1
1 1239 . 13 1 1 A 101 101 HIS CB C 101 28.870 29.837 -0.967 1
1 1240 . 13 1 1 A 101 101 HIS N N 101 120.300 122.277 -1.977 1
1 10 . 14 1 1 A 2 2 TYR H H 2 8.688 7.635 1.053 1
1 11 . 14 1 1 A 2 2 TYR HA H 2 4.737 4.178 0.559 1
1 16 . 14 1 1 A 2 2 TYR C C 2 175.900 176.254 -0.354 1
1 17 . 14 1 1 A 2 2 TYR CA C 2 57.920 60.602 -2.682 1
1 18 . 14 1 1 A 2 2 TYR CB C 2 38.340 38.814 -0.474 1
1 19 . 14 1 1 A 2 2 TYR N N 2 122.100 124.283 -2.183 1
1 20 . 14 1 1 A 3 3 GLY H H 3 8.434 8.088 0.346 1
1 21 . 14 1 1 A 3 3 GLY HA2 H 3 3.909 3.991 -0.082 1
1 22 . 14 1 1 A 3 3 GLY HA3 H 3 3.841 4.000 -0.159 1
1 23 . 14 1 1 A 3 3 GLY C C 3 174.300 175.997 -1.697 1
1 24 . 14 1 1 A 3 3 GLY CA C 3 46.050 45.281 0.769 1
1 25 . 14 1 1 A 3 3 GLY N N 3 111.100 108.416 2.684 1
1 26 . 14 1 1 A 4 4 LYS H H 4 8.060 8.382 -0.322 1
1 27 . 14 1 1 A 4 4 LYS HA H 4 4.297 4.073 0.224 1
1 36 . 14 1 1 A 4 4 LYS C C 4 178.000 179.410 -1.410 1
1 37 . 14 1 1 A 4 4 LYS CA C 4 56.930 59.299 -2.369 1
1 38 . 14 1 1 A 4 4 LYS CB C 4 32.680 32.307 0.373 1
1 42 . 14 1 1 A 4 4 LYS N N 4 119.500 121.389 -1.889 1
1 43 . 14 1 1 A 5 5 LEU H H 5 8.243 8.175 0.068 1
1 44 . 14 1 1 A 5 5 LEU HA H 5 3.947 3.983 -0.036 1
1 54 . 14 1 1 A 5 5 LEU C C 5 177.900 178.903 -1.003 1
1 55 . 14 1 1 A 5 5 LEU CA C 5 57.930 57.851 0.079 1
1 56 . 14 1 1 A 5 5 LEU CB C 5 41.620 41.767 -0.147 1
1 60 . 14 1 1 A 5 5 LEU N N 5 120.800 119.832 0.968 1
1 61 . 14 1 1 A 6 6 ASN H H 6 8.256 8.562 -0.306 1
1 62 . 14 1 1 A 6 6 ASN HA H 6 4.252 4.484 -0.232 1
1 67 . 14 1 1 A 6 6 ASN C C 6 177.300 177.413 -0.113 1
1 68 . 14 1 1 A 6 6 ASN CA C 6 56.900 55.795 1.105 1
1 69 . 14 1 1 A 6 6 ASN CB C 6 38.200 37.671 0.529 1
1 70 . 14 1 1 A 6 6 ASN N N 6 116.200 115.749 0.451 1
1 72 . 14 1 1 A 7 7 ASP H H 7 7.699 9.064 -1.365 1
1 73 . 14 1 1 A 7 7 ASP HA H 7 4.320 4.434 -0.114 1
1 76 . 14 1 1 A 7 7 ASP C C 7 178.000 178.378 -0.378 1
1 77 . 14 1 1 A 7 7 ASP CA C 7 56.980 57.261 -0.281 1
1 78 . 14 1 1 A 7 7 ASP CB C 7 39.870 40.564 -0.694 1
1 79 . 14 1 1 A 7 7 ASP N N 7 119.100 120.304 -1.204 1
1 80 . 14 1 1 A 8 8 LEU H H 8 7.580 8.759 -1.179 1
1 81 . 14 1 1 A 8 8 LEU HA H 8 4.091 4.158 -0.067 1
1 91 . 14 1 1 A 8 8 LEU C C 8 178.800 179.079 -0.279 1
1 92 . 14 1 1 A 8 8 LEU CA C 8 57.790 57.618 0.172 1
1 93 . 14 1 1 A 8 8 LEU CB C 8 41.880 41.617 0.263 1
1 97 . 14 1 1 A 8 8 LEU N N 8 120.400 120.180 0.220 1
1 98 . 14 1 1 A 9 9 LEU H H 9 8.125 9.114 -0.989 1
1 99 . 14 1 1 A 9 9 LEU HA H 9 3.891 4.016 -0.125 1
1 109 . 14 1 1 A 9 9 LEU C C 9 178.900 178.646 0.254 1
1 110 . 14 1 1 A 9 9 LEU CA C 9 58.350 58.646 -0.296 1
1 111 . 14 1 1 A 9 9 LEU CB C 9 41.510 41.960 -0.450 1
1 115 . 14 1 1 A 9 9 LEU N N 9 118.900 120.082 -1.182 1
1 116 . 14 1 1 A 10 10 GLU H H 10 8.011 8.618 -0.607 1
1 117 . 14 1 1 A 10 10 GLU HA H 10 4.072 4.253 -0.181 1
1 122 . 14 1 1 A 10 10 GLU C C 10 179.000 179.170 -0.170 1
1 123 . 14 1 1 A 10 10 GLU CA C 10 59.090 59.705 -0.615 1
1 124 . 14 1 1 A 10 10 GLU CB C 10 27.910 29.149 -1.239 1
1 126 . 14 1 1 A 10 10 GLU N N 10 119.300 118.003 1.297 1
1 127 . 14 1 1 A 11 11 ASP H H 11 8.128 7.831 0.297 1
1 128 . 14 1 1 A 11 11 ASP HA H 11 4.383 4.427 -0.044 1
1 131 . 14 1 1 A 11 11 ASP C C 11 178.500 178.955 -0.455 1
1 132 . 14 1 1 A 11 11 ASP CA C 11 56.580 57.446 -0.866 1
1 133 . 14 1 1 A 11 11 ASP CB C 11 38.600 40.631 -2.031 1
1 134 . 14 1 1 A 11 11 ASP N N 11 119.600 120.653 -1.053 1
1 135 . 14 1 1 A 12 12 LEU H H 12 8.394 8.131 0.263 1
1 136 . 14 1 1 A 12 12 LEU HA H 12 3.923 4.158 -0.235 1
1 146 . 14 1 1 A 12 12 LEU C C 12 178.200 178.689 -0.489 1
1 147 . 14 1 1 A 12 12 LEU CA C 12 57.880 58.268 -0.388 1
1 148 . 14 1 1 A 12 12 LEU CB C 12 41.850 42.095 -0.245 1
1 152 . 14 1 1 A 12 12 LEU N N 12 120.500 120.831 -0.331 1
1 153 . 14 1 1 A 13 13 GLN H H 13 8.371 8.753 -0.382 1
1 154 . 14 1 1 A 13 13 GLN HA H 13 3.879 4.063 -0.184 1
1 161 . 14 1 1 A 13 13 GLN C C 13 178.600 177.845 0.755 1
1 162 . 14 1 1 A 13 13 GLN CA C 13 59.570 58.232 1.338 1
1 163 . 14 1 1 A 13 13 GLN CB C 13 28.440 27.870 0.570 1
1 165 . 14 1 1 A 13 13 GLN N N 13 118.400 117.228 1.172 1
1 167 . 14 1 1 A 14 14 GLU H H 14 7.913 7.889 0.024 1
1 168 . 14 1 1 A 14 14 GLU HA H 14 4.021 4.120 -0.099 1
1 173 . 14 1 1 A 14 14 GLU C C 14 179.000 179.013 -0.013 1
1 174 . 14 1 1 A 14 14 GLU CA C 14 59.030 59.127 -0.097 1
1 175 . 14 1 1 A 14 14 GLU CB C 14 28.720 29.654 -0.934 1
1 177 . 14 1 1 A 14 14 GLU N N 14 119.100 119.768 -0.668 1
1 178 . 14 1 1 A 15 15 VAL H H 15 7.991 7.829 0.162 1
1 179 . 14 1 1 A 15 15 VAL HA H 15 3.696 3.961 -0.265 1
1 187 . 14 1 1 A 15 15 VAL C C 15 178.300 177.944 0.356 1
1 188 . 14 1 1 A 15 15 VAL CA C 15 66.640 65.617 1.023 1
1 189 . 14 1 1 A 15 15 VAL CB C 15 31.470 31.426 0.044 1
1 192 . 14 1 1 A 15 15 VAL N N 15 120.300 117.662 2.638 1
1 193 . 14 1 1 A 16 16 LEU H H 16 8.172 7.485 0.687 1
1 194 . 14 1 1 A 16 16 LEU HA H 16 3.876 4.208 -0.332 1
1 204 . 14 1 1 A 16 16 LEU C C 16 178.400 178.451 -0.051 1
1 205 . 14 1 1 A 16 16 LEU CA C 16 58.050 57.164 0.886 1
1 206 . 14 1 1 A 16 16 LEU CB C 16 41.420 41.807 -0.387 1
1 210 . 14 1 1 A 16 16 LEU N N 16 119.700 124.056 -4.356 1
1 211 . 14 1 1 A 17 17 LYS H H 17 7.755 9.125 -1.370 1
1 212 . 14 1 1 A 17 17 LYS HA H 17 3.951 3.982 -0.031 1
1 221 . 14 1 1 A 17 17 LYS C C 17 178.800 178.522 0.278 1
1 222 . 14 1 1 A 17 17 LYS CA C 17 59.470 59.005 0.465 1
1 223 . 14 1 1 A 17 17 LYS CB C 17 32.350 32.530 -0.180 1
1 227 . 14 1 1 A 17 17 LYS N N 17 117.800 119.511 -1.711 1
1 228 . 14 1 1 A 18 18 HIS H H 18 7.847 7.767 0.080 1
1 229 . 14 1 1 A 18 18 HIS HA H 18 4.549 4.476 0.073 1
1 233 . 14 1 1 A 18 18 HIS C C 18 177.200 175.989 1.211 1
1 234 . 14 1 1 A 18 18 HIS CA C 18 57.870 56.895 0.975 1
1 235 . 14 1 1 A 18 18 HIS CB C 18 28.730 28.952 -0.222 1
1 236 . 14 1 1 A 18 18 HIS N N 18 116.200 116.658 -0.458 1
1 237 . 14 1 1 A 19 19 VAL H H 19 8.415 7.829 0.586 1
1 238 . 14 1 1 A 19 19 VAL HA H 19 3.746 4.125 -0.379 1
1 246 . 14 1 1 A 19 19 VAL CA C 19 65.850 63.757 2.093 1
1 247 . 14 1 1 A 19 19 VAL CB C 19 31.600 33.407 -1.807 1
1 250 . 14 1 1 A 20 20 ASN H H 20 8.041 8.371 -0.330 1
1 251 . 14 1 1 A 20 20 ASN HA H 20 4.545 4.526 0.019 1
1 256 . 14 1 1 A 20 20 ASN C C 20 176.900 176.724 0.176 1
1 257 . 14 1 1 A 20 20 ASN CA C 20 55.070 56.293 -1.223 1
1 258 . 14 1 1 A 20 20 ASN CB C 20 38.270 39.222 -0.952 1
1 259 . 14 1 1 A 20 20 ASN N N 20 117.900 119.570 -1.670 1
1 261 . 14 1 1 A 21 21 GLN H H 21 7.887 7.765 0.122 1
1 262 . 14 1 1 A 21 21 GLN HA H 21 4.096 4.460 -0.364 1
1 269 . 14 1 1 A 21 21 GLN C C 21 176.900 177.549 -0.649 1
1 270 . 14 1 1 A 21 21 GLN CA C 21 57.510 57.725 -0.215 1
1 271 . 14 1 1 A 21 21 GLN CB C 21 29.100 29.800 -0.700 1
1 273 . 14 1 1 A 21 21 GLN N N 21 117.900 117.334 0.566 1
1 275 . 14 1 1 A 22 22 HIS H H 22 7.887 7.605 0.282 1
1 276 . 14 1 1 A 22 22 HIS HA H 22 4.679 4.765 -0.086 1
1 280 . 14 1 1 A 22 22 HIS C C 22 174.300 175.113 -0.813 1
1 281 . 14 1 1 A 22 22 HIS CA C 22 55.770 55.254 0.516 1
1 282 . 14 1 1 A 22 22 HIS CB C 22 28.630 28.163 0.467 1
1 283 . 14 1 1 A 22 22 HIS N N 22 116.100 114.140 1.960 1
1 284 . 14 1 1 A 23 23 TRP H H 23 7.929 8.125 -0.196 1
1 285 . 14 1 1 A 23 23 TRP HA H 23 4.542 5.049 -0.507 1
1 292 . 14 1 1 A 23 23 TRP C C 23 176.600 175.389 1.211 1
1 293 . 14 1 1 A 23 23 TRP CA C 23 58.020 56.727 1.293 1
1 294 . 14 1 1 A 23 23 TRP CB C 23 29.700 31.879 -2.179 1
1 295 . 14 1 1 A 23 23 TRP N N 23 122.000 123.262 -1.262 1
1 297 . 14 1 1 A 24 24 GLN H H 24 8.258 8.294 -0.036 1
1 298 . 14 1 1 A 24 24 GLN HA H 24 4.329 4.786 -0.457 1
1 305 . 14 1 1 A 24 24 GLN C C 24 176.200 175.398 0.802 1
1 306 . 14 1 1 A 24 24 GLN CA C 24 55.960 54.759 1.201 1
1 307 . 14 1 1 A 24 24 GLN CB C 24 29.440 30.704 -1.264 1
1 309 . 14 1 1 A 24 24 GLN N N 24 123.800 124.226 -0.426 1
1 311 . 14 1 1 A 25 25 GLY H H 25 7.470 8.845 -1.375 1
1 312 . 14 1 1 A 25 25 GLY HA2 H 25 3.939 3.792 0.147 1
1 313 . 14 1 1 A 25 25 GLY HA3 H 25 3.800 3.813 -0.013 1
1 314 . 14 1 1 A 25 25 GLY C C 25 174.800 174.962 -0.162 1
1 315 . 14 1 1 A 25 25 GLY CA C 25 45.470 47.140 -1.670 1
1 316 . 14 1 1 A 25 25 GLY N N 25 108.100 109.177 -1.077 1
1 317 . 14 1 1 A 26 26 GLY H H 26 8.332 8.713 -0.381 1
1 318 . 14 1 1 A 26 26 GLY HA2 H 26 4.105 4.160 -0.055 1
1 319 . 14 1 1 A 26 26 GLY HA3 H 26 3.974 4.189 -0.215 1
1 320 . 14 1 1 A 26 26 GLY C C 26 174.900 174.854 0.046 1
1 321 . 14 1 1 A 26 26 GLY CA C 26 45.410 45.058 0.352 1
1 322 . 14 1 1 A 26 26 GLY N N 26 108.700 106.706 1.994 1
1 323 . 14 1 1 A 27 27 GLN H H 27 8.474 8.689 -0.215 1
1 324 . 14 1 1 A 27 27 GLN HA H 27 4.106 4.337 -0.231 1
1 331 . 14 1 1 A 27 27 GLN C C 27 177.100 176.459 0.641 1
1 332 . 14 1 1 A 27 27 GLN CA C 27 57.540 56.515 1.025 1
1 333 . 14 1 1 A 27 27 GLN CB C 27 29.050 28.697 0.353 1
1 335 . 14 1 1 A 27 27 GLN N N 27 121.100 122.321 -1.221 1
1 337 . 14 1 1 A 28 28 LYS H H 28 8.448 8.262 0.186 1
1 338 . 14 1 1 A 28 28 LYS HA H 28 4.068 4.111 -0.043 1
1 347 . 14 1 1 A 28 28 LYS C C 28 177.900 178.324 -0.424 1
1 348 . 14 1 1 A 28 28 LYS CA C 28 58.410 58.291 0.119 1
1 349 . 14 1 1 A 28 28 LYS CB C 28 32.210 32.943 -0.733 1
1 353 . 14 1 1 A 28 28 LYS N N 28 120.500 118.153 2.347 1
1 354 . 14 1 1 A 29 29 ASN H H 29 8.273 7.766 0.507 1
1 355 . 14 1 1 A 29 29 ASN HA H 29 4.584 4.478 0.106 1
1 360 . 14 1 1 A 29 29 ASN C C 29 176.200 177.417 -1.217 1
1 361 . 14 1 1 A 29 29 ASN CA C 29 54.400 55.952 -1.552 1
1 362 . 14 1 1 A 29 29 ASN CB C 29 38.280 38.550 -0.270 1
1 363 . 14 1 1 A 29 29 ASN N N 29 117.500 118.018 -0.518 1
1 365 . 14 1 1 A 30 30 MET H H 30 7.870 7.594 0.276 1
1 366 . 14 1 1 A 30 30 MET HA H 30 4.085 2.481 1.604 1
1 371 . 14 1 1 A 30 30 MET C C 30 177.000 177.779 -0.779 1
1 372 . 14 1 1 A 30 30 MET CA C 30 56.880 57.668 -0.788 1
1 373 . 14 1 1 A 30 30 MET CB C 30 32.340 31.428 0.912 1
1 375 . 14 1 1 A 30 30 MET N N 30 121.100 118.732 2.368 1
1 376 . 14 1 1 A 31 31 ASN H H 31 8.186 7.448 0.738 1
1 377 . 14 1 1 A 31 31 ASN HA H 31 4.311 4.435 -0.124 1
1 382 . 14 1 1 A 31 31 ASN C C 31 176.700 177.929 -1.229 1
1 383 . 14 1 1 A 31 31 ASN CA C 31 55.320 55.694 -0.374 1
1 384 . 14 1 1 A 31 31 ASN CB C 31 38.410 38.276 0.134 1
1 385 . 14 1 1 A 31 31 ASN N N 31 117.900 116.098 1.802 1
1 387 . 14 1 1 A 32 32 LYS H H 32 7.792 7.599 0.193 1
1 388 . 14 1 1 A 32 32 LYS HA H 32 3.992 3.930 0.062 1
1 397 . 14 1 1 A 32 32 LYS C C 32 177.900 178.731 -0.831 1
1 398 . 14 1 1 A 32 32 LYS CA C 32 59.050 59.485 -0.435 1
1 399 . 14 1 1 A 32 32 LYS CB C 32 32.460 32.413 0.047 1
1 403 . 14 1 1 A 32 32 LYS N N 32 120.400 119.538 0.862 1
1 404 . 14 1 1 A 33 33 VAL H H 33 7.689 8.340 -0.651 1
1 405 . 14 1 1 A 33 33 VAL HA H 33 3.791 3.819 -0.028 1
1 413 . 14 1 1 A 33 33 VAL C C 33 177.100 177.493 -0.393 1
1 414 . 14 1 1 A 33 33 VAL CA C 33 65.360 65.154 0.206 1
1 415 . 14 1 1 A 33 33 VAL CB C 33 31.920 31.658 0.262 1
1 418 . 14 1 1 A 33 33 VAL N N 33 120.200 116.036 4.164 1
1 419 . 14 1 1 A 34 34 ASP H H 34 8.408 8.294 0.114 1
1 420 . 14 1 1 A 34 34 ASP HA H 34 4.303 4.252 0.051 1
1 423 . 14 1 1 A 34 34 ASP C C 34 178.200 178.121 0.079 1
1 424 . 14 1 1 A 34 34 ASP CA C 34 55.880 56.963 -1.083 1
1 425 . 14 1 1 A 34 34 ASP CB C 34 38.710 40.784 -2.074 1
1 426 . 14 1 1 A 34 34 ASP N N 34 120.100 122.194 -2.094 1
1 427 . 14 1 1 A 35 35 HIS H H 35 8.204 7.473 0.731 1
1 428 . 14 1 1 A 35 35 HIS HA H 35 4.343 4.277 0.066 1
1 431 . 14 1 1 A 35 35 HIS C C 35 176.800 177.275 -0.475 1
1 432 . 14 1 1 A 35 35 HIS CA C 35 58.310 59.724 -1.414 1
1 433 . 14 1 1 A 35 35 HIS CB C 35 28.070 29.861 -1.791 1
1 434 . 14 1 1 A 35 35 HIS N N 35 118.200 119.160 -0.960 1
1 435 . 14 1 1 A 36 36 HIS H H 36 8.067 7.909 0.158 1
1 436 . 14 1 1 A 36 36 HIS HA H 36 4.602 4.572 0.030 1
1 440 . 14 1 1 A 36 36 HIS C C 36 177.100 177.542 -0.442 1
1 441 . 14 1 1 A 36 36 HIS CA C 36 58.520 59.553 -1.033 1
1 442 . 14 1 1 A 36 36 HIS CB C 36 28.720 29.884 -1.164 1
1 443 . 14 1 1 A 36 36 HIS N N 36 117.100 116.763 0.337 1
1 444 . 14 1 1 A 37 37 LEU H H 37 8.473 8.520 -0.047 1
1 445 . 14 1 1 A 37 37 LEU HA H 37 3.894 3.782 0.112 1
1 455 . 14 1 1 A 37 37 LEU C C 37 178.200 178.030 0.170 1
1 456 . 14 1 1 A 37 37 LEU CA C 37 58.520 57.941 0.579 1
1 457 . 14 1 1 A 37 37 LEU CB C 37 41.810 41.913 -0.103 1
1 461 . 14 1 1 A 37 37 LEU N N 37 119.600 120.673 -1.073 1
1 462 . 14 1 1 A 38 38 GLN H H 38 8.337 8.626 -0.289 1
1 463 . 14 1 1 A 38 38 GLN HA H 38 3.882 3.896 -0.014 1
1 470 . 14 1 1 A 38 38 GLN C C 38 178.500 177.379 1.121 1
1 471 . 14 1 1 A 38 38 GLN CA C 38 59.200 58.713 0.487 1
1 472 . 14 1 1 A 38 38 GLN CB C 38 27.850 28.368 -0.518 1
1 474 . 14 1 1 A 38 38 GLN N N 38 118.000 118.045 -0.045 1
1 476 . 14 1 1 A 39 39 ASN H H 39 7.923 7.778 0.145 1
1 477 . 14 1 1 A 39 39 ASN HA H 39 4.390 4.560 -0.170 1
1 482 . 14 1 1 A 39 39 ASN C C 39 177.500 177.784 -0.284 1
1 483 . 14 1 1 A 39 39 ASN CA C 39 55.780 55.676 0.104 1
1 484 . 14 1 1 A 39 39 ASN CB C 39 37.450 38.755 -1.305 1
1 485 . 14 1 1 A 39 39 ASN N N 39 118.700 116.257 2.443 1
1 487 . 14 1 1 A 40 40 VAL H H 40 7.907 8.492 -0.585 1
1 488 . 14 1 1 A 40 40 VAL HA H 40 3.629 3.460 0.169 1
1 496 . 14 1 1 A 40 40 VAL C C 40 177.500 177.976 -0.476 1
1 497 . 14 1 1 A 40 40 VAL CA C 40 67.080 66.334 0.746 1
1 498 . 14 1 1 A 40 40 VAL CB C 40 31.390 31.100 0.290 1
1 501 . 14 1 1 A 40 40 VAL N N 40 120.400 120.938 -0.538 1
1 502 . 14 1 1 A 41 41 ILE H H 41 8.103 8.136 -0.033 1
1 503 . 14 1 1 A 41 41 ILE HA H 41 3.401 3.655 -0.254 1
1 513 . 14 1 1 A 41 41 ILE C C 41 178.000 178.423 -0.423 1
1 514 . 14 1 1 A 41 41 ILE CA C 41 66.430 65.373 1.057 1
1 515 . 14 1 1 A 41 41 ILE CB C 41 38.050 37.643 0.407 1
1 519 . 14 1 1 A 41 41 ILE N N 41 120.600 119.968 0.632 1
1 520 . 14 1 1 A 42 42 GLU H H 42 8.150 8.132 0.018 1
1 521 . 14 1 1 A 42 42 GLU HA H 42 4.062 4.070 -0.008 1
1 526 . 14 1 1 A 42 42 GLU C C 42 178.500 178.900 -0.400 1
1 527 . 14 1 1 A 42 42 GLU CA C 42 59.120 59.350 -0.230 1
1 528 . 14 1 1 A 42 42 GLU CB C 42 28.160 29.050 -0.890 1
1 530 . 14 1 1 A 42 42 GLU N N 42 119.900 121.945 -2.045 1
1 531 . 14 1 1 A 43 43 ASP H H 43 8.453 8.639 -0.186 1
1 532 . 14 1 1 A 43 43 ASP HA H 43 4.445 4.482 -0.037 1
1 535 . 14 1 1 A 43 43 ASP C C 43 178.400 178.715 -0.315 1
1 536 . 14 1 1 A 43 43 ASP CA C 43 56.490 57.504 -1.014 1
1 537 . 14 1 1 A 43 43 ASP CB C 43 37.820 41.224 -3.404 1
1 538 . 14 1 1 A 43 43 ASP N N 43 119.700 120.297 -0.597 1
1 539 . 14 1 1 A 44 44 ILE H H 44 8.544 7.889 0.655 1
1 540 . 14 1 1 A 44 44 ILE HA H 44 3.590 3.748 -0.158 1
1 550 . 14 1 1 A 44 44 ILE C C 44 177.800 178.033 -0.233 1
1 551 . 14 1 1 A 44 44 ILE CA C 44 66.320 65.418 0.902 1
1 552 . 14 1 1 A 44 44 ILE CB C 44 37.690 37.922 -0.232 1
1 556 . 14 1 1 A 44 44 ILE N N 44 121.500 119.895 1.605 1
1 557 . 14 1 1 A 45 45 HIS H H 45 8.261 8.317 -0.056 1
1 558 . 14 1 1 A 45 45 HIS HA H 45 4.255 4.131 0.124 1
1 562 . 14 1 1 A 45 45 HIS C C 45 177.200 176.850 0.350 1
1 563 . 14 1 1 A 45 45 HIS CA C 45 59.580 59.911 -0.331 1
1 564 . 14 1 1 A 45 45 HIS CB C 45 27.790 30.276 -2.486 1
1 565 . 14 1 1 A 45 45 HIS N N 45 118.800 119.732 -0.932 1
1 566 . 14 1 1 A 46 46 ASP H H 46 8.680 8.094 0.586 1
1 567 . 14 1 1 A 46 46 ASP HA H 46 4.338 4.586 -0.248 1
1 570 . 14 1 1 A 46 46 ASP C C 46 178.700 177.690 1.010 1
1 571 . 14 1 1 A 46 46 ASP CA C 46 57.010 55.359 1.651 1
1 572 . 14 1 1 A 46 46 ASP CB C 46 39.400 40.722 -1.322 1
1 573 . 14 1 1 A 46 46 ASP N N 46 119.200 118.349 0.851 1
1 574 . 14 1 1 A 47 47 PHE H H 47 8.380 9.343 -0.963 1
1 575 . 14 1 1 A 47 47 PHE HA H 47 4.070 4.208 -0.138 1
1 580 . 14 1 1 A 47 47 PHE C C 47 178.600 177.579 1.021 1
1 581 . 14 1 1 A 47 47 PHE CA C 47 61.250 60.001 1.249 1
1 582 . 14 1 1 A 47 47 PHE CB C 47 39.570 40.026 -0.456 1
1 583 . 14 1 1 A 47 47 PHE N N 47 121.800 121.197 0.603 1
1 584 . 14 1 1 A 48 48 MET H H 48 8.366 8.136 0.230 1
1 585 . 14 1 1 A 48 48 MET HA H 48 3.998 4.284 -0.286 1
1 590 . 14 1 1 A 48 48 MET C C 48 177.400 177.890 -0.490 1
1 591 . 14 1 1 A 48 48 MET CA C 48 58.470 58.571 -0.101 1
1 592 . 14 1 1 A 48 48 MET CB C 48 33.170 33.093 0.077 1
1 594 . 14 1 1 A 48 48 MET N N 48 117.700 117.901 -0.201 1
1 595 . 14 1 1 A 49 49 GLN H H 49 7.659 8.241 -0.582 1
1 596 . 14 1 1 A 49 49 GLN HA H 49 4.258 4.038 0.220 1
1 603 . 14 1 1 A 49 49 GLN C C 49 176.700 178.379 -1.679 1
1 604 . 14 1 1 A 49 49 GLN CA C 49 56.380 58.494 -2.114 1
1 605 . 14 1 1 A 49 49 GLN CB C 49 28.980 28.176 0.804 1
1 607 . 14 1 1 A 49 49 GLN N N 49 116.700 118.063 -1.363 1
1 609 . 14 1 1 A 50 50 GLY H H 50 7.685 8.268 -0.583 1
1 610 . 14 1 1 A 50 50 GLY HA2 H 50 3.998 3.755 0.243 1
1 611 . 14 1 1 A 50 50 GLY HA3 H 50 3.998 3.812 0.186 1
1 612 . 14 1 1 A 50 50 GLY C C 50 174.900 174.748 0.152 1
1 613 . 14 1 1 A 50 50 GLY CA C 50 45.460 46.353 -0.893 1
1 614 . 14 1 1 A 50 50 GLY N N 50 106.400 108.968 -2.568 1
1 615 . 14 1 1 A 51 51 GLY H H 51 8.031 8.897 -0.866 1
1 616 . 14 1 1 A 51 51 GLY HA2 H 51 3.817 3.763 0.054 1
1 617 . 14 1 1 A 51 51 GLY HA3 H 51 3.817 3.796 0.021 1
1 618 . 14 1 1 A 51 51 GLY C C 51 174.500 174.339 0.161 1
1 619 . 14 1 1 A 51 51 GLY CA C 51 45.190 45.516 -0.326 1
1 620 . 14 1 1 A 51 51 GLY N N 51 108.900 109.863 -0.963 1
1 621 . 14 1 1 A 52 52 GLY H H 52 8.126 8.185 -0.059 1
1 622 . 14 1 1 A 52 52 GLY HA2 H 52 3.362 3.738 -0.376 1
1 623 . 14 1 1 A 52 52 GLY HA3 H 52 3.362 3.977 -0.615 1
1 624 . 14 1 1 A 52 52 GLY C C 52 173.300 173.898 -0.598 1
1 625 . 14 1 1 A 52 52 GLY CA C 52 45.120 45.336 -0.216 1
1 626 . 14 1 1 A 52 52 GLY N N 52 108.100 108.889 -0.789 1
1 627 . 14 1 1 A 53 53 SER H H 53 7.594 7.891 -0.297 1
1 628 . 14 1 1 A 53 53 SER HA H 53 4.530 4.740 -0.210 1
1 631 . 14 1 1 A 53 53 SER C C 53 175.300 175.231 0.069 1
1 632 . 14 1 1 A 53 53 SER CA C 53 57.770 57.204 0.566 1
1 633 . 14 1 1 A 53 53 SER CB C 53 64.750 62.271 2.479 1
1 634 . 14 1 1 A 53 53 SER N N 53 114.100 115.405 -1.305 1
1 635 . 14 1 1 A 54 54 GLY H H 54 9.003 8.589 0.414 1
1 636 . 14 1 1 A 54 54 GLY HA2 H 54 4.037 3.994 0.043 1
1 637 . 14 1 1 A 54 54 GLY HA3 H 54 3.911 4.116 -0.205 1
1 638 . 14 1 1 A 54 54 GLY C C 54 176.500 175.463 1.037 1
1 639 . 14 1 1 A 54 54 GLY CA C 54 47.040 47.197 -0.157 1
1 640 . 14 1 1 A 54 54 GLY N N 54 110.400 110.791 -0.391 1
1 641 . 14 1 1 A 55 55 GLY H H 55 8.617 8.384 0.233 1
1 642 . 14 1 1 A 55 55 GLY HA2 H 55 3.946 3.950 -0.004 1
1 643 . 14 1 1 A 55 55 GLY HA3 H 55 3.946 3.966 -0.020 1
1 644 . 14 1 1 A 55 55 GLY C C 55 176.400 175.191 1.209 1
1 645 . 14 1 1 A 55 55 GLY CA C 55 46.630 46.233 0.397 1
1 646 . 14 1 1 A 55 55 GLY N N 55 109.800 109.347 0.453 1
1 647 . 14 1 1 A 56 56 LYS H H 56 7.876 8.349 -0.473 1
1 648 . 14 1 1 A 56 56 LYS HA H 56 4.195 4.257 -0.062 1
1 657 . 14 1 1 A 56 56 LYS C C 56 178.600 178.943 -0.343 1
1 658 . 14 1 1 A 56 56 LYS CA C 56 57.960 58.392 -0.432 1
1 659 . 14 1 1 A 56 56 LYS CB C 56 32.110 32.410 -0.300 1
1 663 . 14 1 1 A 56 56 LYS N N 56 121.800 121.266 0.534 1
1 664 . 14 1 1 A 57 57 LEU H H 57 8.153 7.677 0.476 1
1 665 . 14 1 1 A 57 57 LEU HA H 57 3.992 4.279 -0.287 1
1 675 . 14 1 1 A 57 57 LEU C C 57 178.400 178.873 -0.473 1
1 676 . 14 1 1 A 57 57 LEU CA C 57 58.190 57.726 0.464 1
1 677 . 14 1 1 A 57 57 LEU CB C 57 41.360 42.019 -0.659 1
1 681 . 14 1 1 A 57 57 LEU N N 57 120.700 121.435 -0.735 1
1 682 . 14 1 1 A 58 58 GLN H H 58 8.019 8.160 -0.141 1
1 683 . 14 1 1 A 58 58 GLN HA H 58 3.942 4.106 -0.164 1
1 690 . 14 1 1 A 58 58 GLN C C 58 179.100 178.361 0.739 1
1 691 . 14 1 1 A 58 58 GLN CA C 58 59.360 58.409 0.951 1
1 692 . 14 1 1 A 58 58 GLN CB C 58 28.030 28.526 -0.496 1
1 694 . 14 1 1 A 58 58 GLN N N 58 117.400 117.537 -0.137 1
1 696 . 14 1 1 A 59 59 GLU H H 59 7.838 7.992 -0.154 1
1 697 . 14 1 1 A 59 59 GLU HA H 59 4.030 4.109 -0.079 1
1 702 . 14 1 1 A 59 59 GLU C C 59 178.600 179.133 -0.533 1
1 703 . 14 1 1 A 59 59 GLU CA C 59 59.250 59.008 0.242 1
1 704 . 14 1 1 A 59 59 GLU CB C 59 28.960 29.710 -0.750 1
1 706 . 14 1 1 A 59 59 GLU N N 59 119.900 120.395 -0.495 1
1 707 . 14 1 1 A 60 60 MET H H 60 8.223 8.418 -0.195 1
1 708 . 14 1 1 A 60 60 MET HA H 60 3.966 4.154 -0.188 1
1 713 . 14 1 1 A 60 60 MET C C 60 177.900 178.323 -0.423 1
1 714 . 14 1 1 A 60 60 MET CA C 60 59.350 58.111 1.239 1
1 715 . 14 1 1 A 60 60 MET CB C 60 33.210 32.340 0.870 1
1 717 . 14 1 1 A 60 60 MET N N 60 120.100 119.211 0.889 1
1 718 . 14 1 1 A 61 61 MET H H 61 8.134 8.558 -0.424 1
1 719 . 14 1 1 A 61 61 MET HA H 61 4.195 4.195 0.000 1
1 724 . 14 1 1 A 61 61 MET C C 61 179.100 178.164 0.936 1
1 725 . 14 1 1 A 61 61 MET CA C 61 58.210 58.992 -0.782 1
1 726 . 14 1 1 A 61 61 MET CB C 61 31.340 32.237 -0.897 1
1 728 . 14 1 1 A 61 61 MET N N 61 117.000 119.259 -2.259 1
1 729 . 14 1 1 A 62 62 LYS H H 62 7.782 7.830 -0.048 1
1 730 . 14 1 1 A 62 62 LYS HA H 62 4.085 3.959 0.126 1
1 739 . 14 1 1 A 62 62 LYS C C 62 179.600 178.988 0.612 1
1 740 . 14 1 1 A 62 62 LYS CA C 62 59.610 60.004 -0.394 1
1 741 . 14 1 1 A 62 62 LYS CB C 62 32.180 32.276 -0.096 1
1 745 . 14 1 1 A 62 62 LYS N N 62 120.600 118.914 1.686 1
1 746 . 14 1 1 A 63 63 GLU H H 63 8.041 7.982 0.059 1
1 747 . 14 1 1 A 63 63 GLU HA H 63 4.057 3.699 0.358 1
1 752 . 14 1 1 A 63 63 GLU C C 63 178.900 178.908 -0.008 1
1 753 . 14 1 1 A 63 63 GLU CA C 63 59.170 59.019 0.151 1
1 754 . 14 1 1 A 63 63 GLU CB C 63 29.000 28.996 0.004 1
1 756 . 14 1 1 A 63 63 GLU N N 63 120.200 120.344 -0.144 1
1 757 . 14 1 1 A 64 64 PHE H H 64 8.604 9.115 -0.511 1
1 758 . 14 1 1 A 64 64 PHE HA H 64 4.155 3.819 0.336 1
1 763 . 14 1 1 A 64 64 PHE C C 64 177.800 177.591 0.209 1
1 764 . 14 1 1 A 64 64 PHE CA C 64 59.820 60.816 -0.996 1
1 765 . 14 1 1 A 64 64 PHE CB C 64 38.470 38.467 0.003 1
1 766 . 14 1 1 A 64 64 PHE N N 64 119.700 120.570 -0.870 1
1 767 . 14 1 1 A 65 65 GLN H H 65 8.177 8.605 -0.428 1
1 768 . 14 1 1 A 65 65 GLN HA H 65 3.637 3.891 -0.254 1
1 775 . 14 1 1 A 65 65 GLN C C 65 177.800 177.724 0.076 1
1 776 . 14 1 1 A 65 65 GLN CA C 65 58.970 58.130 0.840 1
1 777 . 14 1 1 A 65 65 GLN CB C 65 28.280 28.531 -0.251 1
1 779 . 14 1 1 A 65 65 GLN N N 65 118.500 118.603 -0.103 1
1 781 . 14 1 1 A 66 66 GLN H H 66 7.622 7.450 0.172 1
1 782 . 14 1 1 A 66 66 GLN HA H 66 4.040 4.206 -0.166 1
1 789 . 14 1 1 A 66 66 GLN C C 66 178.600 177.913 0.687 1
1 790 . 14 1 1 A 66 66 GLN CA C 66 59.150 58.145 1.005 1
1 791 . 14 1 1 A 66 66 GLN CB C 66 28.230 28.430 -0.200 1
1 793 . 14 1 1 A 66 66 GLN N N 66 117.400 117.981 -0.581 1
1 795 . 14 1 1 A 67 67 VAL H H 67 7.744 7.393 0.351 1
1 796 . 14 1 1 A 67 67 VAL HA H 67 3.785 3.866 -0.081 1
1 804 . 14 1 1 A 67 67 VAL C C 67 177.500 177.747 -0.247 1
1 805 . 14 1 1 A 67 67 VAL CA C 67 66.220 65.944 0.276 1
1 806 . 14 1 1 A 67 67 VAL CB C 67 31.390 31.912 -0.522 1
1 809 . 14 1 1 A 67 67 VAL N N 67 119.500 120.528 -1.028 1
1 810 . 14 1 1 A 68 68 LEU H H 68 7.983 7.970 0.013 1
1 811 . 14 1 1 A 68 68 LEU HA H 68 3.825 4.090 -0.265 1
1 821 . 14 1 1 A 68 68 LEU C C 68 179.100 178.245 0.855 1
1 822 . 14 1 1 A 68 68 LEU CA C 68 58.740 58.642 0.098 1
1 823 . 14 1 1 A 68 68 LEU CB C 68 41.090 42.232 -1.142 1
1 827 . 14 1 1 A 68 68 LEU N N 68 120.400 120.306 0.094 1
1 828 . 14 1 1 A 69 69 ASP H H 69 8.179 8.396 -0.217 1
1 829 . 14 1 1 A 69 69 ASP HA H 69 4.380 4.334 0.046 1
1 832 . 14 1 1 A 69 69 ASP C C 69 178.900 178.306 0.594 1
1 833 . 14 1 1 A 69 69 ASP CA C 69 57.320 57.431 -0.111 1
1 834 . 14 1 1 A 69 69 ASP CB C 69 40.040 40.918 -0.878 1
1 835 . 14 1 1 A 69 69 ASP N N 69 119.000 118.275 0.725 1
1 836 . 14 1 1 A 70 70 GLU H H 70 8.166 7.796 0.370 1
1 837 . 14 1 1 A 70 70 GLU HA H 70 4.082 4.126 -0.044 1
1 842 . 14 1 1 A 70 70 GLU C C 70 179.600 179.339 0.261 1
1 843 . 14 1 1 A 70 70 GLU CA C 70 59.010 59.554 -0.544 1
1 844 . 14 1 1 A 70 70 GLU CB C 70 28.900 29.695 -0.795 1
1 846 . 14 1 1 A 70 70 GLU N N 70 120.500 119.296 1.204 1
1 847 . 14 1 1 A 71 71 ILE H H 71 8.415 8.243 0.172 1
1 848 . 14 1 1 A 71 71 ILE HA H 71 3.790 3.519 0.271 1
1 858 . 14 1 1 A 71 71 ILE C C 71 177.400 177.680 -0.280 1
1 859 . 14 1 1 A 71 71 ILE CA C 71 64.890 65.397 -0.507 1
1 860 . 14 1 1 A 71 71 ILE CB C 71 37.680 37.630 0.050 1
1 864 . 14 1 1 A 71 71 ILE N N 71 119.200 119.939 -0.739 1
1 865 . 14 1 1 A 72 72 LYS H H 72 8.248 7.793 0.455 1
1 866 . 14 1 1 A 72 72 LYS HA H 72 3.625 3.282 0.343 1
1 873 . 14 1 1 A 72 72 LYS C C 72 178.400 178.307 0.093 1
1 874 . 14 1 1 A 72 72 LYS CA C 72 59.850 59.228 0.622 1
1 875 . 14 1 1 A 72 72 LYS CB C 72 32.070 32.100 -0.030 1
1 879 . 14 1 1 A 72 72 LYS N N 72 120.800 120.758 0.042 1
1 880 . 14 1 1 A 73 73 GLN H H 73 7.937 8.222 -0.285 1
1 881 . 14 1 1 A 73 73 GLN HA H 73 4.042 3.920 0.122 1
1 888 . 14 1 1 A 73 73 GLN C C 73 178.400 178.263 0.137 1
1 889 . 14 1 1 A 73 73 GLN CA C 73 58.510 59.169 -0.659 1
1 890 . 14 1 1 A 73 73 GLN CB C 73 28.430 28.546 -0.116 1
1 892 . 14 1 1 A 73 73 GLN N N 73 117.000 117.913 -0.913 1
1 894 . 14 1 1 A 74 74 GLN H H 74 7.712 8.019 -0.307 1
1 895 . 14 1 1 A 74 74 GLN HA H 74 4.080 4.016 0.064 1
1 902 . 14 1 1 A 74 74 GLN C C 74 177.800 177.723 0.077 1
1 903 . 14 1 1 A 74 74 GLN CA C 74 57.270 58.443 -1.173 1
1 904 . 14 1 1 A 74 74 GLN CB C 74 28.700 28.067 0.633 1
1 906 . 14 1 1 A 74 74 GLN N N 74 118.200 119.449 -1.249 1
1 908 . 14 1 1 A 75 75 LEU H H 75 7.956 7.231 0.725 1
1 909 . 14 1 1 A 75 75 LEU HA H 75 4.212 4.592 -0.380 1
1 919 . 14 1 1 A 75 75 LEU CA C 75 56.660 54.924 1.736 1
1 920 . 14 1 1 A 75 75 LEU CB C 75 42.000 41.140 0.860 1
1 924 . 14 1 1 A 75 75 LEU N N 75 120.700 117.477 3.223 1
1 925 . 14 1 1 A 76 76 GLN H H 76 8.315 8.070 0.245 1
1 926 . 14 1 1 A 76 76 GLN HA H 76 4.113 4.293 -0.180 1
1 933 . 14 1 1 A 76 76 GLN C C 76 177.100 176.110 0.990 1
1 934 . 14 1 1 A 76 76 GLN CA C 76 57.400 56.496 0.904 1
1 935 . 14 1 1 A 76 76 GLN CB C 76 28.640 29.280 -0.640 1
1 937 . 14 1 1 A 76 76 GLN N N 76 120.100 119.577 0.523 1
1 939 . 14 1 1 A 77 77 GLY H H 77 8.021 7.572 0.449 1
1 940 . 14 1 1 A 77 77 GLY HA2 H 77 4.042 4.048 -0.006 1
1 941 . 14 1 1 A 77 77 GLY HA3 H 77 3.869 4.052 -0.183 1
1 942 . 14 1 1 A 77 77 GLY C C 77 174.600 174.307 0.293 1
1 943 . 14 1 1 A 77 77 GLY CA C 77 45.430 45.211 0.219 1
1 944 . 14 1 1 A 77 77 GLY N N 77 107.700 106.956 0.744 1
1 945 . 14 1 1 A 78 78 GLY H H 78 7.819 8.626 -0.807 1
1 946 . 14 1 1 A 78 78 GLY HA2 H 78 4.208 3.993 0.215 1
1 947 . 14 1 1 A 78 78 GLY HA3 H 78 3.801 3.996 -0.195 1
1 948 . 14 1 1 A 78 78 GLY C C 78 173.900 173.957 -0.057 1
1 949 . 14 1 1 A 78 78 GLY CA C 78 45.140 45.111 0.029 1
1 950 . 14 1 1 A 78 78 GLY N N 78 107.100 112.131 -5.031 1
1 951 . 14 1 1 A 79 79 ASP H H 79 7.912 8.143 -0.231 1
1 952 . 14 1 1 A 79 79 ASP HA H 79 4.722 4.653 0.069 1
1 955 . 14 1 1 A 79 79 ASP C C 79 176.200 176.655 -0.455 1
1 956 . 14 1 1 A 79 79 ASP CA C 79 53.210 53.328 -0.118 1
1 957 . 14 1 1 A 79 79 ASP CB C 79 40.160 39.958 0.202 1
1 958 . 14 1 1 A 79 79 ASP N N 79 119.800 119.430 0.370 1
1 959 . 14 1 1 A 80 80 ASN H H 80 8.450 8.329 0.121 1
1 960 . 14 1 1 A 80 80 ASN HA H 80 4.593 4.559 0.034 1
1 965 . 14 1 1 A 80 80 ASN C C 80 177.300 176.957 0.343 1
1 966 . 14 1 1 A 80 80 ASN CA C 80 54.680 54.719 -0.039 1
1 967 . 14 1 1 A 80 80 ASN CB C 80 38.790 37.224 1.566 1
1 968 . 14 1 1 A 80 80 ASN N N 80 121.700 118.772 2.928 1
1 970 . 14 1 1 A 81 81 SER H H 81 8.444 7.830 0.614 1
1 971 . 14 1 1 A 81 81 SER HA H 81 4.263 4.365 -0.102 1
1 974 . 14 1 1 A 81 81 SER C C 81 176.100 177.161 -1.061 1
1 975 . 14 1 1 A 81 81 SER CA C 81 61.470 61.319 0.151 1
1 976 . 14 1 1 A 81 81 SER CB C 81 61.470 62.918 -1.448 1
1 977 . 14 1 1 A 81 81 SER N N 81 117.100 116.038 1.062 1
1 978 . 14 1 1 A 82 82 LEU H H 82 7.929 8.116 -0.187 1
1 979 . 14 1 1 A 82 82 LEU HA H 82 4.332 4.014 0.318 1
1 989 . 14 1 1 A 82 82 LEU C C 82 177.400 179.329 -1.929 1
1 990 . 14 1 1 A 82 82 LEU CA C 82 55.060 57.876 -2.816 1
1 991 . 14 1 1 A 82 82 LEU CB C 82 41.940 41.637 0.303 1
1 995 . 14 1 1 A 82 82 LEU N N 82 120.400 122.162 -1.762 1
1 996 . 14 1 1 A 83 83 HIS H H 83 8.014 8.000 0.014 1
1 997 . 14 1 1 A 83 83 HIS HA H 83 4.173 4.199 -0.026 1
1 1000 . 14 1 1 A 83 83 HIS C C 83 176.100 176.397 -0.297 1
1 1001 . 14 1 1 A 83 83 HIS CA C 83 59.940 59.652 0.288 1
1 1002 . 14 1 1 A 83 83 HIS CB C 83 28.050 30.188 -2.138 1
1 1003 . 14 1 1 A 83 83 HIS N N 83 119.400 118.486 0.914 1
1 1004 . 14 1 1 A 84 84 ASN H H 84 8.598 8.407 0.191 1
1 1005 . 14 1 1 A 84 84 ASN HA H 84 4.735 4.776 -0.041 1
1 1010 . 14 1 1 A 84 84 ASN C C 84 177.400 177.017 0.383 1
1 1011 . 14 1 1 A 84 84 ASN CA C 84 55.790 54.431 1.359 1
1 1012 . 14 1 1 A 84 84 ASN CB C 84 37.520 39.286 -1.766 1
1 1013 . 14 1 1 A 84 84 ASN N N 84 118.100 117.334 0.766 1
1 1015 . 14 1 1 A 85 85 VAL H H 85 7.933 7.792 0.141 1
1 1016 . 14 1 1 A 85 85 VAL HA H 85 3.849 3.830 0.019 1
1 1024 . 14 1 1 A 85 85 VAL C C 85 177.100 177.990 -0.890 1
1 1025 . 14 1 1 A 85 85 VAL CA C 85 65.490 65.531 -0.041 1
1 1026 . 14 1 1 A 85 85 VAL CB C 85 31.760 31.961 -0.201 1
1 1029 . 14 1 1 A 85 85 VAL N N 85 120.500 120.029 0.471 1
1 1030 . 14 1 1 A 86 86 HIS H H 86 8.460 9.364 -0.904 1
1 1031 . 14 1 1 A 86 86 HIS HA H 86 4.054 4.084 -0.030 1
1 1035 . 14 1 1 A 86 86 HIS C C 86 176.300 177.481 -1.181 1
1 1036 . 14 1 1 A 86 86 HIS CA C 86 59.860 60.031 -0.171 1
1 1037 . 14 1 1 A 86 86 HIS CB C 86 29.670 30.202 -0.532 1
1 1038 . 14 1 1 A 86 86 HIS N N 86 119.300 119.301 -0.001 1
1 1039 . 14 1 1 A 87 87 GLU H H 87 7.897 8.330 -0.433 1
1 1040 . 14 1 1 A 87 87 GLU HA H 87 3.838 3.578 0.260 1
1 1045 . 14 1 1 A 87 87 GLU C C 87 178.300 179.533 -1.233 1
1 1046 . 14 1 1 A 87 87 GLU CA C 87 58.690 59.047 -0.357 1
1 1047 . 14 1 1 A 87 87 GLU CB C 87 28.460 29.373 -0.913 1
1 1049 . 14 1 1 A 87 87 GLU N N 87 117.100 118.799 -1.699 1
1 1050 . 14 1 1 A 88 88 ASN H H 88 8.103 8.897 -0.794 1
1 1051 . 14 1 1 A 88 88 ASN HA H 88 4.503 4.435 0.068 1
1 1056 . 14 1 1 A 88 88 ASN C C 88 177.700 177.757 -0.057 1
1 1057 . 14 1 1 A 88 88 ASN CA C 88 55.990 56.204 -0.214 1
1 1058 . 14 1 1 A 88 88 ASN CB C 88 39.010 38.420 0.590 1
1 1059 . 14 1 1 A 88 88 ASN N N 88 118.400 117.161 1.239 1
1 1061 . 14 1 1 A 89 89 ILE H H 89 8.501 8.159 0.342 1
1 1062 . 14 1 1 A 89 89 ILE HA H 89 3.670 3.785 -0.115 1
1 1072 . 14 1 1 A 89 89 ILE C C 89 177.000 178.015 -1.015 1
1 1073 . 14 1 1 A 89 89 ILE CA C 89 65.390 65.091 0.299 1
1 1074 . 14 1 1 A 89 89 ILE CB C 89 37.440 37.771 -0.331 1
1 1078 . 14 1 1 A 89 89 ILE N N 89 118.700 119.357 -0.657 1
1 1079 . 14 1 1 A 90 90 LYS H H 90 8.017 7.961 0.056 1
1 1080 . 14 1 1 A 90 90 LYS HA H 90 3.775 3.981 -0.206 1
1 1089 . 14 1 1 A 90 90 LYS C C 90 178.800 178.879 -0.079 1
1 1090 . 14 1 1 A 90 90 LYS CA C 90 60.450 59.502 0.948 1
1 1091 . 14 1 1 A 90 90 LYS CB C 90 32.110 32.071 0.039 1
1 1095 . 14 1 1 A 90 90 LYS N N 90 120.900 120.711 0.189 1
1 1096 . 14 1 1 A 91 91 GLU H H 91 7.732 8.594 -0.862 1
1 1097 . 14 1 1 A 91 91 GLU HA H 91 4.083 4.086 -0.003 1
1 1102 . 14 1 1 A 91 91 GLU C C 91 179.100 178.957 0.143 1
1 1103 . 14 1 1 A 91 91 GLU CA C 91 59.120 58.242 0.878 1
1 1104 . 14 1 1 A 91 91 GLU CB C 91 28.810 30.273 -1.463 1
1 1106 . 14 1 1 A 91 91 GLU N N 91 119.300 118.407 0.893 1
1 1107 . 14 1 1 A 92 92 ILE H H 92 8.110 9.289 -1.179 1
1 1108 . 14 1 1 A 92 92 ILE HA H 92 3.685 3.816 -0.131 1
1 1118 . 14 1 1 A 92 92 ILE C C 92 178.000 178.037 -0.037 1
1 1119 . 14 1 1 A 92 92 ILE CA C 92 65.900 65.233 0.667 1
1 1120 . 14 1 1 A 92 92 ILE CB C 92 38.400 38.030 0.370 1
1 1124 . 14 1 1 A 92 92 ILE N N 92 121.100 120.481 0.619 1
1 1125 . 14 1 1 A 93 93 PHE H H 93 8.651 8.823 -0.172 1
1 1126 . 14 1 1 A 93 93 PHE HA H 93 3.873 2.997 0.876 1
1 1133 . 14 1 1 A 93 93 PHE C C 93 177.100 176.942 0.158 1
1 1134 . 14 1 1 A 93 93 PHE CA C 93 61.020 60.822 0.198 1
1 1135 . 14 1 1 A 93 93 PHE CB C 93 38.560 38.423 0.137 1
1 1138 . 14 1 1 A 93 93 PHE N N 93 119.400 120.982 -1.582 1
1 1139 . 14 1 1 A 94 94 HIS H H 94 8.126 7.652 0.474 1
1 1140 . 14 1 1 A 94 94 HIS HA H 94 4.368 3.840 0.528 1
1 1145 . 14 1 1 A 94 94 HIS C C 94 177.100 176.325 0.775 1
1 1146 . 14 1 1 A 94 94 HIS CA C 94 58.310 57.666 0.644 1
1 1147 . 14 1 1 A 94 94 HIS CB C 94 27.910 28.704 -0.794 1
1 1148 . 14 1 1 A 94 94 HIS N N 94 116.400 113.389 3.011 1
1 1149 . 14 1 1 A 95 95 HIS H H 95 8.058 8.022 0.036 1
1 1150 . 14 1 1 A 95 95 HIS HA H 95 4.465 4.286 0.179 1
1 1154 . 14 1 1 A 95 95 HIS C C 95 177.300 177.833 -0.533 1
1 1155 . 14 1 1 A 95 95 HIS CA C 95 57.900 59.381 -1.481 1
1 1156 . 14 1 1 A 95 95 HIS CB C 95 28.490 30.459 -1.969 1
1 1157 . 14 1 1 A 95 95 HIS N N 95 117.000 117.062 -0.062 1
1 1158 . 14 1 1 A 96 96 LEU H H 96 8.525 7.744 0.781 1
1 1159 . 14 1 1 A 96 96 LEU HA H 96 3.865 3.932 -0.067 1
1 1169 . 14 1 1 A 96 96 LEU C C 96 178.300 178.314 -0.014 1
1 1170 . 14 1 1 A 96 96 LEU CA C 96 58.250 57.930 0.320 1
1 1171 . 14 1 1 A 96 96 LEU CB C 96 41.720 41.833 -0.113 1
1 1175 . 14 1 1 A 96 96 LEU N N 96 121.300 121.020 0.280 1
1 1176 . 14 1 1 A 97 97 GLU H H 97 8.076 8.326 -0.250 1
1 1177 . 14 1 1 A 97 97 GLU HA H 97 3.719 4.046 -0.327 1
1 1182 . 14 1 1 A 97 97 GLU C C 97 178.300 178.698 -0.398 1
1 1183 . 14 1 1 A 97 97 GLU CA C 97 59.300 58.605 0.695 1
1 1184 . 14 1 1 A 97 97 GLU CB C 97 28.960 29.515 -0.555 1
1 1186 . 14 1 1 A 97 97 GLU N N 97 117.100 118.497 -1.397 1
1 1187 . 14 1 1 A 98 98 GLU H H 98 7.329 7.786 -0.457 1
1 1188 . 14 1 1 A 98 98 GLU HA H 98 4.024 4.184 -0.160 1
1 1193 . 14 1 1 A 98 98 GLU C C 98 177.900 179.023 -1.123 1
1 1194 . 14 1 1 A 98 98 GLU CA C 98 58.190 58.589 -0.399 1
1 1195 . 14 1 1 A 98 98 GLU CB C 98 29.120 29.684 -0.564 1
1 1197 . 14 1 1 A 98 98 GLU N N 98 116.000 119.340 -3.340 1
1 1198 . 14 1 1 A 99 99 LEU H H 99 7.535 8.280 -0.745 1
1 1199 . 14 1 1 A 99 99 LEU HA H 99 4.183 4.178 0.005 1
1 1209 . 14 1 1 A 99 99 LEU C C 99 178.100 177.571 0.529 1
1 1210 . 14 1 1 A 99 99 LEU CA C 99 56.440 56.506 -0.066 1
1 1211 . 14 1 1 A 99 99 LEU CB C 99 43.010 41.440 1.570 1
1 1215 . 14 1 1 A 99 99 LEU N N 99 118.200 119.356 -1.156 1
1 1216 . 14 1 1 A 100 100 VAL H H 100 7.561 7.352 0.209 1
1 1217 . 14 1 1 A 100 100 VAL HA H 100 4.033 4.569 -0.536 1
1 1225 . 14 1 1 A 100 100 VAL C C 100 175.400 177.995 -2.595 1
1 1226 . 14 1 1 A 100 100 VAL CA C 100 62.430 62.126 0.304 1
1 1227 . 14 1 1 A 100 100 VAL CB C 100 32.050 33.358 -1.308 1
1 1230 . 14 1 1 A 100 100 VAL N N 100 114.800 112.533 2.267 1
1 1231 . 14 1 1 A 101 101 HIS H H 101 7.827 7.927 -0.100 1
1 1232 . 14 1 1 A 101 101 HIS HA H 101 4.630 4.136 0.494 1
1 1237 . 14 1 1 A 101 101 HIS C C 101 173.500 176.788 -3.288 1
1 1238 . 14 1 1 A 101 101 HIS CA C 101 55.410 59.322 -3.912 1
1 1239 . 14 1 1 A 101 101 HIS CB C 101 28.870 30.102 -1.232 1
1 1240 . 14 1 1 A 101 101 HIS N N 101 120.300 123.149 -2.849 1
1 10 . 15 1 1 A 2 2 TYR H H 2 8.688 7.540 1.148 1
1 11 . 15 1 1 A 2 2 TYR HA H 2 4.737 4.160 0.577 1
1 16 . 15 1 1 A 2 2 TYR C C 2 175.900 176.318 -0.418 1
1 17 . 15 1 1 A 2 2 TYR CA C 2 57.920 60.065 -2.145 1
1 18 . 15 1 1 A 2 2 TYR CB C 2 38.340 38.825 -0.485 1
1 19 . 15 1 1 A 2 2 TYR N N 2 122.100 120.675 1.425 1
1 20 . 15 1 1 A 3 3 GLY H H 3 8.434 8.332 0.102 1
1 21 . 15 1 1 A 3 3 GLY HA2 H 3 3.909 4.016 -0.107 1
1 22 . 15 1 1 A 3 3 GLY HA3 H 3 3.841 4.037 -0.196 1
1 23 . 15 1 1 A 3 3 GLY C C 3 174.300 175.906 -1.606 1
1 24 . 15 1 1 A 3 3 GLY CA C 3 46.050 45.487 0.563 1
1 25 . 15 1 1 A 3 3 GLY N N 3 111.100 108.377 2.723 1
1 26 . 15 1 1 A 4 4 LYS H H 4 8.060 8.375 -0.315 1
1 27 . 15 1 1 A 4 4 LYS HA H 4 4.297 4.116 0.181 1
1 36 . 15 1 1 A 4 4 LYS C C 4 178.000 179.076 -1.076 1
1 37 . 15 1 1 A 4 4 LYS CA C 4 56.930 59.337 -2.407 1
1 38 . 15 1 1 A 4 4 LYS CB C 4 32.680 31.772 0.908 1
1 42 . 15 1 1 A 4 4 LYS N N 4 119.500 121.208 -1.708 1
1 43 . 15 1 1 A 5 5 LEU H H 5 8.243 8.179 0.064 1
1 44 . 15 1 1 A 5 5 LEU HA H 5 3.947 3.832 0.115 1
1 54 . 15 1 1 A 5 5 LEU C C 5 177.900 178.824 -0.924 1
1 55 . 15 1 1 A 5 5 LEU CA C 5 57.930 57.734 0.196 1
1 56 . 15 1 1 A 5 5 LEU CB C 5 41.620 41.660 -0.040 1
1 60 . 15 1 1 A 5 5 LEU N N 5 120.800 119.870 0.930 1
1 61 . 15 1 1 A 6 6 ASN H H 6 8.256 8.298 -0.042 1
1 62 . 15 1 1 A 6 6 ASN HA H 6 4.252 4.343 -0.091 1
1 67 . 15 1 1 A 6 6 ASN C C 6 177.300 177.463 -0.163 1
1 68 . 15 1 1 A 6 6 ASN CA C 6 56.900 56.547 0.353 1
1 69 . 15 1 1 A 6 6 ASN CB C 6 38.200 38.109 0.091 1
1 70 . 15 1 1 A 6 6 ASN N N 6 116.200 117.343 -1.143 1
1 72 . 15 1 1 A 7 7 ASP H H 7 7.699 8.690 -0.991 1
1 73 . 15 1 1 A 7 7 ASP HA H 7 4.320 4.422 -0.102 1
1 76 . 15 1 1 A 7 7 ASP C C 7 178.000 178.692 -0.692 1
1 77 . 15 1 1 A 7 7 ASP CA C 7 56.980 57.455 -0.475 1
1 78 . 15 1 1 A 7 7 ASP CB C 7 39.870 41.016 -1.146 1
1 79 . 15 1 1 A 7 7 ASP N N 7 119.100 118.350 0.750 1
1 80 . 15 1 1 A 8 8 LEU H H 8 7.580 8.583 -1.003 1
1 81 . 15 1 1 A 8 8 LEU HA H 8 4.091 4.092 -0.001 1
1 91 . 15 1 1 A 8 8 LEU C C 8 178.800 179.080 -0.280 1
1 92 . 15 1 1 A 8 8 LEU CA C 8 57.790 57.704 0.086 1
1 93 . 15 1 1 A 8 8 LEU CB C 8 41.880 41.580 0.300 1
1 97 . 15 1 1 A 8 8 LEU N N 8 120.400 120.642 -0.242 1
1 98 . 15 1 1 A 9 9 LEU H H 9 8.125 9.110 -0.985 1
1 99 . 15 1 1 A 9 9 LEU HA H 9 3.891 4.012 -0.121 1
1 109 . 15 1 1 A 9 9 LEU C C 9 178.900 178.322 0.578 1
1 110 . 15 1 1 A 9 9 LEU CA C 9 58.350 58.401 -0.051 1
1 111 . 15 1 1 A 9 9 LEU CB C 9 41.510 41.970 -0.460 1
1 115 . 15 1 1 A 9 9 LEU N N 9 118.900 120.137 -1.237 1
1 116 . 15 1 1 A 10 10 GLU H H 10 8.011 9.191 -1.180 1
1 117 . 15 1 1 A 10 10 GLU HA H 10 4.072 3.926 0.146 1
1 122 . 15 1 1 A 10 10 GLU C C 10 179.000 177.815 1.185 1
1 123 . 15 1 1 A 10 10 GLU CA C 10 59.090 59.775 -0.685 1
1 124 . 15 1 1 A 10 10 GLU CB C 10 27.910 29.477 -1.567 1
1 126 . 15 1 1 A 10 10 GLU N N 10 119.300 118.859 0.441 1
1 127 . 15 1 1 A 11 11 ASP H H 11 8.128 7.657 0.471 1
1 128 . 15 1 1 A 11 11 ASP HA H 11 4.383 4.487 -0.104 1
1 131 . 15 1 1 A 11 11 ASP C C 11 178.500 178.645 -0.145 1
1 132 . 15 1 1 A 11 11 ASP CA C 11 56.580 56.656 -0.076 1
1 133 . 15 1 1 A 11 11 ASP CB C 11 38.600 40.819 -2.219 1
1 134 . 15 1 1 A 11 11 ASP N N 11 119.600 118.098 1.502 1
1 135 . 15 1 1 A 12 12 LEU H H 12 8.394 8.204 0.190 1
1 136 . 15 1 1 A 12 12 LEU HA H 12 3.923 4.241 -0.318 1
1 146 . 15 1 1 A 12 12 LEU C C 12 178.200 178.449 -0.249 1
1 147 . 15 1 1 A 12 12 LEU CA C 12 57.880 57.844 0.036 1
1 148 . 15 1 1 A 12 12 LEU CB C 12 41.850 41.727 0.123 1
1 152 . 15 1 1 A 12 12 LEU N N 12 120.500 121.750 -1.250 1
1 153 . 15 1 1 A 13 13 GLN H H 13 8.371 8.804 -0.433 1
1 154 . 15 1 1 A 13 13 GLN HA H 13 3.879 4.039 -0.160 1
1 161 . 15 1 1 A 13 13 GLN C C 13 178.600 177.981 0.619 1
1 162 . 15 1 1 A 13 13 GLN CA C 13 59.570 58.310 1.260 1
1 163 . 15 1 1 A 13 13 GLN CB C 13 28.440 27.847 0.593 1
1 165 . 15 1 1 A 13 13 GLN N N 13 118.400 117.073 1.327 1
1 167 . 15 1 1 A 14 14 GLU H H 14 7.913 8.059 -0.146 1
1 168 . 15 1 1 A 14 14 GLU HA H 14 4.021 4.137 -0.116 1
1 173 . 15 1 1 A 14 14 GLU C C 14 179.000 178.900 0.100 1
1 174 . 15 1 1 A 14 14 GLU CA C 14 59.030 59.181 -0.151 1
1 175 . 15 1 1 A 14 14 GLU CB C 14 28.720 29.519 -0.799 1
1 177 . 15 1 1 A 14 14 GLU N N 14 119.100 119.837 -0.737 1
1 178 . 15 1 1 A 15 15 VAL H H 15 7.991 7.801 0.190 1
1 179 . 15 1 1 A 15 15 VAL HA H 15 3.696 3.894 -0.198 1
1 187 . 15 1 1 A 15 15 VAL C C 15 178.300 177.910 0.390 1
1 188 . 15 1 1 A 15 15 VAL CA C 15 66.640 65.564 1.076 1
1 189 . 15 1 1 A 15 15 VAL CB C 15 31.470 31.485 -0.015 1
1 192 . 15 1 1 A 15 15 VAL N N 15 120.300 117.469 2.831 1
1 193 . 15 1 1 A 16 16 LEU H H 16 8.172 7.535 0.637 1
1 194 . 15 1 1 A 16 16 LEU HA H 16 3.876 4.305 -0.429 1
1 204 . 15 1 1 A 16 16 LEU C C 16 178.400 178.359 0.041 1
1 205 . 15 1 1 A 16 16 LEU CA C 16 58.050 57.333 0.717 1
1 206 . 15 1 1 A 16 16 LEU CB C 16 41.420 41.814 -0.394 1
1 210 . 15 1 1 A 16 16 LEU N N 16 119.700 124.331 -4.631 1
1 211 . 15 1 1 A 17 17 LYS H H 17 7.755 9.145 -1.390 1
1 212 . 15 1 1 A 17 17 LYS HA H 17 3.951 4.038 -0.087 1
1 221 . 15 1 1 A 17 17 LYS C C 17 178.800 178.896 -0.096 1
1 222 . 15 1 1 A 17 17 LYS CA C 17 59.470 59.100 0.370 1
1 223 . 15 1 1 A 17 17 LYS CB C 17 32.350 32.655 -0.305 1
1 227 . 15 1 1 A 17 17 LYS N N 17 117.800 119.049 -1.249 1
1 228 . 15 1 1 A 18 18 HIS H H 18 7.847 7.991 -0.144 1
1 229 . 15 1 1 A 18 18 HIS HA H 18 4.549 4.670 -0.121 1
1 233 . 15 1 1 A 18 18 HIS C C 18 177.200 176.810 0.390 1
1 234 . 15 1 1 A 18 18 HIS CA C 18 57.870 57.955 -0.085 1
1 235 . 15 1 1 A 18 18 HIS CB C 18 28.730 29.001 -0.271 1
1 236 . 15 1 1 A 18 18 HIS N N 18 116.200 117.081 -0.881 1
1 237 . 15 1 1 A 19 19 VAL H H 19 8.415 7.852 0.563 1
1 238 . 15 1 1 A 19 19 VAL HA H 19 3.746 3.928 -0.182 1
1 246 . 15 1 1 A 19 19 VAL CA C 19 65.850 65.577 0.273 1
1 247 . 15 1 1 A 19 19 VAL CB C 19 31.600 31.977 -0.377 1
1 250 . 15 1 1 A 20 20 ASN H H 20 8.041 7.958 0.083 1
1 251 . 15 1 1 A 20 20 ASN HA H 20 4.545 4.627 -0.082 1
1 256 . 15 1 1 A 20 20 ASN C C 20 176.900 177.782 -0.882 1
1 257 . 15 1 1 A 20 20 ASN CA C 20 55.070 56.537 -1.467 1
1 258 . 15 1 1 A 20 20 ASN CB C 20 38.270 37.869 0.401 1
1 259 . 15 1 1 A 20 20 ASN N N 20 117.900 119.472 -1.572 1
1 261 . 15 1 1 A 21 21 GLN H H 21 7.887 8.080 -0.193 1
1 262 . 15 1 1 A 21 21 GLN HA H 21 4.096 4.085 0.011 1
1 269 . 15 1 1 A 21 21 GLN C C 21 176.900 177.228 -0.328 1
1 270 . 15 1 1 A 21 21 GLN CA C 21 57.510 57.833 -0.323 1
1 271 . 15 1 1 A 21 21 GLN CB C 21 29.100 29.244 -0.144 1
1 273 . 15 1 1 A 21 21 GLN N N 21 117.900 119.728 -1.828 1
1 275 . 15 1 1 A 22 22 HIS H H 22 7.887 8.265 -0.378 1
1 276 . 15 1 1 A 22 22 HIS HA H 22 4.679 4.908 -0.229 1
1 280 . 15 1 1 A 22 22 HIS C C 22 174.300 175.218 -0.918 1
1 281 . 15 1 1 A 22 22 HIS CA C 22 55.770 55.291 0.479 1
1 282 . 15 1 1 A 22 22 HIS CB C 22 28.630 29.130 -0.500 1
1 283 . 15 1 1 A 22 22 HIS N N 22 116.100 115.021 1.079 1
1 284 . 15 1 1 A 23 23 TRP H H 23 7.929 7.857 0.072 1
1 285 . 15 1 1 A 23 23 TRP HA H 23 4.542 4.722 -0.180 1
1 292 . 15 1 1 A 23 23 TRP C C 23 176.600 175.749 0.851 1
1 293 . 15 1 1 A 23 23 TRP CA C 23 58.020 58.288 -0.268 1
1 294 . 15 1 1 A 23 23 TRP CB C 23 29.700 30.610 -0.910 1
1 295 . 15 1 1 A 23 23 TRP N N 23 122.000 124.089 -2.089 1
1 297 . 15 1 1 A 24 24 GLN H H 24 8.258 8.355 -0.097 1
1 298 . 15 1 1 A 24 24 GLN HA H 24 4.329 4.910 -0.581 1
1 305 . 15 1 1 A 24 24 GLN C C 24 176.200 175.504 0.696 1
1 306 . 15 1 1 A 24 24 GLN CA C 24 55.960 55.368 0.592 1
1 307 . 15 1 1 A 24 24 GLN CB C 24 29.440 31.998 -2.558 1
1 309 . 15 1 1 A 24 24 GLN N N 24 123.800 127.464 -3.664 1
1 311 . 15 1 1 A 25 25 GLY H H 25 7.470 8.695 -1.225 1
1 312 . 15 1 1 A 25 25 GLY HA2 H 25 3.939 4.052 -0.113 1
1 313 . 15 1 1 A 25 25 GLY HA3 H 25 3.800 4.068 -0.268 1
1 314 . 15 1 1 A 25 25 GLY C C 25 174.800 175.444 -0.644 1
1 315 . 15 1 1 A 25 25 GLY CA C 25 45.470 45.762 -0.292 1
1 316 . 15 1 1 A 25 25 GLY N N 25 108.100 113.040 -4.940 1
1 317 . 15 1 1 A 26 26 GLY H H 26 8.332 8.784 -0.452 1
1 318 . 15 1 1 A 26 26 GLY HA2 H 26 4.105 4.097 0.008 1
1 319 . 15 1 1 A 26 26 GLY HA3 H 26 3.974 4.127 -0.153 1
1 320 . 15 1 1 A 26 26 GLY C C 26 174.900 175.248 -0.348 1
1 321 . 15 1 1 A 26 26 GLY CA C 26 45.410 46.161 -0.751 1
1 322 . 15 1 1 A 26 26 GLY N N 26 108.700 106.872 1.828 1
1 323 . 15 1 1 A 27 27 GLN H H 27 8.474 8.310 0.164 1
1 324 . 15 1 1 A 27 27 GLN HA H 27 4.106 4.068 0.038 1
1 331 . 15 1 1 A 27 27 GLN C C 27 177.100 176.670 0.430 1
1 332 . 15 1 1 A 27 27 GLN CA C 27 57.540 57.619 -0.079 1
1 333 . 15 1 1 A 27 27 GLN CB C 27 29.050 28.671 0.379 1
1 335 . 15 1 1 A 27 27 GLN N N 27 121.100 121.484 -0.384 1
1 337 . 15 1 1 A 28 28 LYS H H 28 8.448 8.254 0.194 1
1 338 . 15 1 1 A 28 28 LYS HA H 28 4.068 4.103 -0.035 1
1 347 . 15 1 1 A 28 28 LYS C C 28 177.900 177.975 -0.075 1
1 348 . 15 1 1 A 28 28 LYS CA C 28 58.410 58.416 -0.006 1
1 349 . 15 1 1 A 28 28 LYS CB C 28 32.210 32.460 -0.250 1
1 353 . 15 1 1 A 28 28 LYS N N 28 120.500 117.317 3.183 1
1 354 . 15 1 1 A 29 29 ASN H H 29 8.273 8.257 0.016 1
1 355 . 15 1 1 A 29 29 ASN HA H 29 4.584 4.517 0.067 1
1 360 . 15 1 1 A 29 29 ASN C C 29 176.200 177.992 -1.792 1
1 361 . 15 1 1 A 29 29 ASN CA C 29 54.400 54.486 -0.086 1
1 362 . 15 1 1 A 29 29 ASN CB C 29 38.280 38.618 -0.338 1
1 363 . 15 1 1 A 29 29 ASN N N 29 117.500 115.876 1.624 1
1 365 . 15 1 1 A 30 30 MET H H 30 7.870 7.506 0.364 1
1 366 . 15 1 1 A 30 30 MET HA H 30 4.085 2.517 1.568 1
1 371 . 15 1 1 A 30 30 MET C C 30 177.000 177.743 -0.743 1
1 372 . 15 1 1 A 30 30 MET CA C 30 56.880 57.774 -0.894 1
1 373 . 15 1 1 A 30 30 MET CB C 30 32.340 31.323 1.017 1
1 375 . 15 1 1 A 30 30 MET N N 30 121.100 118.818 2.282 1
1 376 . 15 1 1 A 31 31 ASN H H 31 8.186 7.432 0.754 1
1 377 . 15 1 1 A 31 31 ASN HA H 31 4.311 4.470 -0.159 1
1 382 . 15 1 1 A 31 31 ASN C C 31 176.700 177.738 -1.038 1
1 383 . 15 1 1 A 31 31 ASN CA C 31 55.320 55.367 -0.047 1
1 384 . 15 1 1 A 31 31 ASN CB C 31 38.410 38.594 -0.184 1
1 385 . 15 1 1 A 31 31 ASN N N 31 117.900 116.328 1.572 1
1 387 . 15 1 1 A 32 32 LYS H H 32 7.792 7.735 0.057 1
1 388 . 15 1 1 A 32 32 LYS HA H 32 3.992 3.876 0.116 1
1 397 . 15 1 1 A 32 32 LYS C C 32 177.900 178.948 -1.048 1
1 398 . 15 1 1 A 32 32 LYS CA C 32 59.050 59.087 -0.037 1
1 399 . 15 1 1 A 32 32 LYS CB C 32 32.460 32.672 -0.212 1
1 403 . 15 1 1 A 32 32 LYS N N 32 120.400 118.667 1.733 1
1 404 . 15 1 1 A 33 33 VAL H H 33 7.689 7.779 -0.090 1
1 405 . 15 1 1 A 33 33 VAL HA H 33 3.791 3.897 -0.106 1
1 413 . 15 1 1 A 33 33 VAL C C 33 177.100 177.655 -0.555 1
1 414 . 15 1 1 A 33 33 VAL CA C 33 65.360 64.924 0.436 1
1 415 . 15 1 1 A 33 33 VAL CB C 33 31.920 31.721 0.199 1
1 418 . 15 1 1 A 33 33 VAL N N 33 120.200 115.757 4.443 1
1 419 . 15 1 1 A 34 34 ASP H H 34 8.408 8.209 0.199 1
1 420 . 15 1 1 A 34 34 ASP HA H 34 4.303 4.256 0.047 1
1 423 . 15 1 1 A 34 34 ASP C C 34 178.200 178.228 -0.028 1
1 424 . 15 1 1 A 34 34 ASP CA C 34 55.880 57.083 -1.203 1
1 425 . 15 1 1 A 34 34 ASP CB C 34 38.710 41.032 -2.322 1
1 426 . 15 1 1 A 34 34 ASP N N 34 120.100 122.313 -2.213 1
1 427 . 15 1 1 A 35 35 HIS H H 35 8.204 7.335 0.869 1
1 428 . 15 1 1 A 35 35 HIS HA H 35 4.343 4.251 0.092 1
1 431 . 15 1 1 A 35 35 HIS C C 35 176.800 177.359 -0.559 1
1 432 . 15 1 1 A 35 35 HIS CA C 35 58.310 59.275 -0.965 1
1 433 . 15 1 1 A 35 35 HIS CB C 35 28.070 30.218 -2.148 1
1 434 . 15 1 1 A 35 35 HIS N N 35 118.200 119.004 -0.804 1
1 435 . 15 1 1 A 36 36 HIS H H 36 8.067 7.858 0.209 1
1 436 . 15 1 1 A 36 36 HIS HA H 36 4.602 3.970 0.632 1
1 440 . 15 1 1 A 36 36 HIS C C 36 177.100 177.525 -0.425 1
1 441 . 15 1 1 A 36 36 HIS CA C 36 58.520 59.208 -0.688 1
1 442 . 15 1 1 A 36 36 HIS CB C 36 28.720 29.950 -1.230 1
1 443 . 15 1 1 A 36 36 HIS N N 36 117.100 117.011 0.089 1
1 444 . 15 1 1 A 37 37 LEU H H 37 8.473 8.407 0.066 1
1 445 . 15 1 1 A 37 37 LEU HA H 37 3.894 3.565 0.329 1
1 455 . 15 1 1 A 37 37 LEU C C 37 178.200 178.796 -0.596 1
1 456 . 15 1 1 A 37 37 LEU CA C 37 58.520 58.148 0.372 1
1 457 . 15 1 1 A 37 37 LEU CB C 37 41.810 41.529 0.281 1
1 461 . 15 1 1 A 37 37 LEU N N 37 119.600 119.465 0.135 1
1 462 . 15 1 1 A 38 38 GLN H H 38 8.337 8.423 -0.086 1
1 463 . 15 1 1 A 38 38 GLN HA H 38 3.882 3.954 -0.072 1
1 470 . 15 1 1 A 38 38 GLN C C 38 178.500 178.565 -0.065 1
1 471 . 15 1 1 A 38 38 GLN CA C 38 59.200 59.481 -0.281 1
1 472 . 15 1 1 A 38 38 GLN CB C 38 27.850 28.374 -0.524 1
1 474 . 15 1 1 A 38 38 GLN N N 38 118.000 117.297 0.703 1
1 476 . 15 1 1 A 39 39 ASN H H 39 7.923 8.172 -0.249 1
1 477 . 15 1 1 A 39 39 ASN HA H 39 4.390 4.595 -0.205 1
1 482 . 15 1 1 A 39 39 ASN C C 39 177.500 177.608 -0.108 1
1 483 . 15 1 1 A 39 39 ASN CA C 39 55.780 56.134 -0.354 1
1 484 . 15 1 1 A 39 39 ASN CB C 39 37.450 38.063 -0.613 1
1 485 . 15 1 1 A 39 39 ASN N N 39 118.700 117.458 1.242 1
1 487 . 15 1 1 A 40 40 VAL H H 40 7.907 8.486 -0.579 1
1 488 . 15 1 1 A 40 40 VAL HA H 40 3.629 3.490 0.139 1
1 496 . 15 1 1 A 40 40 VAL C C 40 177.500 177.842 -0.342 1
1 497 . 15 1 1 A 40 40 VAL CA C 40 67.080 66.176 0.904 1
1 498 . 15 1 1 A 40 40 VAL CB C 40 31.390 31.227 0.163 1
1 501 . 15 1 1 A 40 40 VAL N N 40 120.400 120.550 -0.150 1
1 502 . 15 1 1 A 41 41 ILE H H 41 8.103 8.198 -0.095 1
1 503 . 15 1 1 A 41 41 ILE HA H 41 3.401 3.636 -0.235 1
1 513 . 15 1 1 A 41 41 ILE C C 41 178.000 178.501 -0.501 1
1 514 . 15 1 1 A 41 41 ILE CA C 41 66.430 65.546 0.884 1
1 515 . 15 1 1 A 41 41 ILE CB C 41 38.050 37.760 0.290 1
1 519 . 15 1 1 A 41 41 ILE N N 41 120.600 119.728 0.872 1
1 520 . 15 1 1 A 42 42 GLU H H 42 8.150 7.635 0.515 1
1 521 . 15 1 1 A 42 42 GLU HA H 42 4.062 4.089 -0.027 1
1 526 . 15 1 1 A 42 42 GLU C C 42 178.500 178.283 0.217 1
1 527 . 15 1 1 A 42 42 GLU CA C 42 59.120 59.090 0.030 1
1 528 . 15 1 1 A 42 42 GLU CB C 42 28.160 29.097 -0.937 1
1 530 . 15 1 1 A 42 42 GLU N N 42 119.900 121.159 -1.259 1
1 531 . 15 1 1 A 43 43 ASP H H 43 8.453 8.789 -0.336 1
1 532 . 15 1 1 A 43 43 ASP HA H 43 4.445 4.396 0.049 1
1 535 . 15 1 1 A 43 43 ASP C C 43 178.400 178.528 -0.128 1
1 536 . 15 1 1 A 43 43 ASP CA C 43 56.490 58.121 -1.631 1
1 537 . 15 1 1 A 43 43 ASP CB C 43 37.820 41.892 -4.072 1
1 538 . 15 1 1 A 43 43 ASP N N 43 119.700 120.101 -0.401 1
1 539 . 15 1 1 A 44 44 ILE H H 44 8.544 7.893 0.651 1
1 540 . 15 1 1 A 44 44 ILE HA H 44 3.590 3.728 -0.138 1
1 550 . 15 1 1 A 44 44 ILE C C 44 177.800 177.969 -0.169 1
1 551 . 15 1 1 A 44 44 ILE CA C 44 66.320 65.406 0.914 1
1 552 . 15 1 1 A 44 44 ILE CB C 44 37.690 37.830 -0.140 1
1 556 . 15 1 1 A 44 44 ILE N N 44 121.500 119.556 1.944 1
1 557 . 15 1 1 A 45 45 HIS H H 45 8.261 8.158 0.103 1
1 558 . 15 1 1 A 45 45 HIS HA H 45 4.255 4.143 0.112 1
1 562 . 15 1 1 A 45 45 HIS C C 45 177.200 177.552 -0.352 1
1 563 . 15 1 1 A 45 45 HIS CA C 45 59.580 59.681 -0.101 1
1 564 . 15 1 1 A 45 45 HIS CB C 45 27.790 30.272 -2.482 1
1 565 . 15 1 1 A 45 45 HIS N N 45 118.800 119.529 -0.729 1
1 566 . 15 1 1 A 46 46 ASP H H 46 8.680 8.056 0.624 1
1 567 . 15 1 1 A 46 46 ASP HA H 46 4.338 4.518 -0.180 1
1 570 . 15 1 1 A 46 46 ASP C C 46 178.700 178.201 0.499 1
1 571 . 15 1 1 A 46 46 ASP CA C 46 57.010 56.103 0.907 1
1 572 . 15 1 1 A 46 46 ASP CB C 46 39.400 40.919 -1.519 1
1 573 . 15 1 1 A 46 46 ASP N N 46 119.200 118.431 0.769 1
1 574 . 15 1 1 A 47 47 PHE H H 47 8.380 9.230 -0.850 1
1 575 . 15 1 1 A 47 47 PHE HA H 47 4.070 4.230 -0.160 1
1 580 . 15 1 1 A 47 47 PHE C C 47 178.600 177.766 0.834 1
1 581 . 15 1 1 A 47 47 PHE CA C 47 61.250 60.231 1.019 1
1 582 . 15 1 1 A 47 47 PHE CB C 47 39.570 39.921 -0.351 1
1 583 . 15 1 1 A 47 47 PHE N N 47 121.800 120.691 1.109 1
1 584 . 15 1 1 A 48 48 MET H H 48 8.366 7.783 0.583 1
1 585 . 15 1 1 A 48 48 MET HA H 48 3.998 4.546 -0.548 1
1 590 . 15 1 1 A 48 48 MET C C 48 177.400 177.769 -0.369 1
1 591 . 15 1 1 A 48 48 MET CA C 48 58.470 58.934 -0.464 1
1 592 . 15 1 1 A 48 48 MET CB C 48 33.170 32.742 0.428 1
1 594 . 15 1 1 A 48 48 MET N N 48 117.700 117.857 -0.157 1
1 595 . 15 1 1 A 49 49 GLN H H 49 7.659 8.358 -0.699 1
1 596 . 15 1 1 A 49 49 GLN HA H 49 4.258 4.220 0.038 1
1 603 . 15 1 1 A 49 49 GLN C C 49 176.700 178.213 -1.513 1
1 604 . 15 1 1 A 49 49 GLN CA C 49 56.380 57.850 -1.470 1
1 605 . 15 1 1 A 49 49 GLN CB C 49 28.980 29.167 -0.187 1
1 607 . 15 1 1 A 49 49 GLN N N 49 116.700 117.177 -0.477 1
1 609 . 15 1 1 A 50 50 GLY H H 50 7.685 8.433 -0.748 1
1 610 . 15 1 1 A 50 50 GLY HA2 H 50 3.998 3.839 0.159 1
1 611 . 15 1 1 A 50 50 GLY HA3 H 50 3.998 3.885 0.113 1
1 612 . 15 1 1 A 50 50 GLY C C 50 174.900 175.196 -0.296 1
1 613 . 15 1 1 A 50 50 GLY CA C 50 45.460 45.707 -0.247 1
1 614 . 15 1 1 A 50 50 GLY N N 50 106.400 108.283 -1.883 1
1 615 . 15 1 1 A 51 51 GLY H H 51 8.031 9.194 -1.163 1
1 616 . 15 1 1 A 51 51 GLY HA2 H 51 3.817 3.899 -0.082 1
1 617 . 15 1 1 A 51 51 GLY HA3 H 51 3.817 3.900 -0.083 1
1 618 . 15 1 1 A 51 51 GLY C C 51 174.500 174.481 0.019 1
1 619 . 15 1 1 A 51 51 GLY CA C 51 45.190 45.652 -0.462 1
1 620 . 15 1 1 A 51 51 GLY N N 51 108.900 108.703 0.197 1
1 621 . 15 1 1 A 52 52 GLY H H 52 8.126 8.613 -0.487 1
1 622 . 15 1 1 A 52 52 GLY HA2 H 52 3.362 3.633 -0.271 1
1 623 . 15 1 1 A 52 52 GLY HA3 H 52 3.362 4.003 -0.641 1
1 624 . 15 1 1 A 52 52 GLY C C 52 173.300 174.407 -1.107 1
1 625 . 15 1 1 A 52 52 GLY CA C 52 45.120 45.081 0.039 1
1 626 . 15 1 1 A 52 52 GLY N N 52 108.100 107.657 0.443 1
1 627 . 15 1 1 A 53 53 SER H H 53 7.594 7.744 -0.150 1
1 628 . 15 1 1 A 53 53 SER HA H 53 4.530 4.614 -0.084 1
1 631 . 15 1 1 A 53 53 SER C C 53 175.300 175.021 0.279 1
1 632 . 15 1 1 A 53 53 SER CA C 53 57.770 57.506 0.264 1
1 633 . 15 1 1 A 53 53 SER CB C 53 64.750 61.257 3.493 1
1 634 . 15 1 1 A 53 53 SER N N 53 114.100 116.206 -2.106 1
1 635 . 15 1 1 A 54 54 GLY H H 54 9.003 8.583 0.420 1
1 636 . 15 1 1 A 54 54 GLY HA2 H 54 4.037 3.978 0.059 1
1 637 . 15 1 1 A 54 54 GLY HA3 H 54 3.911 4.086 -0.175 1
1 638 . 15 1 1 A 54 54 GLY C C 54 176.500 175.581 0.919 1
1 639 . 15 1 1 A 54 54 GLY CA C 54 47.040 46.939 0.101 1
1 640 . 15 1 1 A 54 54 GLY N N 54 110.400 112.919 -2.519 1
1 641 . 15 1 1 A 55 55 GLY H H 55 8.617 8.304 0.313 1
1 642 . 15 1 1 A 55 55 GLY HA2 H 55 3.946 3.896 0.050 1
1 643 . 15 1 1 A 55 55 GLY HA3 H 55 3.946 3.913 0.033 1
1 644 . 15 1 1 A 55 55 GLY C C 55 176.400 176.238 0.162 1
1 645 . 15 1 1 A 55 55 GLY CA C 55 46.630 47.072 -0.442 1
1 646 . 15 1 1 A 55 55 GLY N N 55 109.800 109.623 0.177 1
1 647 . 15 1 1 A 56 56 LYS H H 56 7.876 8.262 -0.386 1
1 648 . 15 1 1 A 56 56 LYS HA H 56 4.195 4.124 0.071 1
1 657 . 15 1 1 A 56 56 LYS C C 56 178.600 178.910 -0.310 1
1 658 . 15 1 1 A 56 56 LYS CA C 56 57.960 59.141 -1.181 1
1 659 . 15 1 1 A 56 56 LYS CB C 56 32.110 32.563 -0.453 1
1 663 . 15 1 1 A 56 56 LYS N N 56 121.800 122.520 -0.720 1
1 664 . 15 1 1 A 57 57 LEU H H 57 8.153 7.463 0.690 1
1 665 . 15 1 1 A 57 57 LEU HA H 57 3.992 4.306 -0.314 1
1 675 . 15 1 1 A 57 57 LEU C C 57 178.400 178.960 -0.560 1
1 676 . 15 1 1 A 57 57 LEU CA C 57 58.190 57.513 0.677 1
1 677 . 15 1 1 A 57 57 LEU CB C 57 41.360 42.209 -0.849 1
1 681 . 15 1 1 A 57 57 LEU N N 57 120.700 121.815 -1.115 1
1 682 . 15 1 1 A 58 58 GLN H H 58 8.019 8.161 -0.142 1
1 683 . 15 1 1 A 58 58 GLN HA H 58 3.942 4.241 -0.299 1
1 690 . 15 1 1 A 58 58 GLN C C 58 179.100 178.302 0.798 1
1 691 . 15 1 1 A 58 58 GLN CA C 58 59.360 58.030 1.330 1
1 692 . 15 1 1 A 58 58 GLN CB C 58 28.030 28.481 -0.451 1
1 694 . 15 1 1 A 58 58 GLN N N 58 117.400 118.163 -0.763 1
1 696 . 15 1 1 A 59 59 GLU H H 59 7.838 8.231 -0.393 1
1 697 . 15 1 1 A 59 59 GLU HA H 59 4.030 4.182 -0.152 1
1 702 . 15 1 1 A 59 59 GLU C C 59 178.600 179.325 -0.725 1
1 703 . 15 1 1 A 59 59 GLU CA C 59 59.250 59.023 0.227 1
1 704 . 15 1 1 A 59 59 GLU CB C 59 28.960 30.388 -1.428 1
1 706 . 15 1 1 A 59 59 GLU N N 59 119.900 119.448 0.452 1
1 707 . 15 1 1 A 60 60 MET H H 60 8.223 7.973 0.250 1
1 708 . 15 1 1 A 60 60 MET HA H 60 3.966 4.211 -0.245 1
1 713 . 15 1 1 A 60 60 MET C C 60 177.900 178.377 -0.477 1
1 714 . 15 1 1 A 60 60 MET CA C 60 59.350 57.588 1.762 1
1 715 . 15 1 1 A 60 60 MET CB C 60 33.210 32.236 0.974 1
1 717 . 15 1 1 A 60 60 MET N N 60 120.100 119.040 1.060 1
1 718 . 15 1 1 A 61 61 MET H H 61 8.134 8.077 0.057 1
1 719 . 15 1 1 A 61 61 MET HA H 61 4.195 4.204 -0.009 1
1 724 . 15 1 1 A 61 61 MET C C 61 179.100 178.151 0.949 1
1 725 . 15 1 1 A 61 61 MET CA C 61 58.210 58.818 -0.608 1
1 726 . 15 1 1 A 61 61 MET CB C 61 31.340 31.801 -0.461 1
1 728 . 15 1 1 A 61 61 MET N N 61 117.000 119.371 -2.371 1
1 729 . 15 1 1 A 62 62 LYS H H 62 7.782 8.211 -0.429 1
1 730 . 15 1 1 A 62 62 LYS HA H 62 4.085 3.959 0.126 1
1 739 . 15 1 1 A 62 62 LYS C C 62 179.600 178.990 0.610 1
1 740 . 15 1 1 A 62 62 LYS CA C 62 59.610 60.140 -0.530 1
1 741 . 15 1 1 A 62 62 LYS CB C 62 32.180 32.144 0.036 1
1 745 . 15 1 1 A 62 62 LYS N N 62 120.600 118.791 1.809 1
1 746 . 15 1 1 A 63 63 GLU H H 63 8.041 7.955 0.086 1
1 747 . 15 1 1 A 63 63 GLU HA H 63 4.057 3.938 0.119 1
1 752 . 15 1 1 A 63 63 GLU C C 63 178.900 178.864 0.036 1
1 753 . 15 1 1 A 63 63 GLU CA C 63 59.170 58.876 0.294 1
1 754 . 15 1 1 A 63 63 GLU CB C 63 29.000 29.002 -0.002 1
1 756 . 15 1 1 A 63 63 GLU N N 63 120.200 119.491 0.709 1
1 757 . 15 1 1 A 64 64 PHE H H 64 8.604 9.075 -0.471 1
1 758 . 15 1 1 A 64 64 PHE HA H 64 4.155 3.783 0.372 1
1 763 . 15 1 1 A 64 64 PHE C C 64 177.800 177.889 -0.089 1
1 764 . 15 1 1 A 64 64 PHE CA C 64 59.820 60.804 -0.984 1
1 765 . 15 1 1 A 64 64 PHE CB C 64 38.470 38.167 0.303 1
1 766 . 15 1 1 A 64 64 PHE N N 64 119.700 121.348 -1.648 1
1 767 . 15 1 1 A 65 65 GLN H H 65 8.177 8.456 -0.279 1
1 768 . 15 1 1 A 65 65 GLN HA H 65 3.637 4.245 -0.608 1
1 775 . 15 1 1 A 65 65 GLN C C 65 177.800 176.950 0.850 1
1 776 . 15 1 1 A 65 65 GLN CA C 65 58.970 58.435 0.535 1
1 777 . 15 1 1 A 65 65 GLN CB C 65 28.280 28.663 -0.383 1
1 779 . 15 1 1 A 65 65 GLN N N 65 118.500 118.958 -0.458 1
1 781 . 15 1 1 A 66 66 GLN H H 66 7.622 8.323 -0.701 1
1 782 . 15 1 1 A 66 66 GLN HA H 66 4.040 4.150 -0.110 1
1 789 . 15 1 1 A 66 66 GLN C C 66 178.600 178.074 0.526 1
1 790 . 15 1 1 A 66 66 GLN CA C 66 59.150 57.334 1.816 1
1 791 . 15 1 1 A 66 66 GLN CB C 66 28.230 28.013 0.217 1
1 793 . 15 1 1 A 66 66 GLN N N 66 117.400 117.405 -0.005 1
1 795 . 15 1 1 A 67 67 VAL H H 67 7.744 7.364 0.380 1
1 796 . 15 1 1 A 67 67 VAL HA H 67 3.785 3.886 -0.101 1
1 804 . 15 1 1 A 67 67 VAL C C 67 177.500 178.103 -0.603 1
1 805 . 15 1 1 A 67 67 VAL CA C 67 66.220 65.616 0.604 1
1 806 . 15 1 1 A 67 67 VAL CB C 67 31.390 31.941 -0.551 1
1 809 . 15 1 1 A 67 67 VAL N N 67 119.500 120.586 -1.086 1
1 810 . 15 1 1 A 68 68 LEU H H 68 7.983 7.757 0.226 1
1 811 . 15 1 1 A 68 68 LEU HA H 68 3.825 4.109 -0.284 1
1 821 . 15 1 1 A 68 68 LEU C C 68 179.100 178.397 0.703 1
1 822 . 15 1 1 A 68 68 LEU CA C 68 58.740 58.228 0.512 1
1 823 . 15 1 1 A 68 68 LEU CB C 68 41.090 41.917 -0.827 1
1 827 . 15 1 1 A 68 68 LEU N N 68 120.400 119.500 0.900 1
1 828 . 15 1 1 A 69 69 ASP H H 69 8.179 8.322 -0.143 1
1 829 . 15 1 1 A 69 69 ASP HA H 69 4.380 4.388 -0.008 1
1 832 . 15 1 1 A 69 69 ASP C C 69 178.900 178.224 0.676 1
1 833 . 15 1 1 A 69 69 ASP CA C 69 57.320 56.641 0.679 1
1 834 . 15 1 1 A 69 69 ASP CB C 69 40.040 41.046 -1.006 1
1 835 . 15 1 1 A 69 69 ASP N N 69 119.000 119.614 -0.614 1
1 836 . 15 1 1 A 70 70 GLU H H 70 8.166 8.969 -0.803 1
1 837 . 15 1 1 A 70 70 GLU HA H 70 4.082 4.207 -0.125 1
1 842 . 15 1 1 A 70 70 GLU C C 70 179.600 179.226 0.374 1
1 843 . 15 1 1 A 70 70 GLU CA C 70 59.010 59.121 -0.111 1
1 844 . 15 1 1 A 70 70 GLU CB C 70 28.900 30.289 -1.389 1
1 846 . 15 1 1 A 70 70 GLU N N 70 120.500 118.337 2.163 1
1 847 . 15 1 1 A 71 71 ILE H H 71 8.415 8.473 -0.058 1
1 848 . 15 1 1 A 71 71 ILE HA H 71 3.790 3.383 0.407 1
1 858 . 15 1 1 A 71 71 ILE C C 71 177.400 177.760 -0.360 1
1 859 . 15 1 1 A 71 71 ILE CA C 71 64.890 64.940 -0.050 1
1 860 . 15 1 1 A 71 71 ILE CB C 71 37.680 37.360 0.320 1
1 864 . 15 1 1 A 71 71 ILE N N 71 119.200 120.772 -1.572 1
1 865 . 15 1 1 A 72 72 LYS H H 72 8.248 8.112 0.136 1
1 866 . 15 1 1 A 72 72 LYS HA H 72 3.625 3.119 0.506 1
1 873 . 15 1 1 A 72 72 LYS C C 72 178.400 177.683 0.717 1
1 874 . 15 1 1 A 72 72 LYS CA C 72 59.850 58.875 0.975 1
1 875 . 15 1 1 A 72 72 LYS CB C 72 32.070 31.839 0.231 1
1 879 . 15 1 1 A 72 72 LYS N N 72 120.800 120.786 0.014 1
1 880 . 15 1 1 A 73 73 GLN H H 73 7.937 7.692 0.245 1
1 881 . 15 1 1 A 73 73 GLN HA H 73 4.042 4.017 0.025 1
1 888 . 15 1 1 A 73 73 GLN C C 73 178.400 178.540 -0.140 1
1 889 . 15 1 1 A 73 73 GLN CA C 73 58.510 58.335 0.175 1
1 890 . 15 1 1 A 73 73 GLN CB C 73 28.430 28.620 -0.190 1
1 892 . 15 1 1 A 73 73 GLN N N 73 117.000 118.063 -1.063 1
1 894 . 15 1 1 A 74 74 GLN H H 74 7.712 8.328 -0.616 1
1 895 . 15 1 1 A 74 74 GLN HA H 74 4.080 3.920 0.160 1
1 902 . 15 1 1 A 74 74 GLN C C 74 177.800 178.367 -0.567 1
1 903 . 15 1 1 A 74 74 GLN CA C 74 57.270 58.568 -1.298 1
1 904 . 15 1 1 A 74 74 GLN CB C 74 28.700 27.731 0.969 1
1 906 . 15 1 1 A 74 74 GLN N N 74 118.200 120.023 -1.823 1
1 908 . 15 1 1 A 75 75 LEU H H 75 7.956 7.776 0.180 1
1 909 . 15 1 1 A 75 75 LEU HA H 75 4.212 4.056 0.156 1
1 919 . 15 1 1 A 75 75 LEU CA C 75 56.660 56.660 0.000 1
1 920 . 15 1 1 A 75 75 LEU CB C 75 42.000 41.409 0.591 1
1 924 . 15 1 1 A 75 75 LEU N N 75 120.700 119.720 0.980 1
1 925 . 15 1 1 A 76 76 GLN H H 76 8.315 7.856 0.459 1
1 926 . 15 1 1 A 76 76 GLN HA H 76 4.113 4.386 -0.273 1
1 933 . 15 1 1 A 76 76 GLN C C 76 177.100 176.269 0.831 1
1 934 . 15 1 1 A 76 76 GLN CA C 76 57.400 56.118 1.282 1
1 935 . 15 1 1 A 76 76 GLN CB C 76 28.640 28.835 -0.195 1
1 937 . 15 1 1 A 76 76 GLN N N 76 120.100 116.694 3.406 1
1 939 . 15 1 1 A 77 77 GLY H H 77 8.021 7.879 0.142 1
1 940 . 15 1 1 A 77 77 GLY HA2 H 77 4.042 4.096 -0.054 1
1 941 . 15 1 1 A 77 77 GLY HA3 H 77 3.869 4.103 -0.234 1
1 942 . 15 1 1 A 77 77 GLY C C 77 174.600 173.887 0.713 1
1 943 . 15 1 1 A 77 77 GLY CA C 77 45.430 45.218 0.212 1
1 944 . 15 1 1 A 77 77 GLY N N 77 107.700 107.839 -0.139 1
1 945 . 15 1 1 A 78 78 GLY H H 78 7.819 8.794 -0.975 1
1 946 . 15 1 1 A 78 78 GLY HA2 H 78 4.208 3.895 0.313 1
1 947 . 15 1 1 A 78 78 GLY HA3 H 78 3.801 3.898 -0.097 1
1 948 . 15 1 1 A 78 78 GLY C C 78 173.900 174.650 -0.750 1
1 949 . 15 1 1 A 78 78 GLY CA C 78 45.140 47.178 -2.038 1
1 950 . 15 1 1 A 78 78 GLY N N 78 107.100 108.280 -1.180 1
1 951 . 15 1 1 A 79 79 ASP H H 79 7.912 8.385 -0.473 1
1 952 . 15 1 1 A 79 79 ASP HA H 79 4.722 5.108 -0.386 1
1 955 . 15 1 1 A 79 79 ASP C C 79 176.200 176.634 -0.434 1
1 956 . 15 1 1 A 79 79 ASP CA C 79 53.210 52.583 0.627 1
1 957 . 15 1 1 A 79 79 ASP CB C 79 40.160 40.454 -0.294 1
1 958 . 15 1 1 A 79 79 ASP N N 79 119.800 119.671 0.129 1
1 959 . 15 1 1 A 80 80 ASN H H 80 8.450 8.473 -0.023 1
1 960 . 15 1 1 A 80 80 ASN HA H 80 4.593 4.528 0.065 1
1 965 . 15 1 1 A 80 80 ASN C C 80 177.300 177.184 0.116 1
1 966 . 15 1 1 A 80 80 ASN CA C 80 54.680 55.256 -0.576 1
1 967 . 15 1 1 A 80 80 ASN CB C 80 38.790 38.158 0.632 1
1 968 . 15 1 1 A 80 80 ASN N N 80 121.700 120.298 1.402 1
1 970 . 15 1 1 A 81 81 SER H H 81 8.444 8.007 0.437 1
1 971 . 15 1 1 A 81 81 SER HA H 81 4.263 4.142 0.121 1
1 974 . 15 1 1 A 81 81 SER C C 81 176.100 176.593 -0.493 1
1 975 . 15 1 1 A 81 81 SER CA C 81 61.470 61.802 -0.332 1
1 976 . 15 1 1 A 81 81 SER CB C 81 61.470 62.934 -1.464 1
1 977 . 15 1 1 A 81 81 SER N N 81 117.100 115.510 1.590 1
1 978 . 15 1 1 A 82 82 LEU H H 82 7.929 8.173 -0.244 1
1 979 . 15 1 1 A 82 82 LEU HA H 82 4.332 3.981 0.351 1
1 989 . 15 1 1 A 82 82 LEU C C 82 177.400 179.334 -1.934 1
1 990 . 15 1 1 A 82 82 LEU CA C 82 55.060 57.807 -2.747 1
1 991 . 15 1 1 A 82 82 LEU CB C 82 41.940 41.652 0.288 1
1 995 . 15 1 1 A 82 82 LEU N N 82 120.400 121.062 -0.662 1
1 996 . 15 1 1 A 83 83 HIS H H 83 8.014 7.941 0.073 1
1 997 . 15 1 1 A 83 83 HIS HA H 83 4.173 4.218 -0.045 1
1 1000 . 15 1 1 A 83 83 HIS C C 83 176.100 176.590 -0.490 1
1 1001 . 15 1 1 A 83 83 HIS CA C 83 59.940 59.745 0.195 1
1 1002 . 15 1 1 A 83 83 HIS CB C 83 28.050 30.094 -2.044 1
1 1003 . 15 1 1 A 83 83 HIS N N 83 119.400 118.249 1.151 1
1 1004 . 15 1 1 A 84 84 ASN H H 84 8.598 8.372 0.226 1
1 1005 . 15 1 1 A 84 84 ASN HA H 84 4.735 4.696 0.039 1
1 1010 . 15 1 1 A 84 84 ASN C C 84 177.400 177.062 0.338 1
1 1011 . 15 1 1 A 84 84 ASN CA C 84 55.790 54.820 0.970 1
1 1012 . 15 1 1 A 84 84 ASN CB C 84 37.520 38.958 -1.438 1
1 1013 . 15 1 1 A 84 84 ASN N N 84 118.100 117.567 0.533 1
1 1015 . 15 1 1 A 85 85 VAL H H 85 7.933 7.604 0.329 1
1 1016 . 15 1 1 A 85 85 VAL HA H 85 3.849 3.836 0.013 1
1 1024 . 15 1 1 A 85 85 VAL C C 85 177.100 177.972 -0.872 1
1 1025 . 15 1 1 A 85 85 VAL CA C 85 65.490 65.374 0.116 1
1 1026 . 15 1 1 A 85 85 VAL CB C 85 31.760 31.991 -0.231 1
1 1029 . 15 1 1 A 85 85 VAL N N 85 120.500 119.743 0.757 1
1 1030 . 15 1 1 A 86 86 HIS H H 86 8.460 9.382 -0.922 1
1 1031 . 15 1 1 A 86 86 HIS HA H 86 4.054 4.118 -0.064 1
1 1035 . 15 1 1 A 86 86 HIS C C 86 176.300 177.680 -1.380 1
1 1036 . 15 1 1 A 86 86 HIS CA C 86 59.860 60.203 -0.343 1
1 1037 . 15 1 1 A 86 86 HIS CB C 86 29.670 29.970 -0.300 1
1 1038 . 15 1 1 A 86 86 HIS N N 86 119.300 119.260 0.040 1
1 1039 . 15 1 1 A 87 87 GLU H H 87 7.897 8.362 -0.465 1
1 1040 . 15 1 1 A 87 87 GLU HA H 87 3.838 3.570 0.268 1
1 1045 . 15 1 1 A 87 87 GLU C C 87 178.300 179.243 -0.943 1
1 1046 . 15 1 1 A 87 87 GLU CA C 87 58.690 58.885 -0.195 1
1 1047 . 15 1 1 A 87 87 GLU CB C 87 28.460 29.112 -0.652 1
1 1049 . 15 1 1 A 87 87 GLU N N 87 117.100 118.871 -1.771 1
1 1050 . 15 1 1 A 88 88 ASN H H 88 8.103 8.461 -0.358 1
1 1051 . 15 1 1 A 88 88 ASN HA H 88 4.503 4.455 0.048 1
1 1056 . 15 1 1 A 88 88 ASN C C 88 177.700 177.879 -0.179 1
1 1057 . 15 1 1 A 88 88 ASN CA C 88 55.990 56.317 -0.327 1
1 1058 . 15 1 1 A 88 88 ASN CB C 88 39.010 38.435 0.575 1
1 1059 . 15 1 1 A 88 88 ASN N N 88 118.400 117.149 1.251 1
1 1061 . 15 1 1 A 89 89 ILE H H 89 8.501 8.205 0.296 1
1 1062 . 15 1 1 A 89 89 ILE HA H 89 3.670 3.777 -0.107 1
1 1072 . 15 1 1 A 89 89 ILE C C 89 177.000 177.996 -0.996 1
1 1073 . 15 1 1 A 89 89 ILE CA C 89 65.390 65.435 -0.045 1
1 1074 . 15 1 1 A 89 89 ILE CB C 89 37.440 37.777 -0.337 1
1 1078 . 15 1 1 A 89 89 ILE N N 89 118.700 120.055 -1.355 1
1 1079 . 15 1 1 A 90 90 LYS H H 90 8.017 8.136 -0.119 1
1 1080 . 15 1 1 A 90 90 LYS HA H 90 3.775 3.848 -0.073 1
1 1089 . 15 1 1 A 90 90 LYS C C 90 178.800 178.962 -0.162 1
1 1090 . 15 1 1 A 90 90 LYS CA C 90 60.450 60.008 0.442 1
1 1091 . 15 1 1 A 90 90 LYS CB C 90 32.110 32.423 -0.313 1
1 1095 . 15 1 1 A 90 90 LYS N N 90 120.900 119.498 1.402 1
1 1096 . 15 1 1 A 91 91 GLU H H 91 7.732 8.022 -0.290 1
1 1097 . 15 1 1 A 91 91 GLU HA H 91 4.083 4.119 -0.036 1
1 1102 . 15 1 1 A 91 91 GLU C C 91 179.100 179.272 -0.172 1
1 1103 . 15 1 1 A 91 91 GLU CA C 91 59.120 59.351 -0.231 1
1 1104 . 15 1 1 A 91 91 GLU CB C 91 28.810 29.237 -0.427 1
1 1106 . 15 1 1 A 91 91 GLU N N 91 119.300 118.097 1.203 1
1 1107 . 15 1 1 A 92 92 ILE H H 92 8.110 8.757 -0.647 1
1 1108 . 15 1 1 A 92 92 ILE HA H 92 3.685 3.691 -0.006 1
1 1118 . 15 1 1 A 92 92 ILE C C 92 178.000 178.362 -0.362 1
1 1119 . 15 1 1 A 92 92 ILE CA C 92 65.900 65.253 0.647 1
1 1120 . 15 1 1 A 92 92 ILE CB C 92 38.400 38.056 0.344 1
1 1124 . 15 1 1 A 92 92 ILE N N 92 121.100 121.682 -0.582 1
1 1125 . 15 1 1 A 93 93 PHE H H 93 8.651 9.102 -0.451 1
1 1126 . 15 1 1 A 93 93 PHE HA H 93 3.873 3.522 0.351 1
1 1133 . 15 1 1 A 93 93 PHE C C 93 177.100 177.785 -0.685 1
1 1134 . 15 1 1 A 93 93 PHE CA C 93 61.020 61.034 -0.014 1
1 1135 . 15 1 1 A 93 93 PHE CB C 93 38.560 38.155 0.405 1
1 1138 . 15 1 1 A 93 93 PHE N N 93 119.400 120.989 -1.589 1
1 1139 . 15 1 1 A 94 94 HIS H H 94 8.126 7.746 0.380 1
1 1140 . 15 1 1 A 94 94 HIS HA H 94 4.368 3.871 0.497 1
1 1145 . 15 1 1 A 94 94 HIS C C 94 177.100 177.425 -0.325 1
1 1146 . 15 1 1 A 94 94 HIS CA C 94 58.310 58.963 -0.653 1
1 1147 . 15 1 1 A 94 94 HIS CB C 94 27.910 29.258 -1.348 1
1 1148 . 15 1 1 A 94 94 HIS N N 94 116.400 117.076 -0.676 1
1 1149 . 15 1 1 A 95 95 HIS H H 95 8.058 8.132 -0.074 1
1 1150 . 15 1 1 A 95 95 HIS HA H 95 4.465 4.117 0.348 1
1 1154 . 15 1 1 A 95 95 HIS C C 95 177.300 177.198 0.102 1
1 1155 . 15 1 1 A 95 95 HIS CA C 95 57.900 59.533 -1.633 1
1 1156 . 15 1 1 A 95 95 HIS CB C 95 28.490 30.020 -1.530 1
1 1157 . 15 1 1 A 95 95 HIS N N 95 117.000 118.849 -1.849 1
1 1158 . 15 1 1 A 96 96 LEU H H 96 8.525 8.184 0.341 1
1 1159 . 15 1 1 A 96 96 LEU HA H 96 3.865 3.741 0.124 1
1 1169 . 15 1 1 A 96 96 LEU C C 96 178.300 178.602 -0.302 1
1 1170 . 15 1 1 A 96 96 LEU CA C 96 58.250 58.461 -0.211 1
1 1171 . 15 1 1 A 96 96 LEU CB C 96 41.720 41.687 0.033 1
1 1175 . 15 1 1 A 96 96 LEU N N 96 121.300 120.344 0.956 1
1 1176 . 15 1 1 A 97 97 GLU H H 97 8.076 8.204 -0.128 1
1 1177 . 15 1 1 A 97 97 GLU HA H 97 3.719 4.098 -0.379 1
1 1182 . 15 1 1 A 97 97 GLU C C 97 178.300 178.857 -0.557 1
1 1183 . 15 1 1 A 97 97 GLU CA C 97 59.300 58.683 0.617 1
1 1184 . 15 1 1 A 97 97 GLU CB C 97 28.960 29.635 -0.675 1
1 1186 . 15 1 1 A 97 97 GLU N N 97 117.100 118.260 -1.160 1
1 1187 . 15 1 1 A 98 98 GLU H H 98 7.329 8.191 -0.862 1
1 1188 . 15 1 1 A 98 98 GLU HA H 98 4.024 4.095 -0.071 1
1 1193 . 15 1 1 A 98 98 GLU C C 98 177.900 179.046 -1.146 1
1 1194 . 15 1 1 A 98 98 GLU CA C 98 58.190 58.537 -0.347 1
1 1195 . 15 1 1 A 98 98 GLU CB C 98 29.120 29.455 -0.335 1
1 1197 . 15 1 1 A 98 98 GLU N N 98 116.000 119.214 -3.214 1
1 1198 . 15 1 1 A 99 99 LEU H H 99 7.535 8.113 -0.578 1
1 1199 . 15 1 1 A 99 99 LEU HA H 99 4.183 4.173 0.010 1
1 1209 . 15 1 1 A 99 99 LEU C C 99 178.100 177.386 0.714 1
1 1210 . 15 1 1 A 99 99 LEU CA C 99 56.440 56.367 0.073 1
1 1211 . 15 1 1 A 99 99 LEU CB C 99 43.010 41.400 1.610 1
1 1215 . 15 1 1 A 99 99 LEU N N 99 118.200 119.403 -1.203 1
1 1216 . 15 1 1 A 100 100 VAL H H 100 7.561 7.385 0.176 1
1 1217 . 15 1 1 A 100 100 VAL HA H 100 4.033 4.584 -0.551 1
1 1225 . 15 1 1 A 100 100 VAL C C 100 175.400 177.164 -1.764 1
1 1226 . 15 1 1 A 100 100 VAL CA C 100 62.430 61.733 0.697 1
1 1227 . 15 1 1 A 100 100 VAL CB C 100 32.050 33.807 -1.757 1
1 1230 . 15 1 1 A 100 100 VAL N N 100 114.800 111.411 3.389 1
1 1231 . 15 1 1 A 101 101 HIS H H 101 7.827 7.859 -0.032 1
1 1232 . 15 1 1 A 101 101 HIS HA H 101 4.630 4.390 0.240 1
1 1237 . 15 1 1 A 101 101 HIS C C 101 173.500 175.710 -2.210 1
1 1238 . 15 1 1 A 101 101 HIS CA C 101 55.410 57.247 -1.837 1
1 1239 . 15 1 1 A 101 101 HIS CB C 101 28.870 29.057 -0.187 1
1 1240 . 15 1 1 A 101 101 HIS N N 101 120.300 122.573 -2.273 1
1 10 . 16 1 1 A 2 2 TYR H H 2 8.688 7.411 1.277 1
1 11 . 16 1 1 A 2 2 TYR HA H 2 4.737 4.295 0.442 1
1 16 . 16 1 1 A 2 2 TYR C C 2 175.900 176.163 -0.263 1
1 17 . 16 1 1 A 2 2 TYR CA C 2 57.920 60.056 -2.136 1
1 18 . 16 1 1 A 2 2 TYR CB C 2 38.340 38.971 -0.631 1
1 19 . 16 1 1 A 2 2 TYR N N 2 122.100 122.992 -0.892 1
1 20 . 16 1 1 A 3 3 GLY H H 3 8.434 7.878 0.556 1
1 21 . 16 1 1 A 3 3 GLY HA2 H 3 3.909 3.946 -0.037 1
1 22 . 16 1 1 A 3 3 GLY HA3 H 3 3.841 3.997 -0.156 1
1 23 . 16 1 1 A 3 3 GLY C C 3 174.300 176.047 -1.747 1
1 24 . 16 1 1 A 3 3 GLY CA C 3 46.050 45.391 0.659 1
1 25 . 16 1 1 A 3 3 GLY N N 3 111.100 107.665 3.435 1
1 26 . 16 1 1 A 4 4 LYS H H 4 8.060 8.364 -0.304 1
1 27 . 16 1 1 A 4 4 LYS HA H 4 4.297 4.122 0.175 1
1 36 . 16 1 1 A 4 4 LYS C C 4 178.000 178.954 -0.954 1
1 37 . 16 1 1 A 4 4 LYS CA C 4 56.930 59.507 -2.577 1
1 38 . 16 1 1 A 4 4 LYS CB C 4 32.680 32.513 0.167 1
1 42 . 16 1 1 A 4 4 LYS N N 4 119.500 121.332 -1.832 1
1 43 . 16 1 1 A 5 5 LEU H H 5 8.243 8.299 -0.056 1
1 44 . 16 1 1 A 5 5 LEU HA H 5 3.947 3.953 -0.006 1
1 54 . 16 1 1 A 5 5 LEU C C 5 177.900 179.031 -1.131 1
1 55 . 16 1 1 A 5 5 LEU CA C 5 57.930 57.821 0.109 1
1 56 . 16 1 1 A 5 5 LEU CB C 5 41.620 41.571 0.049 1
1 60 . 16 1 1 A 5 5 LEU N N 5 120.800 120.176 0.624 1
1 61 . 16 1 1 A 6 6 ASN H H 6 8.256 8.058 0.198 1
1 62 . 16 1 1 A 6 6 ASN HA H 6 4.252 4.452 -0.200 1
1 67 . 16 1 1 A 6 6 ASN C C 6 177.300 177.731 -0.431 1
1 68 . 16 1 1 A 6 6 ASN CA C 6 56.900 56.564 0.336 1
1 69 . 16 1 1 A 6 6 ASN CB C 6 38.200 38.286 -0.086 1
1 70 . 16 1 1 A 6 6 ASN N N 6 116.200 116.956 -0.756 1
1 72 . 16 1 1 A 7 7 ASP H H 7 7.699 9.253 -1.554 1
1 73 . 16 1 1 A 7 7 ASP HA H 7 4.320 4.440 -0.120 1
1 76 . 16 1 1 A 7 7 ASP C C 7 178.000 178.529 -0.529 1
1 77 . 16 1 1 A 7 7 ASP CA C 7 56.980 57.372 -0.392 1
1 78 . 16 1 1 A 7 7 ASP CB C 7 39.870 40.896 -1.026 1
1 79 . 16 1 1 A 7 7 ASP N N 7 119.100 118.913 0.187 1
1 80 . 16 1 1 A 8 8 LEU H H 8 7.580 8.559 -0.979 1
1 81 . 16 1 1 A 8 8 LEU HA H 8 4.091 4.185 -0.094 1
1 91 . 16 1 1 A 8 8 LEU C C 8 178.800 178.940 -0.140 1
1 92 . 16 1 1 A 8 8 LEU CA C 8 57.790 57.924 -0.134 1
1 93 . 16 1 1 A 8 8 LEU CB C 8 41.880 42.053 -0.173 1
1 97 . 16 1 1 A 8 8 LEU N N 8 120.400 120.148 0.252 1
1 98 . 16 1 1 A 9 9 LEU H H 9 8.125 9.145 -1.020 1
1 99 . 16 1 1 A 9 9 LEU HA H 9 3.891 4.023 -0.132 1
1 109 . 16 1 1 A 9 9 LEU C C 9 178.900 178.563 0.337 1
1 110 . 16 1 1 A 9 9 LEU CA C 9 58.350 58.748 -0.398 1
1 111 . 16 1 1 A 9 9 LEU CB C 9 41.510 42.050 -0.540 1
1 115 . 16 1 1 A 9 9 LEU N N 9 118.900 120.091 -1.191 1
1 116 . 16 1 1 A 10 10 GLU H H 10 8.011 8.806 -0.795 1
1 117 . 16 1 1 A 10 10 GLU HA H 10 4.072 3.953 0.119 1
1 122 . 16 1 1 A 10 10 GLU C C 10 179.000 178.860 0.140 1
1 123 . 16 1 1 A 10 10 GLU CA C 10 59.090 59.895 -0.805 1
1 124 . 16 1 1 A 10 10 GLU CB C 10 27.910 29.335 -1.425 1
1 126 . 16 1 1 A 10 10 GLU N N 10 119.300 118.840 0.460 1
1 127 . 16 1 1 A 11 11 ASP H H 11 8.128 7.904 0.224 1
1 128 . 16 1 1 A 11 11 ASP HA H 11 4.383 4.429 -0.046 1
1 131 . 16 1 1 A 11 11 ASP C C 11 178.500 179.041 -0.541 1
1 132 . 16 1 1 A 11 11 ASP CA C 11 56.580 57.465 -0.885 1
1 133 . 16 1 1 A 11 11 ASP CB C 11 38.600 40.781 -2.181 1
1 134 . 16 1 1 A 11 11 ASP N N 11 119.600 119.684 -0.084 1
1 135 . 16 1 1 A 12 12 LEU H H 12 8.394 8.339 0.055 1
1 136 . 16 1 1 A 12 12 LEU HA H 12 3.923 4.231 -0.308 1
1 146 . 16 1 1 A 12 12 LEU C C 12 178.200 178.337 -0.137 1
1 147 . 16 1 1 A 12 12 LEU CA C 12 57.880 57.637 0.243 1
1 148 . 16 1 1 A 12 12 LEU CB C 12 41.850 41.752 0.098 1
1 152 . 16 1 1 A 12 12 LEU N N 12 120.500 120.742 -0.242 1
1 153 . 16 1 1 A 13 13 GLN H H 13 8.371 9.109 -0.738 1
1 154 . 16 1 1 A 13 13 GLN HA H 13 3.879 4.012 -0.133 1
1 161 . 16 1 1 A 13 13 GLN C C 13 178.600 178.280 0.320 1
1 162 . 16 1 1 A 13 13 GLN CA C 13 59.570 58.716 0.854 1
1 163 . 16 1 1 A 13 13 GLN CB C 13 28.440 28.618 -0.178 1
1 165 . 16 1 1 A 13 13 GLN N N 13 118.400 118.109 0.291 1
1 167 . 16 1 1 A 14 14 GLU H H 14 7.913 8.167 -0.254 1
1 168 . 16 1 1 A 14 14 GLU HA H 14 4.021 4.128 -0.107 1
1 173 . 16 1 1 A 14 14 GLU C C 14 179.000 178.871 0.129 1
1 174 . 16 1 1 A 14 14 GLU CA C 14 59.030 59.104 -0.074 1
1 175 . 16 1 1 A 14 14 GLU CB C 14 28.720 29.714 -0.994 1
1 177 . 16 1 1 A 14 14 GLU N N 14 119.100 119.120 -0.020 1
1 178 . 16 1 1 A 15 15 VAL H H 15 7.991 7.718 0.273 1
1 179 . 16 1 1 A 15 15 VAL HA H 15 3.696 3.852 -0.156 1
1 187 . 16 1 1 A 15 15 VAL C C 15 178.300 177.971 0.329 1
1 188 . 16 1 1 A 15 15 VAL CA C 15 66.640 65.510 1.130 1
1 189 . 16 1 1 A 15 15 VAL CB C 15 31.470 31.642 -0.172 1
1 192 . 16 1 1 A 15 15 VAL N N 15 120.300 117.859 2.441 1
1 193 . 16 1 1 A 16 16 LEU H H 16 8.172 7.962 0.210 1
1 194 . 16 1 1 A 16 16 LEU HA H 16 3.876 4.113 -0.237 1
1 204 . 16 1 1 A 16 16 LEU C C 16 178.400 178.473 -0.073 1
1 205 . 16 1 1 A 16 16 LEU CA C 16 58.050 58.029 0.021 1
1 206 . 16 1 1 A 16 16 LEU CB C 16 41.420 41.304 0.116 1
1 210 . 16 1 1 A 16 16 LEU N N 16 119.700 125.140 -5.440 1
1 211 . 16 1 1 A 17 17 LYS H H 17 7.755 9.145 -1.390 1
1 212 . 16 1 1 A 17 17 LYS HA H 17 3.951 4.064 -0.113 1
1 221 . 16 1 1 A 17 17 LYS C C 17 178.800 179.100 -0.300 1
1 222 . 16 1 1 A 17 17 LYS CA C 17 59.470 59.006 0.464 1
1 223 . 16 1 1 A 17 17 LYS CB C 17 32.350 32.368 -0.018 1
1 227 . 16 1 1 A 17 17 LYS N N 17 117.800 119.337 -1.537 1
1 228 . 16 1 1 A 18 18 HIS H H 18 7.847 8.076 -0.229 1
1 229 . 16 1 1 A 18 18 HIS HA H 18 4.549 4.739 -0.190 1
1 233 . 16 1 1 A 18 18 HIS C C 18 177.200 176.491 0.709 1
1 234 . 16 1 1 A 18 18 HIS CA C 18 57.870 57.601 0.269 1
1 235 . 16 1 1 A 18 18 HIS CB C 18 28.730 28.905 -0.175 1
1 236 . 16 1 1 A 18 18 HIS N N 18 116.200 116.667 -0.467 1
1 237 . 16 1 1 A 19 19 VAL H H 19 8.415 7.906 0.509 1
1 238 . 16 1 1 A 19 19 VAL HA H 19 3.746 4.296 -0.550 1
1 246 . 16 1 1 A 19 19 VAL CA C 19 65.850 62.826 3.024 1
1 247 . 16 1 1 A 19 19 VAL CB C 19 31.600 32.962 -1.362 1
1 250 . 16 1 1 A 20 20 ASN H H 20 8.041 8.156 -0.115 1
1 251 . 16 1 1 A 20 20 ASN HA H 20 4.545 4.624 -0.079 1
1 256 . 16 1 1 A 20 20 ASN C C 20 176.900 176.823 0.077 1
1 257 . 16 1 1 A 20 20 ASN CA C 20 55.070 56.138 -1.068 1
1 258 . 16 1 1 A 20 20 ASN CB C 20 38.270 38.905 -0.635 1
1 259 . 16 1 1 A 20 20 ASN N N 20 117.900 120.967 -3.067 1
1 261 . 16 1 1 A 21 21 GLN H H 21 7.887 8.110 -0.223 1
1 262 . 16 1 1 A 21 21 GLN HA H 21 4.096 4.275 -0.179 1
1 269 . 16 1 1 A 21 21 GLN C C 21 176.900 176.912 -0.012 1
1 270 . 16 1 1 A 21 21 GLN CA C 21 57.510 56.197 1.313 1
1 271 . 16 1 1 A 21 21 GLN CB C 21 29.100 29.229 -0.129 1
1 273 . 16 1 1 A 21 21 GLN N N 21 117.900 116.933 0.967 1
1 275 . 16 1 1 A 22 22 HIS H H 22 7.887 8.275 -0.388 1
1 276 . 16 1 1 A 22 22 HIS HA H 22 4.679 4.928 -0.249 1
1 280 . 16 1 1 A 22 22 HIS C C 22 174.300 174.923 -0.623 1
1 281 . 16 1 1 A 22 22 HIS CA C 22 55.770 55.695 0.075 1
1 282 . 16 1 1 A 22 22 HIS CB C 22 28.630 30.279 -1.649 1
1 283 . 16 1 1 A 22 22 HIS N N 22 116.100 114.107 1.993 1
1 284 . 16 1 1 A 23 23 TRP H H 23 7.929 7.812 0.117 1
1 285 . 16 1 1 A 23 23 TRP HA H 23 4.542 4.597 -0.055 1
1 292 . 16 1 1 A 23 23 TRP C C 23 176.600 175.446 1.154 1
1 293 . 16 1 1 A 23 23 TRP CA C 23 58.020 58.608 -0.588 1
1 294 . 16 1 1 A 23 23 TRP CB C 23 29.700 30.382 -0.682 1
1 295 . 16 1 1 A 23 23 TRP N N 23 122.000 123.830 -1.830 1
1 297 . 16 1 1 A 24 24 GLN H H 24 8.258 8.196 0.062 1
1 298 . 16 1 1 A 24 24 GLN HA H 24 4.329 4.792 -0.463 1
1 305 . 16 1 1 A 24 24 GLN C C 24 176.200 175.161 1.039 1
1 306 . 16 1 1 A 24 24 GLN CA C 24 55.960 54.883 1.077 1
1 307 . 16 1 1 A 24 24 GLN CB C 24 29.440 32.094 -2.654 1
1 309 . 16 1 1 A 24 24 GLN N N 24 123.800 125.805 -2.005 1
1 311 . 16 1 1 A 25 25 GLY H H 25 7.470 8.873 -1.403 1
1 312 . 16 1 1 A 25 25 GLY HA2 H 25 3.939 3.859 0.080 1
1 313 . 16 1 1 A 25 25 GLY HA3 H 25 3.800 3.874 -0.074 1
1 314 . 16 1 1 A 25 25 GLY C C 25 174.800 175.059 -0.259 1
1 315 . 16 1 1 A 25 25 GLY CA C 25 45.470 46.753 -1.283 1
1 316 . 16 1 1 A 25 25 GLY N N 25 108.100 110.485 -2.385 1
1 317 . 16 1 1 A 26 26 GLY H H 26 8.332 8.696 -0.364 1
1 318 . 16 1 1 A 26 26 GLY HA2 H 26 4.105 4.173 -0.068 1
1 319 . 16 1 1 A 26 26 GLY HA3 H 26 3.974 4.209 -0.235 1
1 320 . 16 1 1 A 26 26 GLY C C 26 174.900 174.622 0.278 1
1 321 . 16 1 1 A 26 26 GLY CA C 26 45.410 45.114 0.296 1
1 322 . 16 1 1 A 26 26 GLY N N 26 108.700 106.852 1.848 1
1 323 . 16 1 1 A 27 27 GLN H H 27 8.474 8.672 -0.198 1
1 324 . 16 1 1 A 27 27 GLN HA H 27 4.106 4.268 -0.162 1
1 331 . 16 1 1 A 27 27 GLN C C 27 177.100 176.258 0.842 1
1 332 . 16 1 1 A 27 27 GLN CA C 27 57.540 56.286 1.254 1
1 333 . 16 1 1 A 27 27 GLN CB C 27 29.050 28.806 0.244 1
1 335 . 16 1 1 A 27 27 GLN N N 27 121.100 122.612 -1.512 1
1 337 . 16 1 1 A 28 28 LYS H H 28 8.448 8.455 -0.007 1
1 338 . 16 1 1 A 28 28 LYS HA H 28 4.068 4.071 -0.003 1
1 347 . 16 1 1 A 28 28 LYS C C 28 177.900 178.184 -0.284 1
1 348 . 16 1 1 A 28 28 LYS CA C 28 58.410 58.329 0.081 1
1 349 . 16 1 1 A 28 28 LYS CB C 28 32.210 32.721 -0.511 1
1 353 . 16 1 1 A 28 28 LYS N N 28 120.500 117.931 2.569 1
1 354 . 16 1 1 A 29 29 ASN H H 29 8.273 7.688 0.585 1
1 355 . 16 1 1 A 29 29 ASN HA H 29 4.584 4.463 0.121 1
1 360 . 16 1 1 A 29 29 ASN C C 29 176.200 177.331 -1.131 1
1 361 . 16 1 1 A 29 29 ASN CA C 29 54.400 55.901 -1.501 1
1 362 . 16 1 1 A 29 29 ASN CB C 29 38.280 38.523 -0.243 1
1 363 . 16 1 1 A 29 29 ASN N N 29 117.500 117.934 -0.434 1
1 365 . 16 1 1 A 30 30 MET H H 30 7.870 7.509 0.361 1
1 366 . 16 1 1 A 30 30 MET HA H 30 4.085 2.718 1.367 1
1 371 . 16 1 1 A 30 30 MET C C 30 177.000 177.627 -0.627 1
1 372 . 16 1 1 A 30 30 MET CA C 30 56.880 57.430 -0.550 1
1 373 . 16 1 1 A 30 30 MET CB C 30 32.340 31.685 0.655 1
1 375 . 16 1 1 A 30 30 MET N N 30 121.100 118.770 2.330 1
1 376 . 16 1 1 A 31 31 ASN H H 31 8.186 7.554 0.632 1
1 377 . 16 1 1 A 31 31 ASN HA H 31 4.311 4.344 -0.033 1
1 382 . 16 1 1 A 31 31 ASN C C 31 176.700 177.512 -0.812 1
1 383 . 16 1 1 A 31 31 ASN CA C 31 55.320 55.316 0.004 1
1 384 . 16 1 1 A 31 31 ASN CB C 31 38.410 38.605 -0.195 1
1 385 . 16 1 1 A 31 31 ASN N N 31 117.900 116.232 1.668 1
1 387 . 16 1 1 A 32 32 LYS H H 32 7.792 7.087 0.705 1
1 388 . 16 1 1 A 32 32 LYS HA H 32 3.992 4.113 -0.121 1
1 397 . 16 1 1 A 32 32 LYS C C 32 177.900 179.301 -1.401 1
1 398 . 16 1 1 A 32 32 LYS CA C 32 59.050 59.582 -0.532 1
1 399 . 16 1 1 A 32 32 LYS CB C 32 32.460 32.590 -0.130 1
1 403 . 16 1 1 A 32 32 LYS N N 32 120.400 118.812 1.588 1
1 404 . 16 1 1 A 33 33 VAL H H 33 7.689 8.340 -0.651 1
1 405 . 16 1 1 A 33 33 VAL HA H 33 3.791 4.071 -0.280 1
1 413 . 16 1 1 A 33 33 VAL C C 33 177.100 177.473 -0.373 1
1 414 . 16 1 1 A 33 33 VAL CA C 33 65.360 65.172 0.188 1
1 415 . 16 1 1 A 33 33 VAL CB C 33 31.920 31.580 0.340 1
1 418 . 16 1 1 A 33 33 VAL N N 33 120.200 115.858 4.342 1
1 419 . 16 1 1 A 34 34 ASP H H 34 8.408 7.842 0.566 1
1 420 . 16 1 1 A 34 34 ASP HA H 34 4.303 4.164 0.139 1
1 423 . 16 1 1 A 34 34 ASP C C 34 178.200 178.430 -0.230 1
1 424 . 16 1 1 A 34 34 ASP CA C 34 55.880 56.981 -1.101 1
1 425 . 16 1 1 A 34 34 ASP CB C 34 38.710 41.293 -2.583 1
1 426 . 16 1 1 A 34 34 ASP N N 34 120.100 120.966 -0.866 1
1 427 . 16 1 1 A 35 35 HIS H H 35 8.204 6.824 1.380 1
1 428 . 16 1 1 A 35 35 HIS HA H 35 4.343 4.248 0.095 1
1 431 . 16 1 1 A 35 35 HIS C C 35 176.800 177.522 -0.722 1
1 432 . 16 1 1 A 35 35 HIS CA C 35 58.310 59.548 -1.238 1
1 433 . 16 1 1 A 35 35 HIS CB C 35 28.070 29.771 -1.701 1
1 434 . 16 1 1 A 35 35 HIS N N 35 118.200 117.030 1.170 1
1 435 . 16 1 1 A 36 36 HIS H H 36 8.067 7.844 0.223 1
1 436 . 16 1 1 A 36 36 HIS HA H 36 4.602 4.139 0.463 1
1 440 . 16 1 1 A 36 36 HIS C C 36 177.100 177.647 -0.547 1
1 441 . 16 1 1 A 36 36 HIS CA C 36 58.520 59.649 -1.129 1
1 442 . 16 1 1 A 36 36 HIS CB C 36 28.720 29.890 -1.170 1
1 443 . 16 1 1 A 36 36 HIS N N 36 117.100 117.634 -0.534 1
1 444 . 16 1 1 A 37 37 LEU H H 37 8.473 8.556 -0.083 1
1 445 . 16 1 1 A 37 37 LEU HA H 37 3.894 3.622 0.272 1
1 455 . 16 1 1 A 37 37 LEU C C 37 178.200 178.752 -0.552 1
1 456 . 16 1 1 A 37 37 LEU CA C 37 58.520 57.993 0.527 1
1 457 . 16 1 1 A 37 37 LEU CB C 37 41.810 41.692 0.118 1
1 461 . 16 1 1 A 37 37 LEU N N 37 119.600 119.609 -0.009 1
1 462 . 16 1 1 A 38 38 GLN H H 38 8.337 8.089 0.248 1
1 463 . 16 1 1 A 38 38 GLN HA H 38 3.882 3.960 -0.078 1
1 470 . 16 1 1 A 38 38 GLN C C 38 178.500 178.451 0.049 1
1 471 . 16 1 1 A 38 38 GLN CA C 38 59.200 59.324 -0.124 1
1 472 . 16 1 1 A 38 38 GLN CB C 38 27.850 28.172 -0.322 1
1 474 . 16 1 1 A 38 38 GLN N N 38 118.000 117.125 0.875 1
1 476 . 16 1 1 A 39 39 ASN H H 39 7.923 7.433 0.490 1
1 477 . 16 1 1 A 39 39 ASN HA H 39 4.390 4.615 -0.225 1
1 482 . 16 1 1 A 39 39 ASN C C 39 177.500 178.056 -0.556 1
1 483 . 16 1 1 A 39 39 ASN CA C 39 55.780 56.080 -0.300 1
1 484 . 16 1 1 A 39 39 ASN CB C 39 37.450 38.752 -1.302 1
1 485 . 16 1 1 A 39 39 ASN N N 39 118.700 117.993 0.707 1
1 487 . 16 1 1 A 40 40 VAL H H 40 7.907 8.250 -0.343 1
1 488 . 16 1 1 A 40 40 VAL HA H 40 3.629 3.485 0.144 1
1 496 . 16 1 1 A 40 40 VAL C C 40 177.500 177.922 -0.422 1
1 497 . 16 1 1 A 40 40 VAL CA C 40 67.080 66.266 0.814 1
1 498 . 16 1 1 A 40 40 VAL CB C 40 31.390 31.379 0.011 1
1 501 . 16 1 1 A 40 40 VAL N N 40 120.400 120.680 -0.280 1
1 502 . 16 1 1 A 41 41 ILE H H 41 8.103 8.295 -0.192 1
1 503 . 16 1 1 A 41 41 ILE HA H 41 3.401 3.628 -0.227 1
1 513 . 16 1 1 A 41 41 ILE C C 41 178.000 178.699 -0.699 1
1 514 . 16 1 1 A 41 41 ILE CA C 41 66.430 65.252 1.178 1
1 515 . 16 1 1 A 41 41 ILE CB C 41 38.050 37.629 0.421 1
1 519 . 16 1 1 A 41 41 ILE N N 41 120.600 119.776 0.824 1
1 520 . 16 1 1 A 42 42 GLU H H 42 8.150 8.094 0.056 1
1 521 . 16 1 1 A 42 42 GLU HA H 42 4.062 4.062 0.000 1
1 526 . 16 1 1 A 42 42 GLU C C 42 178.500 178.197 0.303 1
1 527 . 16 1 1 A 42 42 GLU CA C 42 59.120 59.129 -0.009 1
1 528 . 16 1 1 A 42 42 GLU CB C 42 28.160 29.011 -0.851 1
1 530 . 16 1 1 A 42 42 GLU N N 42 119.900 121.455 -1.555 1
1 531 . 16 1 1 A 43 43 ASP H H 43 8.453 8.443 0.010 1
1 532 . 16 1 1 A 43 43 ASP HA H 43 4.445 4.396 0.049 1
1 535 . 16 1 1 A 43 43 ASP C C 43 178.400 178.787 -0.387 1
1 536 . 16 1 1 A 43 43 ASP CA C 43 56.490 58.030 -1.540 1
1 537 . 16 1 1 A 43 43 ASP CB C 43 37.820 41.791 -3.971 1
1 538 . 16 1 1 A 43 43 ASP N N 43 119.700 120.177 -0.477 1
1 539 . 16 1 1 A 44 44 ILE H H 44 8.544 7.710 0.834 1
1 540 . 16 1 1 A 44 44 ILE HA H 44 3.590 3.735 -0.145 1
1 550 . 16 1 1 A 44 44 ILE C C 44 177.800 178.240 -0.440 1
1 551 . 16 1 1 A 44 44 ILE CA C 44 66.320 65.527 0.793 1
1 552 . 16 1 1 A 44 44 ILE CB C 44 37.690 37.684 0.006 1
1 556 . 16 1 1 A 44 44 ILE N N 44 121.500 119.623 1.877 1
1 557 . 16 1 1 A 45 45 HIS H H 45 8.261 8.036 0.225 1
1 558 . 16 1 1 A 45 45 HIS HA H 45 4.255 4.156 0.099 1
1 562 . 16 1 1 A 45 45 HIS C C 45 177.200 175.972 1.228 1
1 563 . 16 1 1 A 45 45 HIS CA C 45 59.580 59.740 -0.160 1
1 564 . 16 1 1 A 45 45 HIS CB C 45 27.790 29.952 -2.162 1
1 565 . 16 1 1 A 45 45 HIS N N 45 118.800 119.810 -1.010 1
1 566 . 16 1 1 A 46 46 ASP H H 46 8.680 8.355 0.325 1
1 567 . 16 1 1 A 46 46 ASP HA H 46 4.338 4.574 -0.236 1
1 570 . 16 1 1 A 46 46 ASP C C 46 178.700 177.775 0.925 1
1 571 . 16 1 1 A 46 46 ASP CA C 46 57.010 54.963 2.047 1
1 572 . 16 1 1 A 46 46 ASP CB C 46 39.400 41.082 -1.682 1
1 573 . 16 1 1 A 46 46 ASP N N 46 119.200 118.602 0.598 1
1 574 . 16 1 1 A 47 47 PHE H H 47 8.380 8.889 -0.509 1
1 575 . 16 1 1 A 47 47 PHE HA H 47 4.070 4.171 -0.101 1
1 580 . 16 1 1 A 47 47 PHE C C 47 178.600 177.560 1.040 1
1 581 . 16 1 1 A 47 47 PHE CA C 47 61.250 60.205 1.045 1
1 582 . 16 1 1 A 47 47 PHE CB C 47 39.570 39.719 -0.149 1
1 583 . 16 1 1 A 47 47 PHE N N 47 121.800 121.455 0.345 1
1 584 . 16 1 1 A 48 48 MET H H 48 8.366 8.170 0.196 1
1 585 . 16 1 1 A 48 48 MET HA H 48 3.998 4.043 -0.045 1
1 590 . 16 1 1 A 48 48 MET C C 48 177.400 178.349 -0.949 1
1 591 . 16 1 1 A 48 48 MET CA C 48 58.470 58.107 0.363 1
1 592 . 16 1 1 A 48 48 MET CB C 48 33.170 31.484 1.686 1
1 594 . 16 1 1 A 48 48 MET N N 48 117.700 117.752 -0.052 1
1 595 . 16 1 1 A 49 49 GLN H H 49 7.659 8.028 -0.369 1
1 596 . 16 1 1 A 49 49 GLN HA H 49 4.258 3.965 0.293 1
1 603 . 16 1 1 A 49 49 GLN C C 49 176.700 179.078 -2.378 1
1 604 . 16 1 1 A 49 49 GLN CA C 49 56.380 58.754 -2.374 1
1 605 . 16 1 1 A 49 49 GLN CB C 49 28.980 28.514 0.466 1
1 607 . 16 1 1 A 49 49 GLN N N 49 116.700 118.551 -1.851 1
1 609 . 16 1 1 A 50 50 GLY H H 50 7.685 7.561 0.124 1
1 610 . 16 1 1 A 50 50 GLY HA2 H 50 3.998 3.820 0.178 1
1 611 . 16 1 1 A 50 50 GLY HA3 H 50 3.998 3.861 0.137 1
1 612 . 16 1 1 A 50 50 GLY C C 50 174.900 174.862 0.038 1
1 613 . 16 1 1 A 50 50 GLY CA C 50 45.460 45.541 -0.081 1
1 614 . 16 1 1 A 50 50 GLY N N 50 106.400 108.159 -1.759 1
1 615 . 16 1 1 A 51 51 GLY H H 51 8.031 7.982 0.049 1
1 616 . 16 1 1 A 51 51 GLY HA2 H 51 3.817 3.597 0.220 1
1 617 . 16 1 1 A 51 51 GLY HA3 H 51 3.817 3.754 0.063 1
1 618 . 16 1 1 A 51 51 GLY C C 51 174.500 174.195 0.305 1
1 619 . 16 1 1 A 51 51 GLY CA C 51 45.190 46.160 -0.970 1
1 620 . 16 1 1 A 51 51 GLY N N 51 108.900 108.851 0.049 1
1 621 . 16 1 1 A 52 52 GLY H H 52 8.126 7.758 0.368 1
1 622 . 16 1 1 A 52 52 GLY HA2 H 52 3.362 3.723 -0.361 1
1 623 . 16 1 1 A 52 52 GLY HA3 H 52 3.362 3.963 -0.601 1
1 624 . 16 1 1 A 52 52 GLY C C 52 173.300 173.580 -0.280 1
1 625 . 16 1 1 A 52 52 GLY CA C 52 45.120 45.278 -0.158 1
1 626 . 16 1 1 A 52 52 GLY N N 52 108.100 108.205 -0.105 1
1 627 . 16 1 1 A 53 53 SER H H 53 7.594 7.869 -0.275 1
1 628 . 16 1 1 A 53 53 SER HA H 53 4.530 4.870 -0.340 1
1 631 . 16 1 1 A 53 53 SER C C 53 175.300 175.466 -0.166 1
1 632 . 16 1 1 A 53 53 SER CA C 53 57.770 57.404 0.366 1
1 633 . 16 1 1 A 53 53 SER CB C 53 64.750 63.548 1.202 1
1 634 . 16 1 1 A 53 53 SER N N 53 114.100 116.728 -2.628 1
1 635 . 16 1 1 A 54 54 GLY H H 54 9.003 8.534 0.469 1
1 636 . 16 1 1 A 54 54 GLY HA2 H 54 4.037 4.048 -0.011 1
1 637 . 16 1 1 A 54 54 GLY HA3 H 54 3.911 4.201 -0.290 1
1 638 . 16 1 1 A 54 54 GLY C C 54 176.500 175.492 1.008 1
1 639 . 16 1 1 A 54 54 GLY CA C 54 47.040 47.215 -0.175 1
1 640 . 16 1 1 A 54 54 GLY N N 54 110.400 110.284 0.116 1
1 641 . 16 1 1 A 55 55 GLY H H 55 8.617 8.306 0.311 1
1 642 . 16 1 1 A 55 55 GLY HA2 H 55 3.946 3.904 0.042 1
1 643 . 16 1 1 A 55 55 GLY HA3 H 55 3.946 3.918 0.028 1
1 644 . 16 1 1 A 55 55 GLY C C 55 176.400 175.624 0.776 1
1 645 . 16 1 1 A 55 55 GLY CA C 55 46.630 46.942 -0.312 1
1 646 . 16 1 1 A 55 55 GLY N N 55 109.800 109.651 0.149 1
1 647 . 16 1 1 A 56 56 LYS H H 56 7.876 8.882 -1.006 1
1 648 . 16 1 1 A 56 56 LYS HA H 56 4.195 4.222 -0.027 1
1 657 . 16 1 1 A 56 56 LYS C C 56 178.600 179.205 -0.605 1
1 658 . 16 1 1 A 56 56 LYS CA C 56 57.960 58.714 -0.754 1
1 659 . 16 1 1 A 56 56 LYS CB C 56 32.110 32.370 -0.260 1
1 663 . 16 1 1 A 56 56 LYS N N 56 121.800 121.724 0.076 1
1 664 . 16 1 1 A 57 57 LEU H H 57 8.153 8.143 0.010 1
1 665 . 16 1 1 A 57 57 LEU HA H 57 3.992 4.305 -0.313 1
1 675 . 16 1 1 A 57 57 LEU C C 57 178.400 178.698 -0.298 1
1 676 . 16 1 1 A 57 57 LEU CA C 57 58.190 58.418 -0.228 1
1 677 . 16 1 1 A 57 57 LEU CB C 57 41.360 42.078 -0.718 1
1 681 . 16 1 1 A 57 57 LEU N N 57 120.700 121.977 -1.277 1
1 682 . 16 1 1 A 58 58 GLN H H 58 8.019 8.054 -0.035 1
1 683 . 16 1 1 A 58 58 GLN HA H 58 3.942 4.115 -0.173 1
1 690 . 16 1 1 A 58 58 GLN C C 58 179.100 178.377 0.723 1
1 691 . 16 1 1 A 58 58 GLN CA C 58 59.360 58.364 0.996 1
1 692 . 16 1 1 A 58 58 GLN CB C 58 28.030 28.266 -0.236 1
1 694 . 16 1 1 A 58 58 GLN N N 58 117.400 117.437 -0.037 1
1 696 . 16 1 1 A 59 59 GLU H H 59 7.838 7.956 -0.118 1
1 697 . 16 1 1 A 59 59 GLU HA H 59 4.030 4.126 -0.096 1
1 702 . 16 1 1 A 59 59 GLU C C 59 178.600 179.318 -0.718 1
1 703 . 16 1 1 A 59 59 GLU CA C 59 59.250 59.031 0.219 1
1 704 . 16 1 1 A 59 59 GLU CB C 59 28.960 29.683 -0.723 1
1 706 . 16 1 1 A 59 59 GLU N N 59 119.900 120.439 -0.539 1
1 707 . 16 1 1 A 60 60 MET H H 60 8.223 8.144 0.079 1
1 708 . 16 1 1 A 60 60 MET HA H 60 3.966 4.221 -0.255 1
1 713 . 16 1 1 A 60 60 MET C C 60 177.900 178.329 -0.429 1
1 714 . 16 1 1 A 60 60 MET CA C 60 59.350 57.820 1.530 1
1 715 . 16 1 1 A 60 60 MET CB C 60 33.210 32.259 0.951 1
1 717 . 16 1 1 A 60 60 MET N N 60 120.100 118.945 1.155 1
1 718 . 16 1 1 A 61 61 MET H H 61 8.134 8.327 -0.193 1
1 719 . 16 1 1 A 61 61 MET HA H 61 4.195 4.372 -0.177 1
1 724 . 16 1 1 A 61 61 MET C C 61 179.100 178.383 0.717 1
1 725 . 16 1 1 A 61 61 MET CA C 61 58.210 58.915 -0.705 1
1 726 . 16 1 1 A 61 61 MET CB C 61 31.340 32.282 -0.942 1
1 728 . 16 1 1 A 61 61 MET N N 61 117.000 119.283 -2.283 1
1 729 . 16 1 1 A 62 62 LYS H H 62 7.782 7.806 -0.024 1
1 730 . 16 1 1 A 62 62 LYS HA H 62 4.085 4.096 -0.011 1
1 739 . 16 1 1 A 62 62 LYS C C 62 179.600 179.072 0.528 1
1 740 . 16 1 1 A 62 62 LYS CA C 62 59.610 59.813 -0.203 1
1 741 . 16 1 1 A 62 62 LYS CB C 62 32.180 32.168 0.012 1
1 745 . 16 1 1 A 62 62 LYS N N 62 120.600 119.050 1.550 1
1 746 . 16 1 1 A 63 63 GLU H H 63 8.041 8.060 -0.019 1
1 747 . 16 1 1 A 63 63 GLU HA H 63 4.057 3.948 0.109 1
1 752 . 16 1 1 A 63 63 GLU C C 63 178.900 178.721 0.179 1
1 753 . 16 1 1 A 63 63 GLU CA C 63 59.170 59.042 0.128 1
1 754 . 16 1 1 A 63 63 GLU CB C 63 29.000 29.357 -0.357 1
1 756 . 16 1 1 A 63 63 GLU N N 63 120.200 120.798 -0.598 1
1 757 . 16 1 1 A 64 64 PHE H H 64 8.604 9.084 -0.480 1
1 758 . 16 1 1 A 64 64 PHE HA H 64 4.155 3.742 0.413 1
1 763 . 16 1 1 A 64 64 PHE C C 64 177.800 177.395 0.405 1
1 764 . 16 1 1 A 64 64 PHE CA C 64 59.820 61.120 -1.300 1
1 765 . 16 1 1 A 64 64 PHE CB C 64 38.470 38.098 0.372 1
1 766 . 16 1 1 A 64 64 PHE N N 64 119.700 119.997 -0.297 1
1 767 . 16 1 1 A 65 65 GLN H H 65 8.177 7.772 0.405 1
1 768 . 16 1 1 A 65 65 GLN HA H 65 3.637 4.214 -0.577 1
1 775 . 16 1 1 A 65 65 GLN C C 65 177.800 177.611 0.189 1
1 776 . 16 1 1 A 65 65 GLN CA C 65 58.970 58.412 0.558 1
1 777 . 16 1 1 A 65 65 GLN CB C 65 28.280 28.688 -0.408 1
1 779 . 16 1 1 A 65 65 GLN N N 65 118.500 117.890 0.610 1
1 781 . 16 1 1 A 66 66 GLN H H 66 7.622 9.428 -1.806 1
1 782 . 16 1 1 A 66 66 GLN HA H 66 4.040 4.074 -0.034 1
1 789 . 16 1 1 A 66 66 GLN C C 66 178.600 178.073 0.527 1
1 790 . 16 1 1 A 66 66 GLN CA C 66 59.150 58.308 0.842 1
1 791 . 16 1 1 A 66 66 GLN CB C 66 28.230 27.638 0.592 1
1 793 . 16 1 1 A 66 66 GLN N N 66 117.400 117.445 -0.045 1
1 795 . 16 1 1 A 67 67 VAL H H 67 7.744 7.270 0.474 1
1 796 . 16 1 1 A 67 67 VAL HA H 67 3.785 3.844 -0.059 1
1 804 . 16 1 1 A 67 67 VAL C C 67 177.500 177.792 -0.292 1
1 805 . 16 1 1 A 67 67 VAL CA C 67 66.220 65.647 0.573 1
1 806 . 16 1 1 A 67 67 VAL CB C 67 31.390 31.936 -0.546 1
1 809 . 16 1 1 A 67 67 VAL N N 67 119.500 120.572 -1.072 1
1 810 . 16 1 1 A 68 68 LEU H H 68 7.983 8.028 -0.045 1
1 811 . 16 1 1 A 68 68 LEU HA H 68 3.825 4.062 -0.237 1
1 821 . 16 1 1 A 68 68 LEU C C 68 179.100 178.364 0.736 1
1 822 . 16 1 1 A 68 68 LEU CA C 68 58.740 58.160 0.580 1
1 823 . 16 1 1 A 68 68 LEU CB C 68 41.090 41.974 -0.884 1
1 827 . 16 1 1 A 68 68 LEU N N 68 120.400 120.223 0.177 1
1 828 . 16 1 1 A 69 69 ASP H H 69 8.179 7.803 0.376 1
1 829 . 16 1 1 A 69 69 ASP HA H 69 4.380 4.501 -0.121 1
1 832 . 16 1 1 A 69 69 ASP C C 69 178.900 179.157 -0.257 1
1 833 . 16 1 1 A 69 69 ASP CA C 69 57.320 56.701 0.619 1
1 834 . 16 1 1 A 69 69 ASP CB C 69 40.040 40.679 -0.639 1
1 835 . 16 1 1 A 69 69 ASP N N 69 119.000 118.748 0.252 1
1 836 . 16 1 1 A 70 70 GLU H H 70 8.166 8.194 -0.028 1
1 837 . 16 1 1 A 70 70 GLU HA H 70 4.082 4.142 -0.060 1
1 842 . 16 1 1 A 70 70 GLU C C 70 179.600 179.358 0.242 1
1 843 . 16 1 1 A 70 70 GLU CA C 70 59.010 59.296 -0.286 1
1 844 . 16 1 1 A 70 70 GLU CB C 70 28.900 29.812 -0.912 1
1 846 . 16 1 1 A 70 70 GLU N N 70 120.500 120.876 -0.376 1
1 847 . 16 1 1 A 71 71 ILE H H 71 8.415 8.308 0.107 1
1 848 . 16 1 1 A 71 71 ILE HA H 71 3.790 3.363 0.427 1
1 858 . 16 1 1 A 71 71 ILE C C 71 177.400 177.870 -0.470 1
1 859 . 16 1 1 A 71 71 ILE CA C 71 64.890 65.005 -0.115 1
1 860 . 16 1 1 A 71 71 ILE CB C 71 37.680 37.721 -0.041 1
1 864 . 16 1 1 A 71 71 ILE N N 71 119.200 120.857 -1.657 1
1 865 . 16 1 1 A 72 72 LYS H H 72 8.248 7.729 0.519 1
1 866 . 16 1 1 A 72 72 LYS HA H 72 3.625 3.346 0.279 1
1 873 . 16 1 1 A 72 72 LYS C C 72 178.400 177.862 0.538 1
1 874 . 16 1 1 A 72 72 LYS CA C 72 59.850 59.048 0.802 1
1 875 . 16 1 1 A 72 72 LYS CB C 72 32.070 32.025 0.045 1
1 879 . 16 1 1 A 72 72 LYS N N 72 120.800 120.182 0.618 1
1 880 . 16 1 1 A 73 73 GLN H H 73 7.937 7.943 -0.006 1
1 881 . 16 1 1 A 73 73 GLN HA H 73 4.042 4.054 -0.012 1
1 888 . 16 1 1 A 73 73 GLN C C 73 178.400 178.420 -0.020 1
1 889 . 16 1 1 A 73 73 GLN CA C 73 58.510 58.710 -0.200 1
1 890 . 16 1 1 A 73 73 GLN CB C 73 28.430 28.525 -0.095 1
1 892 . 16 1 1 A 73 73 GLN N N 73 117.000 117.787 -0.787 1
1 894 . 16 1 1 A 74 74 GLN H H 74 7.712 8.049 -0.337 1
1 895 . 16 1 1 A 74 74 GLN HA H 74 4.080 3.875 0.205 1
1 902 . 16 1 1 A 74 74 GLN C C 74 177.800 178.039 -0.239 1
1 903 . 16 1 1 A 74 74 GLN CA C 74 57.270 58.816 -1.546 1
1 904 . 16 1 1 A 74 74 GLN CB C 74 28.700 27.807 0.893 1
1 906 . 16 1 1 A 74 74 GLN N N 74 118.200 118.536 -0.336 1
1 908 . 16 1 1 A 75 75 LEU H H 75 7.956 7.740 0.216 1
1 909 . 16 1 1 A 75 75 LEU HA H 75 4.212 3.761 0.451 1
1 919 . 16 1 1 A 75 75 LEU CA C 75 56.660 57.879 -1.219 1
1 920 . 16 1 1 A 75 75 LEU CB C 75 42.000 41.461 0.539 1
1 924 . 16 1 1 A 75 75 LEU N N 75 120.700 121.438 -0.738 1
1 925 . 16 1 1 A 76 76 GLN H H 76 8.315 7.849 0.466 1
1 926 . 16 1 1 A 76 76 GLN HA H 76 4.113 4.286 -0.173 1
1 933 . 16 1 1 A 76 76 GLN C C 76 177.100 174.566 2.534 1
1 934 . 16 1 1 A 76 76 GLN CA C 76 57.400 54.987 2.413 1
1 935 . 16 1 1 A 76 76 GLN CB C 76 28.640 27.395 1.245 1
1 937 . 16 1 1 A 76 76 GLN N N 76 120.100 117.911 2.189 1
1 939 . 16 1 1 A 77 77 GLY H H 77 8.021 8.287 -0.266 1
1 940 . 16 1 1 A 77 77 GLY HA2 H 77 4.042 4.139 -0.097 1
1 941 . 16 1 1 A 77 77 GLY HA3 H 77 3.869 4.148 -0.279 1
1 942 . 16 1 1 A 77 77 GLY C C 77 174.600 173.624 0.976 1
1 943 . 16 1 1 A 77 77 GLY CA C 77 45.430 45.895 -0.465 1
1 944 . 16 1 1 A 77 77 GLY N N 77 107.700 111.695 -3.995 1
1 945 . 16 1 1 A 78 78 GLY H H 78 7.819 8.814 -0.995 1
1 946 . 16 1 1 A 78 78 GLY HA2 H 78 4.208 3.919 0.289 1
1 947 . 16 1 1 A 78 78 GLY HA3 H 78 3.801 3.924 -0.123 1
1 948 . 16 1 1 A 78 78 GLY C C 78 173.900 174.474 -0.574 1
1 949 . 16 1 1 A 78 78 GLY CA C 78 45.140 45.172 -0.032 1
1 950 . 16 1 1 A 78 78 GLY N N 78 107.100 110.457 -3.357 1
1 951 . 16 1 1 A 79 79 ASP H H 79 7.912 8.204 -0.292 1
1 952 . 16 1 1 A 79 79 ASP HA H 79 4.722 4.767 -0.045 1
1 955 . 16 1 1 A 79 79 ASP C C 79 176.200 176.664 -0.464 1
1 956 . 16 1 1 A 79 79 ASP CA C 79 53.210 53.066 0.144 1
1 957 . 16 1 1 A 79 79 ASP CB C 79 40.160 40.186 -0.026 1
1 958 . 16 1 1 A 79 79 ASP N N 79 119.800 120.203 -0.403 1
1 959 . 16 1 1 A 80 80 ASN H H 80 8.450 8.389 0.061 1
1 960 . 16 1 1 A 80 80 ASN HA H 80 4.593 4.597 -0.004 1
1 965 . 16 1 1 A 80 80 ASN C C 80 177.300 177.570 -0.270 1
1 966 . 16 1 1 A 80 80 ASN CA C 80 54.680 55.517 -0.837 1
1 967 . 16 1 1 A 80 80 ASN CB C 80 38.790 38.215 0.575 1
1 968 . 16 1 1 A 80 80 ASN N N 80 121.700 119.604 2.096 1
1 970 . 16 1 1 A 81 81 SER H H 81 8.444 7.875 0.569 1
1 971 . 16 1 1 A 81 81 SER HA H 81 4.263 4.294 -0.031 1
1 974 . 16 1 1 A 81 81 SER C C 81 176.100 176.709 -0.609 1
1 975 . 16 1 1 A 81 81 SER CA C 81 61.470 61.390 0.080 1
1 976 . 16 1 1 A 81 81 SER CB C 81 61.470 63.133 -1.663 1
1 977 . 16 1 1 A 81 81 SER N N 81 117.100 115.643 1.457 1
1 978 . 16 1 1 A 82 82 LEU H H 82 7.929 8.055 -0.126 1
1 979 . 16 1 1 A 82 82 LEU HA H 82 4.332 3.935 0.397 1
1 989 . 16 1 1 A 82 82 LEU C C 82 177.400 179.169 -1.769 1
1 990 . 16 1 1 A 82 82 LEU CA C 82 55.060 57.916 -2.856 1
1 991 . 16 1 1 A 82 82 LEU CB C 82 41.940 41.646 0.294 1
1 995 . 16 1 1 A 82 82 LEU N N 82 120.400 121.247 -0.847 1
1 996 . 16 1 1 A 83 83 HIS H H 83 8.014 7.977 0.037 1
1 997 . 16 1 1 A 83 83 HIS HA H 83 4.173 4.242 -0.069 1
1 1000 . 16 1 1 A 83 83 HIS C C 83 176.100 176.819 -0.719 1
1 1001 . 16 1 1 A 83 83 HIS CA C 83 59.940 59.303 0.637 1
1 1002 . 16 1 1 A 83 83 HIS CB C 83 28.050 29.836 -1.786 1
1 1003 . 16 1 1 A 83 83 HIS N N 83 119.400 118.443 0.957 1
1 1004 . 16 1 1 A 84 84 ASN H H 84 8.598 8.836 -0.238 1
1 1005 . 16 1 1 A 84 84 ASN HA H 84 4.735 4.667 0.068 1
1 1010 . 16 1 1 A 84 84 ASN C C 84 177.400 177.339 0.061 1
1 1011 . 16 1 1 A 84 84 ASN CA C 84 55.790 54.919 0.871 1
1 1012 . 16 1 1 A 84 84 ASN CB C 84 37.520 38.988 -1.468 1
1 1013 . 16 1 1 A 84 84 ASN N N 84 118.100 117.394 0.706 1
1 1015 . 16 1 1 A 85 85 VAL H H 85 7.933 7.748 0.185 1
1 1016 . 16 1 1 A 85 85 VAL HA H 85 3.849 3.781 0.068 1
1 1024 . 16 1 1 A 85 85 VAL C C 85 177.100 177.959 -0.859 1
1 1025 . 16 1 1 A 85 85 VAL CA C 85 65.490 65.553 -0.063 1
1 1026 . 16 1 1 A 85 85 VAL CB C 85 31.760 31.950 -0.190 1
1 1029 . 16 1 1 A 85 85 VAL N N 85 120.500 120.175 0.325 1
1 1030 . 16 1 1 A 86 86 HIS H H 86 8.460 9.303 -0.843 1
1 1031 . 16 1 1 A 86 86 HIS HA H 86 4.054 4.068 -0.014 1
1 1035 . 16 1 1 A 86 86 HIS C C 86 176.300 177.564 -1.264 1
1 1036 . 16 1 1 A 86 86 HIS CA C 86 59.860 59.733 0.127 1
1 1037 . 16 1 1 A 86 86 HIS CB C 86 29.670 30.218 -0.548 1
1 1038 . 16 1 1 A 86 86 HIS N N 86 119.300 119.041 0.259 1
1 1039 . 16 1 1 A 87 87 GLU H H 87 7.897 8.479 -0.582 1
1 1040 . 16 1 1 A 87 87 GLU HA H 87 3.838 3.809 0.029 1
1 1045 . 16 1 1 A 87 87 GLU C C 87 178.300 179.060 -0.760 1
1 1046 . 16 1 1 A 87 87 GLU CA C 87 58.690 59.212 -0.522 1
1 1047 . 16 1 1 A 87 87 GLU CB C 87 28.460 29.541 -1.081 1
1 1049 . 16 1 1 A 87 87 GLU N N 87 117.100 118.922 -1.822 1
1 1050 . 16 1 1 A 88 88 ASN H H 88 8.103 8.938 -0.835 1
1 1051 . 16 1 1 A 88 88 ASN HA H 88 4.503 4.342 0.161 1
1 1056 . 16 1 1 A 88 88 ASN C C 88 177.700 177.743 -0.043 1
1 1057 . 16 1 1 A 88 88 ASN CA C 88 55.990 56.299 -0.309 1
1 1058 . 16 1 1 A 88 88 ASN CB C 88 39.010 38.460 0.550 1
1 1059 . 16 1 1 A 88 88 ASN N N 88 118.400 117.494 0.906 1
1 1061 . 16 1 1 A 89 89 ILE H H 89 8.501 8.078 0.423 1
1 1062 . 16 1 1 A 89 89 ILE HA H 89 3.670 3.689 -0.019 1
1 1072 . 16 1 1 A 89 89 ILE C C 89 177.000 177.764 -0.764 1
1 1073 . 16 1 1 A 89 89 ILE CA C 89 65.390 64.959 0.431 1
1 1074 . 16 1 1 A 89 89 ILE CB C 89 37.440 37.659 -0.219 1
1 1078 . 16 1 1 A 89 89 ILE N N 89 118.700 119.410 -0.710 1
1 1079 . 16 1 1 A 90 90 LYS H H 90 8.017 7.461 0.556 1
1 1080 . 16 1 1 A 90 90 LYS HA H 90 3.775 3.816 -0.041 1
1 1089 . 16 1 1 A 90 90 LYS C C 90 178.800 178.727 0.073 1
1 1090 . 16 1 1 A 90 90 LYS CA C 90 60.450 59.697 0.753 1
1 1091 . 16 1 1 A 90 90 LYS CB C 90 32.110 32.465 -0.355 1
1 1095 . 16 1 1 A 90 90 LYS N N 90 120.900 121.210 -0.310 1
1 1096 . 16 1 1 A 91 91 GLU H H 91 7.732 7.521 0.211 1
1 1097 . 16 1 1 A 91 91 GLU HA H 91 4.083 3.992 0.091 1
1 1102 . 16 1 1 A 91 91 GLU C C 91 179.100 178.501 0.599 1
1 1103 . 16 1 1 A 91 91 GLU CA C 91 59.120 58.529 0.591 1
1 1104 . 16 1 1 A 91 91 GLU CB C 91 28.810 29.748 -0.938 1
1 1106 . 16 1 1 A 91 91 GLU N N 91 119.300 117.969 1.331 1
1 1107 . 16 1 1 A 92 92 ILE H H 92 8.110 8.379 -0.269 1
1 1108 . 16 1 1 A 92 92 ILE HA H 92 3.685 3.485 0.200 1
1 1118 . 16 1 1 A 92 92 ILE C C 92 178.000 178.113 -0.113 1
1 1119 . 16 1 1 A 92 92 ILE CA C 92 65.900 65.579 0.321 1
1 1120 . 16 1 1 A 92 92 ILE CB C 92 38.400 38.190 0.210 1
1 1124 . 16 1 1 A 92 92 ILE N N 92 121.100 120.621 0.479 1
1 1125 . 16 1 1 A 93 93 PHE H H 93 8.651 8.040 0.611 1
1 1126 . 16 1 1 A 93 93 PHE HA H 93 3.873 3.147 0.726 1
1 1133 . 16 1 1 A 93 93 PHE C C 93 177.100 177.895 -0.795 1
1 1134 . 16 1 1 A 93 93 PHE CA C 93 61.020 60.875 0.145 1
1 1135 . 16 1 1 A 93 93 PHE CB C 93 38.560 38.336 0.224 1
1 1138 . 16 1 1 A 93 93 PHE N N 93 119.400 120.433 -1.033 1
1 1139 . 16 1 1 A 94 94 HIS H H 94 8.126 7.401 0.725 1
1 1140 . 16 1 1 A 94 94 HIS HA H 94 4.368 3.962 0.406 1
1 1145 . 16 1 1 A 94 94 HIS C C 94 177.100 176.938 0.162 1
1 1146 . 16 1 1 A 94 94 HIS CA C 94 58.310 58.051 0.259 1
1 1147 . 16 1 1 A 94 94 HIS CB C 94 27.910 29.506 -1.596 1
1 1148 . 16 1 1 A 94 94 HIS N N 94 116.400 117.921 -1.521 1
1 1149 . 16 1 1 A 95 95 HIS H H 95 8.058 7.798 0.260 1
1 1150 . 16 1 1 A 95 95 HIS HA H 95 4.465 4.403 0.062 1
1 1154 . 16 1 1 A 95 95 HIS C C 95 177.300 178.039 -0.739 1
1 1155 . 16 1 1 A 95 95 HIS CA C 95 57.900 59.477 -1.577 1
1 1156 . 16 1 1 A 95 95 HIS CB C 95 28.490 30.450 -1.960 1
1 1157 . 16 1 1 A 95 95 HIS N N 95 117.000 115.558 1.442 1
1 1158 . 16 1 1 A 96 96 LEU H H 96 8.525 8.163 0.362 1
1 1159 . 16 1 1 A 96 96 LEU HA H 96 3.865 4.044 -0.179 1
1 1169 . 16 1 1 A 96 96 LEU C C 96 178.300 178.550 -0.250 1
1 1170 . 16 1 1 A 96 96 LEU CA C 96 58.250 58.145 0.105 1
1 1171 . 16 1 1 A 96 96 LEU CB C 96 41.720 42.067 -0.347 1
1 1175 . 16 1 1 A 96 96 LEU N N 96 121.300 121.183 0.117 1
1 1176 . 16 1 1 A 97 97 GLU H H 97 8.076 8.447 -0.371 1
1 1177 . 16 1 1 A 97 97 GLU HA H 97 3.719 4.070 -0.351 1
1 1182 . 16 1 1 A 97 97 GLU C C 97 178.300 178.746 -0.446 1
1 1183 . 16 1 1 A 97 97 GLU CA C 97 59.300 58.672 0.628 1
1 1184 . 16 1 1 A 97 97 GLU CB C 97 28.960 29.579 -0.619 1
1 1186 . 16 1 1 A 97 97 GLU N N 97 117.100 118.592 -1.492 1
1 1187 . 16 1 1 A 98 98 GLU H H 98 7.329 7.865 -0.536 1
1 1188 . 16 1 1 A 98 98 GLU HA H 98 4.024 4.215 -0.191 1
1 1193 . 16 1 1 A 98 98 GLU C C 98 177.900 179.142 -1.242 1
1 1194 . 16 1 1 A 98 98 GLU CA C 98 58.190 58.642 -0.452 1
1 1195 . 16 1 1 A 98 98 GLU CB C 98 29.120 29.616 -0.496 1
1 1197 . 16 1 1 A 98 98 GLU N N 98 116.000 119.382 -3.382 1
1 1198 . 16 1 1 A 99 99 LEU H H 99 7.535 8.385 -0.850 1
1 1199 . 16 1 1 A 99 99 LEU HA H 99 4.183 4.139 0.044 1
1 1209 . 16 1 1 A 99 99 LEU C C 99 178.100 177.700 0.400 1
1 1210 . 16 1 1 A 99 99 LEU CA C 99 56.440 56.843 -0.403 1
1 1211 . 16 1 1 A 99 99 LEU CB C 99 43.010 41.765 1.245 1
1 1215 . 16 1 1 A 99 99 LEU N N 99 118.200 119.570 -1.370 1
1 1216 . 16 1 1 A 100 100 VAL H H 100 7.561 7.468 0.093 1
1 1217 . 16 1 1 A 100 100 VAL HA H 100 4.033 4.329 -0.296 1
1 1225 . 16 1 1 A 100 100 VAL C C 100 175.400 178.072 -2.672 1
1 1226 . 16 1 1 A 100 100 VAL CA C 100 62.430 63.655 -1.225 1
1 1227 . 16 1 1 A 100 100 VAL CB C 100 32.050 32.952 -0.902 1
1 1230 . 16 1 1 A 100 100 VAL N N 100 114.800 112.787 2.013 1
1 1231 . 16 1 1 A 101 101 HIS H H 101 7.827 7.897 -0.070 1
1 1232 . 16 1 1 A 101 101 HIS HA H 101 4.630 4.153 0.477 1
1 1237 . 16 1 1 A 101 101 HIS C C 101 173.500 175.459 -1.959 1
1 1238 . 16 1 1 A 101 101 HIS CA C 101 55.410 59.233 -3.823 1
1 1239 . 16 1 1 A 101 101 HIS CB C 101 28.870 30.147 -1.277 1
1 1240 . 16 1 1 A 101 101 HIS N N 101 120.300 123.087 -2.787 1
1 10 . 17 1 1 A 2 2 TYR H H 2 8.688 7.413 1.275 1
1 11 . 17 1 1 A 2 2 TYR HA H 2 4.737 4.253 0.484 1
1 16 . 17 1 1 A 2 2 TYR C C 2 175.900 176.171 -0.271 1
1 17 . 17 1 1 A 2 2 TYR CA C 2 57.920 60.842 -2.922 1
1 18 . 17 1 1 A 2 2 TYR CB C 2 38.340 38.406 -0.066 1
1 19 . 17 1 1 A 2 2 TYR N N 2 122.100 125.418 -3.318 1
1 20 . 17 1 1 A 3 3 GLY H H 3 8.434 8.229 0.205 1
1 21 . 17 1 1 A 3 3 GLY HA2 H 3 3.909 4.121 -0.212 1
1 22 . 17 1 1 A 3 3 GLY HA3 H 3 3.841 4.167 -0.326 1
1 23 . 17 1 1 A 3 3 GLY C C 3 174.300 176.121 -1.821 1
1 24 . 17 1 1 A 3 3 GLY CA C 3 46.050 45.538 0.512 1
1 25 . 17 1 1 A 3 3 GLY N N 3 111.100 108.390 2.710 1
1 26 . 17 1 1 A 4 4 LYS H H 4 8.060 8.311 -0.251 1
1 27 . 17 1 1 A 4 4 LYS HA H 4 4.297 4.206 0.091 1
1 36 . 17 1 1 A 4 4 LYS C C 4 178.000 179.065 -1.065 1
1 37 . 17 1 1 A 4 4 LYS CA C 4 56.930 59.430 -2.500 1
1 38 . 17 1 1 A 4 4 LYS CB C 4 32.680 32.289 0.391 1
1 42 . 17 1 1 A 4 4 LYS N N 4 119.500 121.374 -1.874 1
1 43 . 17 1 1 A 5 5 LEU H H 5 8.243 8.174 0.069 1
1 44 . 17 1 1 A 5 5 LEU HA H 5 3.947 3.837 0.110 1
1 54 . 17 1 1 A 5 5 LEU C C 5 177.900 178.866 -0.966 1
1 55 . 17 1 1 A 5 5 LEU CA C 5 57.930 57.770 0.160 1
1 56 . 17 1 1 A 5 5 LEU CB C 5 41.620 41.656 -0.036 1
1 60 . 17 1 1 A 5 5 LEU N N 5 120.800 119.849 0.951 1
1 61 . 17 1 1 A 6 6 ASN H H 6 8.256 7.909 0.347 1
1 62 . 17 1 1 A 6 6 ASN HA H 6 4.252 4.212 0.040 1
1 67 . 17 1 1 A 6 6 ASN C C 6 177.300 177.583 -0.283 1
1 68 . 17 1 1 A 6 6 ASN CA C 6 56.900 56.454 0.446 1
1 69 . 17 1 1 A 6 6 ASN CB C 6 38.200 38.260 -0.060 1
1 70 . 17 1 1 A 6 6 ASN N N 6 116.200 116.593 -0.393 1
1 72 . 17 1 1 A 7 7 ASP H H 7 7.699 8.713 -1.014 1
1 73 . 17 1 1 A 7 7 ASP HA H 7 4.320 4.458 -0.138 1
1 76 . 17 1 1 A 7 7 ASP C C 7 178.000 178.876 -0.876 1
1 77 . 17 1 1 A 7 7 ASP CA C 7 56.980 57.512 -0.532 1
1 78 . 17 1 1 A 7 7 ASP CB C 7 39.870 40.409 -0.539 1
1 79 . 17 1 1 A 7 7 ASP N N 7 119.100 118.139 0.961 1
1 80 . 17 1 1 A 8 8 LEU H H 8 7.580 8.648 -1.068 1
1 81 . 17 1 1 A 8 8 LEU HA H 8 4.091 4.091 0.000 1
1 91 . 17 1 1 A 8 8 LEU C C 8 178.800 179.021 -0.221 1
1 92 . 17 1 1 A 8 8 LEU CA C 8 57.790 58.005 -0.215 1
1 93 . 17 1 1 A 8 8 LEU CB C 8 41.880 41.730 0.150 1
1 97 . 17 1 1 A 8 8 LEU N N 8 120.400 120.673 -0.273 1
1 98 . 17 1 1 A 9 9 LEU H H 9 8.125 8.920 -0.795 1
1 99 . 17 1 1 A 9 9 LEU HA H 9 3.891 3.953 -0.062 1
1 109 . 17 1 1 A 9 9 LEU C C 9 178.900 178.543 0.357 1
1 110 . 17 1 1 A 9 9 LEU CA C 9 58.350 58.453 -0.103 1
1 111 . 17 1 1 A 9 9 LEU CB C 9 41.510 41.863 -0.353 1
1 115 . 17 1 1 A 9 9 LEU N N 9 118.900 120.092 -1.192 1
1 116 . 17 1 1 A 10 10 GLU H H 10 8.011 9.036 -1.025 1
1 117 . 17 1 1 A 10 10 GLU HA H 10 4.072 4.218 -0.146 1
1 122 . 17 1 1 A 10 10 GLU C C 10 179.000 178.343 0.657 1
1 123 . 17 1 1 A 10 10 GLU CA C 10 59.090 60.003 -0.913 1
1 124 . 17 1 1 A 10 10 GLU CB C 10 27.910 29.151 -1.241 1
1 126 . 17 1 1 A 10 10 GLU N N 10 119.300 117.968 1.332 1
1 127 . 17 1 1 A 11 11 ASP H H 11 8.128 8.026 0.102 1
1 128 . 17 1 1 A 11 11 ASP HA H 11 4.383 4.664 -0.281 1
1 131 . 17 1 1 A 11 11 ASP C C 11 178.500 178.242 0.258 1
1 132 . 17 1 1 A 11 11 ASP CA C 11 56.580 56.386 0.194 1
1 133 . 17 1 1 A 11 11 ASP CB C 11 38.600 40.669 -2.069 1
1 134 . 17 1 1 A 11 11 ASP N N 11 119.600 119.430 0.170 1
1 135 . 17 1 1 A 12 12 LEU H H 12 8.394 7.995 0.399 1
1 136 . 17 1 1 A 12 12 LEU HA H 12 3.923 4.279 -0.356 1
1 146 . 17 1 1 A 12 12 LEU C C 12 178.200 178.663 -0.463 1
1 147 . 17 1 1 A 12 12 LEU CA C 12 57.880 57.665 0.215 1
1 148 . 17 1 1 A 12 12 LEU CB C 12 41.850 41.906 -0.056 1
1 152 . 17 1 1 A 12 12 LEU N N 12 120.500 120.224 0.276 1
1 153 . 17 1 1 A 13 13 GLN H H 13 8.371 8.666 -0.295 1
1 154 . 17 1 1 A 13 13 GLN HA H 13 3.879 4.035 -0.156 1
1 161 . 17 1 1 A 13 13 GLN C C 13 178.600 177.966 0.634 1
1 162 . 17 1 1 A 13 13 GLN CA C 13 59.570 58.221 1.349 1
1 163 . 17 1 1 A 13 13 GLN CB C 13 28.440 27.662 0.778 1
1 165 . 17 1 1 A 13 13 GLN N N 13 118.400 117.060 1.340 1
1 167 . 17 1 1 A 14 14 GLU H H 14 7.913 7.538 0.375 1
1 168 . 17 1 1 A 14 14 GLU HA H 14 4.021 4.096 -0.075 1
1 173 . 17 1 1 A 14 14 GLU C C 14 179.000 178.919 0.081 1
1 174 . 17 1 1 A 14 14 GLU CA C 14 59.030 59.005 0.025 1
1 175 . 17 1 1 A 14 14 GLU CB C 14 28.720 29.470 -0.750 1
1 177 . 17 1 1 A 14 14 GLU N N 14 119.100 119.630 -0.530 1
1 178 . 17 1 1 A 15 15 VAL H H 15 7.991 7.743 0.248 1
1 179 . 17 1 1 A 15 15 VAL HA H 15 3.696 3.882 -0.186 1
1 187 . 17 1 1 A 15 15 VAL C C 15 178.300 178.051 0.249 1
1 188 . 17 1 1 A 15 15 VAL CA C 15 66.640 65.563 1.077 1
1 189 . 17 1 1 A 15 15 VAL CB C 15 31.470 31.587 -0.117 1
1 192 . 17 1 1 A 15 15 VAL N N 15 120.300 117.532 2.768 1
1 193 . 17 1 1 A 16 16 LEU H H 16 8.172 7.936 0.236 1
1 194 . 17 1 1 A 16 16 LEU HA H 16 3.876 4.179 -0.303 1
1 204 . 17 1 1 A 16 16 LEU C C 16 178.400 178.628 -0.228 1
1 205 . 17 1 1 A 16 16 LEU CA C 16 58.050 58.111 -0.061 1
1 206 . 17 1 1 A 16 16 LEU CB C 16 41.420 41.376 0.044 1
1 210 . 17 1 1 A 16 16 LEU N N 16 119.700 125.105 -5.405 1
1 211 . 17 1 1 A 17 17 LYS H H 17 7.755 9.187 -1.432 1
1 212 . 17 1 1 A 17 17 LYS HA H 17 3.951 4.102 -0.151 1
1 221 . 17 1 1 A 17 17 LYS C C 17 178.800 178.917 -0.117 1
1 222 . 17 1 1 A 17 17 LYS CA C 17 59.470 58.880 0.590 1
1 223 . 17 1 1 A 17 17 LYS CB C 17 32.350 32.850 -0.500 1
1 227 . 17 1 1 A 17 17 LYS N N 17 117.800 120.153 -2.353 1
1 228 . 17 1 1 A 18 18 HIS H H 18 7.847 8.424 -0.577 1
1 229 . 17 1 1 A 18 18 HIS HA H 18 4.549 4.518 0.031 1
1 233 . 17 1 1 A 18 18 HIS C C 18 177.200 175.924 1.276 1
1 234 . 17 1 1 A 18 18 HIS CA C 18 57.870 57.011 0.859 1
1 235 . 17 1 1 A 18 18 HIS CB C 18 28.730 29.288 -0.558 1
1 236 . 17 1 1 A 18 18 HIS N N 18 116.200 119.702 -3.502 1
1 237 . 17 1 1 A 19 19 VAL H H 19 8.415 7.859 0.556 1
1 238 . 17 1 1 A 19 19 VAL HA H 19 3.746 4.105 -0.359 1
1 246 . 17 1 1 A 19 19 VAL CA C 19 65.850 63.771 2.079 1
1 247 . 17 1 1 A 19 19 VAL CB C 19 31.600 33.620 -2.020 1
1 250 . 17 1 1 A 20 20 ASN H H 20 8.041 8.283 -0.242 1
1 251 . 17 1 1 A 20 20 ASN HA H 20 4.545 4.600 -0.055 1
1 256 . 17 1 1 A 20 20 ASN C C 20 176.900 178.549 -1.649 1
1 257 . 17 1 1 A 20 20 ASN CA C 20 55.070 56.600 -1.530 1
1 258 . 17 1 1 A 20 20 ASN CB C 20 38.270 38.238 0.032 1
1 259 . 17 1 1 A 20 20 ASN N N 20 117.900 119.114 -1.214 1
1 261 . 17 1 1 A 21 21 GLN H H 21 7.887 7.918 -0.031 1
1 262 . 17 1 1 A 21 21 GLN HA H 21 4.096 4.208 -0.112 1
1 269 . 17 1 1 A 21 21 GLN C C 21 176.900 177.081 -0.181 1
1 270 . 17 1 1 A 21 21 GLN CA C 21 57.510 58.124 -0.614 1
1 271 . 17 1 1 A 21 21 GLN CB C 21 29.100 29.257 -0.157 1
1 273 . 17 1 1 A 21 21 GLN N N 21 117.900 117.215 0.685 1
1 275 . 17 1 1 A 22 22 HIS H H 22 7.887 8.213 -0.326 1
1 276 . 17 1 1 A 22 22 HIS HA H 22 4.679 4.828 -0.149 1
1 280 . 17 1 1 A 22 22 HIS C C 22 174.300 175.006 -0.706 1
1 281 . 17 1 1 A 22 22 HIS CA C 22 55.770 55.240 0.530 1
1 282 . 17 1 1 A 22 22 HIS CB C 22 28.630 28.991 -0.361 1
1 283 . 17 1 1 A 22 22 HIS N N 22 116.100 112.677 3.423 1
1 284 . 17 1 1 A 23 23 TRP H H 23 7.929 7.870 0.059 1
1 285 . 17 1 1 A 23 23 TRP HA H 23 4.542 4.784 -0.242 1
1 292 . 17 1 1 A 23 23 TRP C C 23 176.600 175.420 1.180 1
1 293 . 17 1 1 A 23 23 TRP CA C 23 58.020 57.784 0.236 1
1 294 . 17 1 1 A 23 23 TRP CB C 23 29.700 30.646 -0.946 1
1 295 . 17 1 1 A 23 23 TRP N N 23 122.000 124.022 -2.022 1
1 297 . 17 1 1 A 24 24 GLN H H 24 8.258 8.282 -0.024 1
1 298 . 17 1 1 A 24 24 GLN HA H 24 4.329 4.782 -0.453 1
1 305 . 17 1 1 A 24 24 GLN C C 24 176.200 175.303 0.897 1
1 306 . 17 1 1 A 24 24 GLN CA C 24 55.960 55.403 0.557 1
1 307 . 17 1 1 A 24 24 GLN CB C 24 29.440 32.277 -2.837 1
1 309 . 17 1 1 A 24 24 GLN N N 24 123.800 126.486 -2.686 1
1 311 . 17 1 1 A 25 25 GLY H H 25 7.470 8.817 -1.347 1
1 312 . 17 1 1 A 25 25 GLY HA2 H 25 3.939 3.997 -0.058 1
1 313 . 17 1 1 A 25 25 GLY HA3 H 25 3.800 4.026 -0.226 1
1 314 . 17 1 1 A 25 25 GLY C C 25 174.800 175.500 -0.700 1
1 315 . 17 1 1 A 25 25 GLY CA C 25 45.470 45.970 -0.500 1
1 316 . 17 1 1 A 25 25 GLY N N 25 108.100 112.451 -4.351 1
1 317 . 17 1 1 A 26 26 GLY H H 26 8.332 8.720 -0.388 1
1 318 . 17 1 1 A 26 26 GLY HA2 H 26 4.105 4.156 -0.051 1
1 319 . 17 1 1 A 26 26 GLY HA3 H 26 3.974 4.221 -0.247 1
1 320 . 17 1 1 A 26 26 GLY C C 26 174.900 175.229 -0.329 1
1 321 . 17 1 1 A 26 26 GLY CA C 26 45.410 45.824 -0.414 1
1 322 . 17 1 1 A 26 26 GLY N N 26 108.700 107.350 1.350 1
1 323 . 17 1 1 A 27 27 GLN H H 27 8.474 8.169 0.305 1
1 324 . 17 1 1 A 27 27 GLN HA H 27 4.106 3.945 0.161 1
1 331 . 17 1 1 A 27 27 GLN C C 27 177.100 176.835 0.265 1
1 332 . 17 1 1 A 27 27 GLN CA C 27 57.540 58.246 -0.706 1
1 333 . 17 1 1 A 27 27 GLN CB C 27 29.050 28.948 0.102 1
1 335 . 17 1 1 A 27 27 GLN N N 27 121.100 120.268 0.832 1
1 337 . 17 1 1 A 28 28 LYS H H 28 8.448 8.195 0.253 1
1 338 . 17 1 1 A 28 28 LYS HA H 28 4.068 4.046 0.022 1
1 347 . 17 1 1 A 28 28 LYS C C 28 177.900 178.547 -0.647 1
1 348 . 17 1 1 A 28 28 LYS CA C 28 58.410 58.863 -0.453 1
1 349 . 17 1 1 A 28 28 LYS CB C 28 32.210 32.391 -0.181 1
1 353 . 17 1 1 A 28 28 LYS N N 28 120.500 117.434 3.066 1
1 354 . 17 1 1 A 29 29 ASN H H 29 8.273 8.860 -0.587 1
1 355 . 17 1 1 A 29 29 ASN HA H 29 4.584 4.381 0.203 1
1 360 . 17 1 1 A 29 29 ASN C C 29 176.200 177.310 -1.110 1
1 361 . 17 1 1 A 29 29 ASN CA C 29 54.400 56.262 -1.862 1
1 362 . 17 1 1 A 29 29 ASN CB C 29 38.280 38.084 0.196 1
1 363 . 17 1 1 A 29 29 ASN N N 29 117.500 118.160 -0.660 1
1 365 . 17 1 1 A 30 30 MET H H 30 7.870 7.507 0.363 1
1 366 . 17 1 1 A 30 30 MET HA H 30 4.085 2.939 1.146 1
1 371 . 17 1 1 A 30 30 MET C C 30 177.000 177.865 -0.865 1
1 372 . 17 1 1 A 30 30 MET CA C 30 56.880 58.210 -1.330 1
1 373 . 17 1 1 A 30 30 MET CB C 30 32.340 31.581 0.759 1
1 375 . 17 1 1 A 30 30 MET N N 30 121.100 118.644 2.456 1
1 376 . 17 1 1 A 31 31 ASN H H 31 8.186 7.552 0.634 1
1 377 . 17 1 1 A 31 31 ASN HA H 31 4.311 4.509 -0.198 1
1 382 . 17 1 1 A 31 31 ASN C C 31 176.700 177.767 -1.067 1
1 383 . 17 1 1 A 31 31 ASN CA C 31 55.320 55.694 -0.374 1
1 384 . 17 1 1 A 31 31 ASN CB C 31 38.410 38.473 -0.063 1
1 385 . 17 1 1 A 31 31 ASN N N 31 117.900 116.212 1.688 1
1 387 . 17 1 1 A 32 32 LYS H H 32 7.792 7.172 0.620 1
1 388 . 17 1 1 A 32 32 LYS HA H 32 3.992 4.037 -0.045 1
1 397 . 17 1 1 A 32 32 LYS C C 32 177.900 179.145 -1.245 1
1 398 . 17 1 1 A 32 32 LYS CA C 32 59.050 59.352 -0.302 1
1 399 . 17 1 1 A 32 32 LYS CB C 32 32.460 32.548 -0.088 1
1 403 . 17 1 1 A 32 32 LYS N N 32 120.400 118.831 1.569 1
1 404 . 17 1 1 A 33 33 VAL H H 33 7.689 8.627 -0.938 1
1 405 . 17 1 1 A 33 33 VAL HA H 33 3.791 3.699 0.092 1
1 413 . 17 1 1 A 33 33 VAL C C 33 177.100 177.654 -0.554 1
1 414 . 17 1 1 A 33 33 VAL CA C 33 65.360 64.746 0.614 1
1 415 . 17 1 1 A 33 33 VAL CB C 33 31.920 31.329 0.591 1
1 418 . 17 1 1 A 33 33 VAL N N 33 120.200 115.527 4.673 1
1 419 . 17 1 1 A 34 34 ASP H H 34 8.408 8.218 0.190 1
1 420 . 17 1 1 A 34 34 ASP HA H 34 4.303 4.235 0.068 1
1 423 . 17 1 1 A 34 34 ASP C C 34 178.200 178.258 -0.058 1
1 424 . 17 1 1 A 34 34 ASP CA C 34 55.880 57.185 -1.305 1
1 425 . 17 1 1 A 34 34 ASP CB C 34 38.710 41.745 -3.035 1
1 426 . 17 1 1 A 34 34 ASP N N 34 120.100 120.970 -0.870 1
1 427 . 17 1 1 A 35 35 HIS H H 35 8.204 7.658 0.546 1
1 428 . 17 1 1 A 35 35 HIS HA H 35 4.343 4.281 0.062 1
1 431 . 17 1 1 A 35 35 HIS C C 35 176.800 177.461 -0.661 1
1 432 . 17 1 1 A 35 35 HIS CA C 35 58.310 59.090 -0.780 1
1 433 . 17 1 1 A 35 35 HIS CB C 35 28.070 29.784 -1.714 1
1 434 . 17 1 1 A 35 35 HIS N N 35 118.200 119.131 -0.931 1
1 435 . 17 1 1 A 36 36 HIS H H 36 8.067 8.287 -0.220 1
1 436 . 17 1 1 A 36 36 HIS HA H 36 4.602 4.062 0.540 1
1 440 . 17 1 1 A 36 36 HIS C C 36 177.100 177.617 -0.517 1
1 441 . 17 1 1 A 36 36 HIS CA C 36 58.520 59.476 -0.956 1
1 442 . 17 1 1 A 36 36 HIS CB C 36 28.720 30.134 -1.414 1
1 443 . 17 1 1 A 36 36 HIS N N 36 117.100 116.793 0.307 1
1 444 . 17 1 1 A 37 37 LEU H H 37 8.473 8.250 0.223 1
1 445 . 17 1 1 A 37 37 LEU HA H 37 3.894 3.736 0.158 1
1 455 . 17 1 1 A 37 37 LEU C C 37 178.200 178.761 -0.561 1
1 456 . 17 1 1 A 37 37 LEU CA C 37 58.520 57.858 0.662 1
1 457 . 17 1 1 A 37 37 LEU CB C 37 41.810 41.413 0.397 1
1 461 . 17 1 1 A 37 37 LEU N N 37 119.600 119.539 0.061 1
1 462 . 17 1 1 A 38 38 GLN H H 38 8.337 8.433 -0.096 1
1 463 . 17 1 1 A 38 38 GLN HA H 38 3.882 3.980 -0.098 1
1 470 . 17 1 1 A 38 38 GLN C C 38 178.500 177.760 0.740 1
1 471 . 17 1 1 A 38 38 GLN CA C 38 59.200 59.264 -0.064 1
1 472 . 17 1 1 A 38 38 GLN CB C 38 27.850 28.501 -0.651 1
1 474 . 17 1 1 A 38 38 GLN N N 38 118.000 117.429 0.571 1
1 476 . 17 1 1 A 39 39 ASN H H 39 7.923 7.592 0.331 1
1 477 . 17 1 1 A 39 39 ASN HA H 39 4.390 4.616 -0.226 1
1 482 . 17 1 1 A 39 39 ASN C C 39 177.500 177.975 -0.475 1
1 483 . 17 1 1 A 39 39 ASN CA C 39 55.780 56.113 -0.333 1
1 484 . 17 1 1 A 39 39 ASN CB C 39 37.450 38.539 -1.089 1
1 485 . 17 1 1 A 39 39 ASN N N 39 118.700 117.013 1.687 1
1 487 . 17 1 1 A 40 40 VAL H H 40 7.907 8.522 -0.615 1
1 488 . 17 1 1 A 40 40 VAL HA H 40 3.629 3.546 0.083 1
1 496 . 17 1 1 A 40 40 VAL C C 40 177.500 177.938 -0.438 1
1 497 . 17 1 1 A 40 40 VAL CA C 40 67.080 66.413 0.667 1
1 498 . 17 1 1 A 40 40 VAL CB C 40 31.390 31.598 -0.208 1
1 501 . 17 1 1 A 40 40 VAL N N 40 120.400 120.529 -0.129 1
1 502 . 17 1 1 A 41 41 ILE H H 41 8.103 8.099 0.004 1
1 503 . 17 1 1 A 41 41 ILE HA H 41 3.401 3.674 -0.273 1
1 513 . 17 1 1 A 41 41 ILE C C 41 178.000 178.776 -0.776 1
1 514 . 17 1 1 A 41 41 ILE CA C 41 66.430 65.446 0.984 1
1 515 . 17 1 1 A 41 41 ILE CB C 41 38.050 37.709 0.341 1
1 519 . 17 1 1 A 41 41 ILE N N 41 120.600 119.657 0.943 1
1 520 . 17 1 1 A 42 42 GLU H H 42 8.150 8.143 0.007 1
1 521 . 17 1 1 A 42 42 GLU HA H 42 4.062 4.097 -0.035 1
1 526 . 17 1 1 A 42 42 GLU C C 42 178.500 178.974 -0.474 1
1 527 . 17 1 1 A 42 42 GLU CA C 42 59.120 59.475 -0.355 1
1 528 . 17 1 1 A 42 42 GLU CB C 42 28.160 28.790 -0.630 1
1 530 . 17 1 1 A 42 42 GLU N N 42 119.900 121.423 -1.523 1
1 531 . 17 1 1 A 43 43 ASP H H 43 8.453 9.081 -0.628 1
1 532 . 17 1 1 A 43 43 ASP HA H 43 4.445 4.447 -0.002 1
1 535 . 17 1 1 A 43 43 ASP C C 43 178.400 178.661 -0.261 1
1 536 . 17 1 1 A 43 43 ASP CA C 43 56.490 58.117 -1.627 1
1 537 . 17 1 1 A 43 43 ASP CB C 43 37.820 41.590 -3.770 1
1 538 . 17 1 1 A 43 43 ASP N N 43 119.700 120.080 -0.380 1
1 539 . 17 1 1 A 44 44 ILE H H 44 8.544 7.778 0.766 1
1 540 . 17 1 1 A 44 44 ILE HA H 44 3.590 3.745 -0.155 1
1 550 . 17 1 1 A 44 44 ILE C C 44 177.800 178.416 -0.616 1
1 551 . 17 1 1 A 44 44 ILE CA C 44 66.320 65.320 1.000 1
1 552 . 17 1 1 A 44 44 ILE CB C 44 37.690 38.201 -0.511 1
1 556 . 17 1 1 A 44 44 ILE N N 44 121.500 119.565 1.935 1
1 557 . 17 1 1 A 45 45 HIS H H 45 8.261 8.248 0.013 1
1 558 . 17 1 1 A 45 45 HIS HA H 45 4.255 4.501 -0.246 1
1 562 . 17 1 1 A 45 45 HIS C C 45 177.200 177.248 -0.048 1
1 563 . 17 1 1 A 45 45 HIS CA C 45 59.580 58.983 0.597 1
1 564 . 17 1 1 A 45 45 HIS CB C 45 27.790 29.489 -1.699 1
1 565 . 17 1 1 A 45 45 HIS N N 45 118.800 119.507 -0.707 1
1 566 . 17 1 1 A 46 46 ASP H H 46 8.680 7.958 0.722 1
1 567 . 17 1 1 A 46 46 ASP HA H 46 4.338 4.471 -0.133 1
1 570 . 17 1 1 A 46 46 ASP C C 46 178.700 178.183 0.517 1
1 571 . 17 1 1 A 46 46 ASP CA C 46 57.010 55.521 1.489 1
1 572 . 17 1 1 A 46 46 ASP CB C 46 39.400 40.781 -1.381 1
1 573 . 17 1 1 A 46 46 ASP N N 46 119.200 119.379 -0.179 1
1 574 . 17 1 1 A 47 47 PHE H H 47 8.380 9.519 -1.139 1
1 575 . 17 1 1 A 47 47 PHE HA H 47 4.070 4.235 -0.165 1
1 580 . 17 1 1 A 47 47 PHE C C 47 178.600 177.859 0.741 1
1 581 . 17 1 1 A 47 47 PHE CA C 47 61.250 60.426 0.824 1
1 582 . 17 1 1 A 47 47 PHE CB C 47 39.570 39.518 0.052 1
1 583 . 17 1 1 A 47 47 PHE N N 47 121.800 120.878 0.922 1
1 584 . 17 1 1 A 48 48 MET H H 48 8.366 8.336 0.030 1
1 585 . 17 1 1 A 48 48 MET HA H 48 3.998 4.489 -0.491 1
1 590 . 17 1 1 A 48 48 MET C C 48 177.400 177.691 -0.291 1
1 591 . 17 1 1 A 48 48 MET CA C 48 58.470 58.218 0.252 1
1 592 . 17 1 1 A 48 48 MET CB C 48 33.170 32.713 0.457 1
1 594 . 17 1 1 A 48 48 MET N N 48 117.700 118.302 -0.602 1
1 595 . 17 1 1 A 49 49 GLN H H 49 7.659 8.287 -0.628 1
1 596 . 17 1 1 A 49 49 GLN HA H 49 4.258 4.380 -0.122 1
1 603 . 17 1 1 A 49 49 GLN C C 49 176.700 178.462 -1.762 1
1 604 . 17 1 1 A 49 49 GLN CA C 49 56.380 57.708 -1.328 1
1 605 . 17 1 1 A 49 49 GLN CB C 49 28.980 29.671 -0.691 1
1 607 . 17 1 1 A 49 49 GLN N N 49 116.700 116.486 0.214 1
1 609 . 17 1 1 A 50 50 GLY H H 50 7.685 8.906 -1.221 1
1 610 . 17 1 1 A 50 50 GLY HA2 H 50 3.998 3.893 0.105 1
1 611 . 17 1 1 A 50 50 GLY HA3 H 50 3.998 3.903 0.095 1
1 612 . 17 1 1 A 50 50 GLY C C 50 174.900 175.163 -0.263 1
1 613 . 17 1 1 A 50 50 GLY CA C 50 45.460 45.688 -0.228 1
1 614 . 17 1 1 A 50 50 GLY N N 50 106.400 108.627 -2.227 1
1 615 . 17 1 1 A 51 51 GLY H H 51 8.031 9.193 -1.162 1
1 616 . 17 1 1 A 51 51 GLY HA2 H 51 3.817 3.899 -0.082 1
1 617 . 17 1 1 A 51 51 GLY HA3 H 51 3.817 3.901 -0.084 1
1 618 . 17 1 1 A 51 51 GLY C C 51 174.500 175.274 -0.774 1
1 619 . 17 1 1 A 51 51 GLY CA C 51 45.190 45.450 -0.260 1
1 620 . 17 1 1 A 51 51 GLY N N 51 108.900 108.382 0.518 1
1 621 . 17 1 1 A 52 52 GLY H H 52 8.126 8.304 -0.178 1
1 622 . 17 1 1 A 52 52 GLY HA2 H 52 3.362 2.382 0.980 1
1 623 . 17 1 1 A 52 52 GLY HA3 H 52 3.362 3.642 -0.280 1
1 624 . 17 1 1 A 52 52 GLY C C 52 173.300 174.321 -1.021 1
1 625 . 17 1 1 A 52 52 GLY CA C 52 45.120 44.506 0.614 1
1 626 . 17 1 1 A 52 52 GLY N N 52 108.100 107.732 0.368 1
1 627 . 17 1 1 A 53 53 SER H H 53 7.594 7.978 -0.384 1
1 628 . 17 1 1 A 53 53 SER HA H 53 4.530 4.313 0.217 1
1 631 . 17 1 1 A 53 53 SER C C 53 175.300 176.336 -1.036 1
1 632 . 17 1 1 A 53 53 SER CA C 53 57.770 59.940 -2.170 1
1 633 . 17 1 1 A 53 53 SER CB C 53 64.750 63.394 1.356 1
1 634 . 17 1 1 A 53 53 SER N N 53 114.100 116.656 -2.556 1
1 635 . 17 1 1 A 54 54 GLY H H 54 9.003 8.867 0.136 1
1 636 . 17 1 1 A 54 54 GLY HA2 H 54 4.037 3.953 0.084 1
1 637 . 17 1 1 A 54 54 GLY HA3 H 54 3.911 4.061 -0.150 1
1 638 . 17 1 1 A 54 54 GLY C C 54 176.500 175.638 0.862 1
1 639 . 17 1 1 A 54 54 GLY CA C 54 47.040 47.178 -0.138 1
1 640 . 17 1 1 A 54 54 GLY N N 54 110.400 112.571 -2.171 1
1 641 . 17 1 1 A 55 55 GLY H H 55 8.617 8.359 0.258 1
1 642 . 17 1 1 A 55 55 GLY HA2 H 55 3.946 3.880 0.066 1
1 643 . 17 1 1 A 55 55 GLY HA3 H 55 3.946 3.895 0.051 1
1 644 . 17 1 1 A 55 55 GLY C C 55 176.400 176.169 0.231 1
1 645 . 17 1 1 A 55 55 GLY CA C 55 46.630 47.059 -0.429 1
1 646 . 17 1 1 A 55 55 GLY N N 55 109.800 109.697 0.103 1
1 647 . 17 1 1 A 56 56 LYS H H 56 7.876 8.819 -0.943 1
1 648 . 17 1 1 A 56 56 LYS HA H 56 4.195 4.161 0.034 1
1 657 . 17 1 1 A 56 56 LYS C C 56 178.600 178.962 -0.362 1
1 658 . 17 1 1 A 56 56 LYS CA C 56 57.960 59.236 -1.276 1
1 659 . 17 1 1 A 56 56 LYS CB C 56 32.110 32.187 -0.077 1
1 663 . 17 1 1 A 56 56 LYS N N 56 121.800 122.463 -0.663 1
1 664 . 17 1 1 A 57 57 LEU H H 57 8.153 7.564 0.589 1
1 665 . 17 1 1 A 57 57 LEU HA H 57 3.992 4.297 -0.305 1
1 675 . 17 1 1 A 57 57 LEU C C 57 178.400 178.828 -0.428 1
1 676 . 17 1 1 A 57 57 LEU CA C 57 58.190 57.703 0.487 1
1 677 . 17 1 1 A 57 57 LEU CB C 57 41.360 41.936 -0.576 1
1 681 . 17 1 1 A 57 57 LEU N N 57 120.700 122.141 -1.441 1
1 682 . 17 1 1 A 58 58 GLN H H 58 8.019 8.383 -0.364 1
1 683 . 17 1 1 A 58 58 GLN HA H 58 3.942 4.205 -0.263 1
1 690 . 17 1 1 A 58 58 GLN C C 58 179.100 178.201 0.899 1
1 691 . 17 1 1 A 58 58 GLN CA C 58 59.360 58.029 1.331 1
1 692 . 17 1 1 A 58 58 GLN CB C 58 28.030 28.394 -0.364 1
1 694 . 17 1 1 A 58 58 GLN N N 58 117.400 117.951 -0.551 1
1 696 . 17 1 1 A 59 59 GLU H H 59 7.838 8.113 -0.275 1
1 697 . 17 1 1 A 59 59 GLU HA H 59 4.030 4.134 -0.104 1
1 702 . 17 1 1 A 59 59 GLU C C 59 178.600 179.484 -0.884 1
1 703 . 17 1 1 A 59 59 GLU CA C 59 59.250 58.865 0.385 1
1 704 . 17 1 1 A 59 59 GLU CB C 59 28.960 29.912 -0.952 1
1 706 . 17 1 1 A 59 59 GLU N N 59 119.900 119.909 -0.009 1
1 707 . 17 1 1 A 60 60 MET H H 60 8.223 8.432 -0.209 1
1 708 . 17 1 1 A 60 60 MET HA H 60 3.966 4.280 -0.314 1
1 713 . 17 1 1 A 60 60 MET C C 60 177.900 178.547 -0.647 1
1 714 . 17 1 1 A 60 60 MET CA C 60 59.350 57.527 1.823 1
1 715 . 17 1 1 A 60 60 MET CB C 60 33.210 32.263 0.947 1
1 717 . 17 1 1 A 60 60 MET N N 60 120.100 119.059 1.041 1
1 718 . 17 1 1 A 61 61 MET H H 61 8.134 7.964 0.170 1
1 719 . 17 1 1 A 61 61 MET HA H 61 4.195 4.315 -0.120 1
1 724 . 17 1 1 A 61 61 MET C C 61 179.100 178.160 0.940 1
1 725 . 17 1 1 A 61 61 MET CA C 61 58.210 58.638 -0.428 1
1 726 . 17 1 1 A 61 61 MET CB C 61 31.340 31.975 -0.635 1
1 728 . 17 1 1 A 61 61 MET N N 61 117.000 119.878 -2.878 1
1 729 . 17 1 1 A 62 62 LYS H H 62 7.782 8.081 -0.299 1
1 730 . 17 1 1 A 62 62 LYS HA H 62 4.085 3.973 0.112 1
1 739 . 17 1 1 A 62 62 LYS C C 62 179.600 179.394 0.206 1
1 740 . 17 1 1 A 62 62 LYS CA C 62 59.610 60.098 -0.488 1
1 741 . 17 1 1 A 62 62 LYS CB C 62 32.180 32.423 -0.243 1
1 745 . 17 1 1 A 62 62 LYS N N 62 120.600 118.943 1.657 1
1 746 . 17 1 1 A 63 63 GLU H H 63 8.041 7.878 0.163 1
1 747 . 17 1 1 A 63 63 GLU HA H 63 4.057 3.956 0.101 1
1 752 . 17 1 1 A 63 63 GLU C C 63 178.900 178.938 -0.038 1
1 753 . 17 1 1 A 63 63 GLU CA C 63 59.170 59.317 -0.147 1
1 754 . 17 1 1 A 63 63 GLU CB C 63 29.000 29.297 -0.297 1
1 756 . 17 1 1 A 63 63 GLU N N 63 120.200 119.635 0.565 1
1 757 . 17 1 1 A 64 64 PHE H H 64 8.604 9.306 -0.702 1
1 758 . 17 1 1 A 64 64 PHE HA H 64 4.155 3.915 0.240 1
1 763 . 17 1 1 A 64 64 PHE C C 64 177.800 177.528 0.272 1
1 764 . 17 1 1 A 64 64 PHE CA C 64 59.820 61.414 -1.594 1
1 765 . 17 1 1 A 64 64 PHE CB C 64 38.470 38.872 -0.402 1
1 766 . 17 1 1 A 64 64 PHE N N 64 119.700 121.158 -1.458 1
1 767 . 17 1 1 A 65 65 GLN H H 65 8.177 8.617 -0.440 1
1 768 . 17 1 1 A 65 65 GLN HA H 65 3.637 3.833 -0.196 1
1 775 . 17 1 1 A 65 65 GLN C C 65 177.800 178.189 -0.389 1
1 776 . 17 1 1 A 65 65 GLN CA C 65 58.970 58.204 0.766 1
1 777 . 17 1 1 A 65 65 GLN CB C 65 28.280 28.249 0.031 1
1 779 . 17 1 1 A 65 65 GLN N N 65 118.500 118.357 0.143 1
1 781 . 17 1 1 A 66 66 GLN H H 66 7.622 8.369 -0.747 1
1 782 . 17 1 1 A 66 66 GLN HA H 66 4.040 4.243 -0.203 1
1 789 . 17 1 1 A 66 66 GLN C C 66 178.600 177.613 0.987 1
1 790 . 17 1 1 A 66 66 GLN CA C 66 59.150 58.372 0.778 1
1 791 . 17 1 1 A 66 66 GLN CB C 66 28.230 28.374 -0.144 1
1 793 . 17 1 1 A 66 66 GLN N N 66 117.400 118.229 -0.829 1
1 795 . 17 1 1 A 67 67 VAL H H 67 7.744 7.517 0.227 1
1 796 . 17 1 1 A 67 67 VAL HA H 67 3.785 3.850 -0.065 1
1 804 . 17 1 1 A 67 67 VAL C C 67 177.500 177.679 -0.179 1
1 805 . 17 1 1 A 67 67 VAL CA C 67 66.220 65.768 0.452 1
1 806 . 17 1 1 A 67 67 VAL CB C 67 31.390 31.699 -0.309 1
1 809 . 17 1 1 A 67 67 VAL N N 67 119.500 120.703 -1.203 1
1 810 . 17 1 1 A 68 68 LEU H H 68 7.983 7.768 0.215 1
1 811 . 17 1 1 A 68 68 LEU HA H 68 3.825 4.020 -0.195 1
1 821 . 17 1 1 A 68 68 LEU C C 68 179.100 177.986 1.114 1
1 822 . 17 1 1 A 68 68 LEU CA C 68 58.740 58.374 0.366 1
1 823 . 17 1 1 A 68 68 LEU CB C 68 41.090 41.520 -0.430 1
1 827 . 17 1 1 A 68 68 LEU N N 68 120.400 120.492 -0.092 1
1 828 . 17 1 1 A 69 69 ASP H H 69 8.179 7.645 0.534 1
1 829 . 17 1 1 A 69 69 ASP HA H 69 4.380 4.490 -0.110 1
1 832 . 17 1 1 A 69 69 ASP C C 69 178.900 177.955 0.945 1
1 833 . 17 1 1 A 69 69 ASP CA C 69 57.320 55.150 2.170 1
1 834 . 17 1 1 A 69 69 ASP CB C 69 40.040 40.908 -0.868 1
1 835 . 17 1 1 A 69 69 ASP N N 69 119.000 118.198 0.802 1
1 836 . 17 1 1 A 70 70 GLU H H 70 8.166 7.816 0.350 1
1 837 . 17 1 1 A 70 70 GLU HA H 70 4.082 4.128 -0.046 1
1 842 . 17 1 1 A 70 70 GLU C C 70 179.600 178.933 0.667 1
1 843 . 17 1 1 A 70 70 GLU CA C 70 59.010 58.605 0.405 1
1 844 . 17 1 1 A 70 70 GLU CB C 70 28.900 30.001 -1.101 1
1 846 . 17 1 1 A 70 70 GLU N N 70 120.500 118.777 1.723 1
1 847 . 17 1 1 A 71 71 ILE H H 71 8.415 8.171 0.244 1
1 848 . 17 1 1 A 71 71 ILE HA H 71 3.790 3.369 0.421 1
1 858 . 17 1 1 A 71 71 ILE C C 71 177.400 177.547 -0.147 1
1 859 . 17 1 1 A 71 71 ILE CA C 71 64.890 65.164 -0.274 1
1 860 . 17 1 1 A 71 71 ILE CB C 71 37.680 37.389 0.291 1
1 864 . 17 1 1 A 71 71 ILE N N 71 119.200 119.597 -0.397 1
1 865 . 17 1 1 A 72 72 LYS H H 72 8.248 7.972 0.276 1
1 866 . 17 1 1 A 72 72 LYS HA H 72 3.625 3.103 0.522 1
1 873 . 17 1 1 A 72 72 LYS C C 72 178.400 178.434 -0.034 1
1 874 . 17 1 1 A 72 72 LYS CA C 72 59.850 59.151 0.699 1
1 875 . 17 1 1 A 72 72 LYS CB C 72 32.070 31.973 0.097 1
1 879 . 17 1 1 A 72 72 LYS N N 72 120.800 120.472 0.328 1
1 880 . 17 1 1 A 73 73 GLN H H 73 7.937 7.443 0.494 1
1 881 . 17 1 1 A 73 73 GLN HA H 73 4.042 4.003 0.039 1
1 888 . 17 1 1 A 73 73 GLN C C 73 178.400 178.975 -0.575 1
1 889 . 17 1 1 A 73 73 GLN CA C 73 58.510 58.976 -0.466 1
1 890 . 17 1 1 A 73 73 GLN CB C 73 28.430 28.179 0.251 1
1 892 . 17 1 1 A 73 73 GLN N N 73 117.000 117.919 -0.919 1
1 894 . 17 1 1 A 74 74 GLN H H 74 7.712 8.124 -0.412 1
1 895 . 17 1 1 A 74 74 GLN HA H 74 4.080 3.917 0.163 1
1 902 . 17 1 1 A 74 74 GLN C C 74 177.800 178.257 -0.457 1
1 903 . 17 1 1 A 74 74 GLN CA C 74 57.270 58.401 -1.131 1
1 904 . 17 1 1 A 74 74 GLN CB C 74 28.700 27.890 0.810 1
1 906 . 17 1 1 A 74 74 GLN N N 74 118.200 118.382 -0.182 1
1 908 . 17 1 1 A 75 75 LEU H H 75 7.956 7.691 0.265 1
1 909 . 17 1 1 A 75 75 LEU HA H 75 4.212 4.421 -0.209 1
1 919 . 17 1 1 A 75 75 LEU CA C 75 56.660 56.396 0.264 1
1 920 . 17 1 1 A 75 75 LEU CB C 75 42.000 41.388 0.612 1
1 924 . 17 1 1 A 75 75 LEU N N 75 120.700 119.363 1.337 1
1 925 . 17 1 1 A 76 76 GLN H H 76 8.315 8.511 -0.196 1
1 926 . 17 1 1 A 76 76 GLN HA H 76 4.113 4.308 -0.195 1
1 933 . 17 1 1 A 76 76 GLN C C 76 177.100 176.820 0.280 1
1 934 . 17 1 1 A 76 76 GLN CA C 76 57.400 57.116 0.284 1
1 935 . 17 1 1 A 76 76 GLN CB C 76 28.640 28.458 0.182 1
1 937 . 17 1 1 A 76 76 GLN N N 76 120.100 117.942 2.158 1
1 939 . 17 1 1 A 77 77 GLY H H 77 8.021 7.729 0.292 1
1 940 . 17 1 1 A 77 77 GLY HA2 H 77 4.042 4.036 0.006 1
1 941 . 17 1 1 A 77 77 GLY HA3 H 77 3.869 4.043 -0.174 1
1 942 . 17 1 1 A 77 77 GLY C C 77 174.600 174.379 0.221 1
1 943 . 17 1 1 A 77 77 GLY CA C 77 45.430 44.775 0.655 1
1 944 . 17 1 1 A 77 77 GLY N N 77 107.700 108.784 -1.084 1
1 945 . 17 1 1 A 78 78 GLY H H 78 7.819 8.085 -0.266 1
1 946 . 17 1 1 A 78 78 GLY HA2 H 78 4.208 4.111 0.097 1
1 947 . 17 1 1 A 78 78 GLY HA3 H 78 3.801 4.123 -0.322 1
1 948 . 17 1 1 A 78 78 GLY C C 78 173.900 174.043 -0.143 1
1 949 . 17 1 1 A 78 78 GLY CA C 78 45.140 45.438 -0.298 1
1 950 . 17 1 1 A 78 78 GLY N N 78 107.100 111.557 -4.457 1
1 951 . 17 1 1 A 79 79 ASP H H 79 7.912 8.099 -0.187 1
1 952 . 17 1 1 A 79 79 ASP HA H 79 4.722 4.613 0.109 1
1 955 . 17 1 1 A 79 79 ASP C C 79 176.200 176.077 0.123 1
1 956 . 17 1 1 A 79 79 ASP CA C 79 53.210 53.551 -0.341 1
1 957 . 17 1 1 A 79 79 ASP CB C 79 40.160 39.608 0.552 1
1 958 . 17 1 1 A 79 79 ASP N N 79 119.800 119.247 0.553 1
1 959 . 17 1 1 A 80 80 ASN H H 80 8.450 8.432 0.018 1
1 960 . 17 1 1 A 80 80 ASN HA H 80 4.593 4.572 0.021 1
1 965 . 17 1 1 A 80 80 ASN C C 80 177.300 177.142 0.158 1
1 966 . 17 1 1 A 80 80 ASN CA C 80 54.680 55.306 -0.626 1
1 967 . 17 1 1 A 80 80 ASN CB C 80 38.790 38.161 0.629 1
1 968 . 17 1 1 A 80 80 ASN N N 80 121.700 122.081 -0.381 1
1 970 . 17 1 1 A 81 81 SER H H 81 8.444 7.844 0.600 1
1 971 . 17 1 1 A 81 81 SER HA H 81 4.263 4.274 -0.011 1
1 974 . 17 1 1 A 81 81 SER C C 81 176.100 177.179 -1.079 1
1 975 . 17 1 1 A 81 81 SER CA C 81 61.470 61.228 0.242 1
1 976 . 17 1 1 A 81 81 SER CB C 81 61.470 62.685 -1.215 1
1 977 . 17 1 1 A 81 81 SER N N 81 117.100 114.845 2.255 1
1 978 . 17 1 1 A 82 82 LEU H H 82 7.929 7.951 -0.022 1
1 979 . 17 1 1 A 82 82 LEU HA H 82 4.332 3.904 0.428 1
1 989 . 17 1 1 A 82 82 LEU C C 82 177.400 179.141 -1.741 1
1 990 . 17 1 1 A 82 82 LEU CA C 82 55.060 57.794 -2.734 1
1 991 . 17 1 1 A 82 82 LEU CB C 82 41.940 41.577 0.363 1
1 995 . 17 1 1 A 82 82 LEU N N 82 120.400 122.522 -2.122 1
1 996 . 17 1 1 A 83 83 HIS H H 83 8.014 7.932 0.082 1
1 997 . 17 1 1 A 83 83 HIS HA H 83 4.173 4.170 0.003 1
1 1000 . 17 1 1 A 83 83 HIS C C 83 176.100 176.502 -0.402 1
1 1001 . 17 1 1 A 83 83 HIS CA C 83 59.940 59.775 0.165 1
1 1002 . 17 1 1 A 83 83 HIS CB C 83 28.050 30.192 -2.142 1
1 1003 . 17 1 1 A 83 83 HIS N N 83 119.400 118.250 1.150 1
1 1004 . 17 1 1 A 84 84 ASN H H 84 8.598 8.032 0.566 1
1 1005 . 17 1 1 A 84 84 ASN HA H 84 4.735 4.630 0.105 1
1 1010 . 17 1 1 A 84 84 ASN C C 84 177.400 177.395 0.005 1
1 1011 . 17 1 1 A 84 84 ASN CA C 84 55.790 55.066 0.724 1
1 1012 . 17 1 1 A 84 84 ASN CB C 84 37.520 39.323 -1.803 1
1 1013 . 17 1 1 A 84 84 ASN N N 84 118.100 116.655 1.445 1
1 1015 . 17 1 1 A 85 85 VAL H H 85 7.933 7.785 0.148 1
1 1016 . 17 1 1 A 85 85 VAL HA H 85 3.849 3.796 0.053 1
1 1024 . 17 1 1 A 85 85 VAL C C 85 177.100 177.953 -0.853 1
1 1025 . 17 1 1 A 85 85 VAL CA C 85 65.490 65.562 -0.072 1
1 1026 . 17 1 1 A 85 85 VAL CB C 85 31.760 31.831 -0.071 1
1 1029 . 17 1 1 A 85 85 VAL N N 85 120.500 119.882 0.618 1
1 1030 . 17 1 1 A 86 86 HIS H H 86 8.460 9.297 -0.837 1
1 1031 . 17 1 1 A 86 86 HIS HA H 86 4.054 4.061 -0.007 1
1 1035 . 17 1 1 A 86 86 HIS C C 86 176.300 177.544 -1.244 1
1 1036 . 17 1 1 A 86 86 HIS CA C 86 59.860 59.367 0.493 1
1 1037 . 17 1 1 A 86 86 HIS CB C 86 29.670 30.001 -0.331 1
1 1038 . 17 1 1 A 86 86 HIS N N 86 119.300 119.129 0.171 1
1 1039 . 17 1 1 A 87 87 GLU H H 87 7.897 7.999 -0.102 1
1 1040 . 17 1 1 A 87 87 GLU HA H 87 3.838 3.649 0.189 1
1 1045 . 17 1 1 A 87 87 GLU C C 87 178.300 178.683 -0.383 1
1 1046 . 17 1 1 A 87 87 GLU CA C 87 58.690 58.657 0.033 1
1 1047 . 17 1 1 A 87 87 GLU CB C 87 28.460 28.986 -0.526 1
1 1049 . 17 1 1 A 87 87 GLU N N 87 117.100 118.953 -1.853 1
1 1050 . 17 1 1 A 88 88 ASN H H 88 8.103 9.014 -0.911 1
1 1051 . 17 1 1 A 88 88 ASN HA H 88 4.503 4.360 0.143 1
1 1056 . 17 1 1 A 88 88 ASN C C 88 177.700 177.945 -0.245 1
1 1057 . 17 1 1 A 88 88 ASN CA C 88 55.990 56.307 -0.317 1
1 1058 . 17 1 1 A 88 88 ASN CB C 88 39.010 38.844 0.166 1
1 1059 . 17 1 1 A 88 88 ASN N N 88 118.400 118.303 0.097 1
1 1061 . 17 1 1 A 89 89 ILE H H 89 8.501 8.221 0.280 1
1 1062 . 17 1 1 A 89 89 ILE HA H 89 3.670 3.797 -0.127 1
1 1072 . 17 1 1 A 89 89 ILE C C 89 177.000 177.858 -0.858 1
1 1073 . 17 1 1 A 89 89 ILE CA C 89 65.390 65.532 -0.142 1
1 1074 . 17 1 1 A 89 89 ILE CB C 89 37.440 37.778 -0.338 1
1 1078 . 17 1 1 A 89 89 ILE N N 89 118.700 119.194 -0.494 1
1 1079 . 17 1 1 A 90 90 LYS H H 90 8.017 8.113 -0.096 1
1 1080 . 17 1 1 A 90 90 LYS HA H 90 3.775 3.973 -0.198 1
1 1089 . 17 1 1 A 90 90 LYS C C 90 178.800 178.977 -0.177 1
1 1090 . 17 1 1 A 90 90 LYS CA C 90 60.450 59.943 0.507 1
1 1091 . 17 1 1 A 90 90 LYS CB C 90 32.110 32.403 -0.293 1
1 1095 . 17 1 1 A 90 90 LYS N N 90 120.900 120.342 0.558 1
1 1096 . 17 1 1 A 91 91 GLU H H 91 7.732 7.883 -0.151 1
1 1097 . 17 1 1 A 91 91 GLU HA H 91 4.083 4.143 -0.060 1
1 1102 . 17 1 1 A 91 91 GLU C C 91 179.100 179.186 -0.086 1
1 1103 . 17 1 1 A 91 91 GLU CA C 91 59.120 58.970 0.150 1
1 1104 . 17 1 1 A 91 91 GLU CB C 91 28.810 29.979 -1.169 1
1 1106 . 17 1 1 A 91 91 GLU N N 91 119.300 118.033 1.267 1
1 1107 . 17 1 1 A 92 92 ILE H H 92 8.110 9.068 -0.958 1
1 1108 . 17 1 1 A 92 92 ILE HA H 92 3.685 3.606 0.079 1
1 1118 . 17 1 1 A 92 92 ILE C C 92 178.000 178.207 -0.207 1
1 1119 . 17 1 1 A 92 92 ILE CA C 92 65.900 65.529 0.371 1
1 1120 . 17 1 1 A 92 92 ILE CB C 92 38.400 38.079 0.321 1
1 1124 . 17 1 1 A 92 92 ILE N N 92 121.100 121.038 0.062 1
1 1125 . 17 1 1 A 93 93 PHE H H 93 8.651 9.149 -0.498 1
1 1126 . 17 1 1 A 93 93 PHE HA H 93 3.873 3.066 0.807 1
1 1133 . 17 1 1 A 93 93 PHE C C 93 177.100 177.577 -0.477 1
1 1134 . 17 1 1 A 93 93 PHE CA C 93 61.020 61.073 -0.053 1
1 1135 . 17 1 1 A 93 93 PHE CB C 93 38.560 38.315 0.245 1
1 1138 . 17 1 1 A 93 93 PHE N N 93 119.400 121.266 -1.866 1
1 1139 . 17 1 1 A 94 94 HIS H H 94 8.126 7.850 0.276 1
1 1140 . 17 1 1 A 94 94 HIS HA H 94 4.368 3.984 0.384 1
1 1145 . 17 1 1 A 94 94 HIS C C 94 177.100 176.447 0.653 1
1 1146 . 17 1 1 A 94 94 HIS CA C 94 58.310 58.090 0.220 1
1 1147 . 17 1 1 A 94 94 HIS CB C 94 27.910 28.786 -0.876 1
1 1148 . 17 1 1 A 94 94 HIS N N 94 116.400 115.591 0.809 1
1 1149 . 17 1 1 A 95 95 HIS H H 95 8.058 8.069 -0.011 1
1 1150 . 17 1 1 A 95 95 HIS HA H 95 4.465 4.247 0.218 1
1 1154 . 17 1 1 A 95 95 HIS C C 95 177.300 177.680 -0.380 1
1 1155 . 17 1 1 A 95 95 HIS CA C 95 57.900 58.877 -0.977 1
1 1156 . 17 1 1 A 95 95 HIS CB C 95 28.490 30.517 -2.027 1
1 1157 . 17 1 1 A 95 95 HIS N N 95 117.000 117.857 -0.857 1
1 1158 . 17 1 1 A 96 96 LEU H H 96 8.525 8.038 0.487 1
1 1159 . 17 1 1 A 96 96 LEU HA H 96 3.865 3.821 0.044 1
1 1169 . 17 1 1 A 96 96 LEU C C 96 178.300 178.383 -0.083 1
1 1170 . 17 1 1 A 96 96 LEU CA C 96 58.250 57.904 0.346 1
1 1171 . 17 1 1 A 96 96 LEU CB C 96 41.720 41.859 -0.139 1
1 1175 . 17 1 1 A 96 96 LEU N N 96 121.300 120.865 0.435 1
1 1176 . 17 1 1 A 97 97 GLU H H 97 8.076 7.631 0.445 1
1 1177 . 17 1 1 A 97 97 GLU HA H 97 3.719 4.006 -0.287 1
1 1182 . 17 1 1 A 97 97 GLU C C 97 178.300 178.625 -0.325 1
1 1183 . 17 1 1 A 97 97 GLU CA C 97 59.300 58.527 0.773 1
1 1184 . 17 1 1 A 97 97 GLU CB C 97 28.960 29.555 -0.595 1
1 1186 . 17 1 1 A 97 97 GLU N N 97 117.100 118.623 -1.523 1
1 1187 . 17 1 1 A 98 98 GLU H H 98 7.329 7.636 -0.307 1
1 1188 . 17 1 1 A 98 98 GLU HA H 98 4.024 4.122 -0.098 1
1 1193 . 17 1 1 A 98 98 GLU C C 98 177.900 179.056 -1.156 1
1 1194 . 17 1 1 A 98 98 GLU CA C 98 58.190 58.461 -0.271 1
1 1195 . 17 1 1 A 98 98 GLU CB C 98 29.120 29.607 -0.487 1
1 1197 . 17 1 1 A 98 98 GLU N N 98 116.000 119.182 -3.182 1
1 1198 . 17 1 1 A 99 99 LEU H H 99 7.535 7.927 -0.392 1
1 1199 . 17 1 1 A 99 99 LEU HA H 99 4.183 4.118 0.065 1
1 1209 . 17 1 1 A 99 99 LEU C C 99 178.100 177.343 0.757 1
1 1210 . 17 1 1 A 99 99 LEU CA C 99 56.440 56.368 0.072 1
1 1211 . 17 1 1 A 99 99 LEU CB C 99 43.010 41.193 1.817 1
1 1215 . 17 1 1 A 99 99 LEU N N 99 118.200 119.434 -1.234 1
1 1216 . 17 1 1 A 100 100 VAL H H 100 7.561 7.310 0.251 1
1 1217 . 17 1 1 A 100 100 VAL HA H 100 4.033 4.629 -0.596 1
1 1225 . 17 1 1 A 100 100 VAL C C 100 175.400 177.831 -2.431 1
1 1226 . 17 1 1 A 100 100 VAL CA C 100 62.430 61.812 0.618 1
1 1227 . 17 1 1 A 100 100 VAL CB C 100 32.050 33.712 -1.662 1
1 1230 . 17 1 1 A 100 100 VAL N N 100 114.800 111.895 2.905 1
1 1231 . 17 1 1 A 101 101 HIS H H 101 7.827 7.733 0.094 1
1 1232 . 17 1 1 A 101 101 HIS HA H 101 4.630 4.239 0.391 1
1 1237 . 17 1 1 A 101 101 HIS C C 101 173.500 175.617 -2.117 1
1 1238 . 17 1 1 A 101 101 HIS CA C 101 55.410 58.571 -3.161 1
1 1239 . 17 1 1 A 101 101 HIS CB C 101 28.870 29.913 -1.043 1
1 1240 . 17 1 1 A 101 101 HIS N N 101 120.300 123.014 -2.714 1
1 10 . 18 1 1 A 2 2 TYR H H 2 8.688 7.366 1.322 1
1 11 . 18 1 1 A 2 2 TYR HA H 2 4.737 4.180 0.557 1
1 16 . 18 1 1 A 2 2 TYR C C 2 175.900 176.261 -0.361 1
1 17 . 18 1 1 A 2 2 TYR CA C 2 57.920 60.579 -2.659 1
1 18 . 18 1 1 A 2 2 TYR CB C 2 38.340 38.676 -0.336 1
1 19 . 18 1 1 A 2 2 TYR N N 2 122.100 125.976 -3.876 1
1 20 . 18 1 1 A 3 3 GLY H H 3 8.434 8.273 0.161 1
1 21 . 18 1 1 A 3 3 GLY HA2 H 3 3.909 4.082 -0.173 1
1 22 . 18 1 1 A 3 3 GLY HA3 H 3 3.841 4.108 -0.267 1
1 23 . 18 1 1 A 3 3 GLY C C 3 174.300 175.890 -1.590 1
1 24 . 18 1 1 A 3 3 GLY CA C 3 46.050 45.326 0.724 1
1 25 . 18 1 1 A 3 3 GLY N N 3 111.100 108.365 2.735 1
1 26 . 18 1 1 A 4 4 LYS H H 4 8.060 8.453 -0.393 1
1 27 . 18 1 1 A 4 4 LYS HA H 4 4.297 4.151 0.146 1
1 36 . 18 1 1 A 4 4 LYS C C 4 178.000 178.875 -0.875 1
1 37 . 18 1 1 A 4 4 LYS CA C 4 56.930 59.362 -2.432 1
1 38 . 18 1 1 A 4 4 LYS CB C 4 32.680 31.907 0.773 1
1 42 . 18 1 1 A 4 4 LYS N N 4 119.500 121.566 -2.066 1
1 43 . 18 1 1 A 5 5 LEU H H 5 8.243 8.181 0.062 1
1 44 . 18 1 1 A 5 5 LEU HA H 5 3.947 3.925 0.022 1
1 54 . 18 1 1 A 5 5 LEU C C 5 177.900 178.700 -0.800 1
1 55 . 18 1 1 A 5 5 LEU CA C 5 57.930 57.882 0.048 1
1 56 . 18 1 1 A 5 5 LEU CB C 5 41.620 41.709 -0.089 1
1 60 . 18 1 1 A 5 5 LEU N N 5 120.800 120.601 0.199 1
1 61 . 18 1 1 A 6 6 ASN H H 6 8.256 8.542 -0.286 1
1 62 . 18 1 1 A 6 6 ASN HA H 6 4.252 4.391 -0.139 1
1 67 . 18 1 1 A 6 6 ASN C C 6 177.300 177.753 -0.453 1
1 68 . 18 1 1 A 6 6 ASN CA C 6 56.900 56.601 0.299 1
1 69 . 18 1 1 A 6 6 ASN CB C 6 38.200 37.832 0.368 1
1 70 . 18 1 1 A 6 6 ASN N N 6 116.200 115.375 0.825 1
1 72 . 18 1 1 A 7 7 ASP H H 7 7.699 9.063 -1.364 1
1 73 . 18 1 1 A 7 7 ASP HA H 7 4.320 4.412 -0.092 1
1 76 . 18 1 1 A 7 7 ASP C C 7 178.000 178.619 -0.619 1
1 77 . 18 1 1 A 7 7 ASP CA C 7 56.980 57.503 -0.523 1
1 78 . 18 1 1 A 7 7 ASP CB C 7 39.870 41.281 -1.411 1
1 79 . 18 1 1 A 7 7 ASP N N 7 119.100 119.325 -0.225 1
1 80 . 18 1 1 A 8 8 LEU H H 8 7.580 8.680 -1.100 1
1 81 . 18 1 1 A 8 8 LEU HA H 8 4.091 4.161 -0.070 1
1 91 . 18 1 1 A 8 8 LEU C C 8 178.800 178.990 -0.190 1
1 92 . 18 1 1 A 8 8 LEU CA C 8 57.790 57.779 0.011 1
1 93 . 18 1 1 A 8 8 LEU CB C 8 41.880 41.732 0.148 1
1 97 . 18 1 1 A 8 8 LEU N N 8 120.400 119.739 0.661 1
1 98 . 18 1 1 A 9 9 LEU H H 9 8.125 9.164 -1.039 1
1 99 . 18 1 1 A 9 9 LEU HA H 9 3.891 4.016 -0.125 1
1 109 . 18 1 1 A 9 9 LEU C C 9 178.900 178.552 0.348 1
1 110 . 18 1 1 A 9 9 LEU CA C 9 58.350 58.620 -0.270 1
1 111 . 18 1 1 A 9 9 LEU CB C 9 41.510 42.020 -0.510 1
1 115 . 18 1 1 A 9 9 LEU N N 9 118.900 120.206 -1.306 1
1 116 . 18 1 1 A 10 10 GLU H H 10 8.011 8.935 -0.924 1
1 117 . 18 1 1 A 10 10 GLU HA H 10 4.072 4.004 0.068 1
1 122 . 18 1 1 A 10 10 GLU C C 10 179.000 178.688 0.312 1
1 123 . 18 1 1 A 10 10 GLU CA C 10 59.090 59.852 -0.762 1
1 124 . 18 1 1 A 10 10 GLU CB C 10 27.910 29.234 -1.324 1
1 126 . 18 1 1 A 10 10 GLU N N 10 119.300 118.805 0.495 1
1 127 . 18 1 1 A 11 11 ASP H H 11 8.128 8.065 0.063 1
1 128 . 18 1 1 A 11 11 ASP HA H 11 4.383 4.356 0.027 1
1 131 . 18 1 1 A 11 11 ASP C C 11 178.500 178.941 -0.441 1
1 132 . 18 1 1 A 11 11 ASP CA C 11 56.580 57.082 -0.502 1
1 133 . 18 1 1 A 11 11 ASP CB C 11 38.600 40.698 -2.098 1
1 134 . 18 1 1 A 11 11 ASP N N 11 119.600 119.778 -0.178 1
1 135 . 18 1 1 A 12 12 LEU H H 12 8.394 7.894 0.500 1
1 136 . 18 1 1 A 12 12 LEU HA H 12 3.923 4.276 -0.353 1
1 146 . 18 1 1 A 12 12 LEU C C 12 178.200 178.609 -0.409 1
1 147 . 18 1 1 A 12 12 LEU CA C 12 57.880 57.365 0.515 1
1 148 . 18 1 1 A 12 12 LEU CB C 12 41.850 41.936 -0.086 1
1 152 . 18 1 1 A 12 12 LEU N N 12 120.500 121.014 -0.514 1
1 153 . 18 1 1 A 13 13 GLN H H 13 8.371 8.806 -0.435 1
1 154 . 18 1 1 A 13 13 GLN HA H 13 3.879 4.091 -0.212 1
1 161 . 18 1 1 A 13 13 GLN C C 13 178.600 178.267 0.333 1
1 162 . 18 1 1 A 13 13 GLN CA C 13 59.570 58.353 1.217 1
1 163 . 18 1 1 A 13 13 GLN CB C 13 28.440 27.744 0.696 1
1 165 . 18 1 1 A 13 13 GLN N N 13 118.400 117.071 1.329 1
1 167 . 18 1 1 A 14 14 GLU H H 14 7.913 8.225 -0.312 1
1 168 . 18 1 1 A 14 14 GLU HA H 14 4.021 4.093 -0.072 1
1 173 . 18 1 1 A 14 14 GLU C C 14 179.000 178.986 0.014 1
1 174 . 18 1 1 A 14 14 GLU CA C 14 59.030 59.223 -0.193 1
1 175 . 18 1 1 A 14 14 GLU CB C 14 28.720 29.473 -0.753 1
1 177 . 18 1 1 A 14 14 GLU N N 14 119.100 119.911 -0.811 1
1 178 . 18 1 1 A 15 15 VAL H H 15 7.991 7.613 0.378 1
1 179 . 18 1 1 A 15 15 VAL HA H 15 3.696 3.877 -0.181 1
1 187 . 18 1 1 A 15 15 VAL C C 15 178.300 177.934 0.366 1
1 188 . 18 1 1 A 15 15 VAL CA C 15 66.640 65.639 1.001 1
1 189 . 18 1 1 A 15 15 VAL CB C 15 31.470 31.753 -0.283 1
1 192 . 18 1 1 A 15 15 VAL N N 15 120.300 117.722 2.578 1
1 193 . 18 1 1 A 16 16 LEU H H 16 8.172 7.967 0.205 1
1 194 . 18 1 1 A 16 16 LEU HA H 16 3.876 4.134 -0.258 1
1 204 . 18 1 1 A 16 16 LEU C C 16 178.400 178.707 -0.307 1
1 205 . 18 1 1 A 16 16 LEU CA C 16 58.050 58.140 -0.090 1
1 206 . 18 1 1 A 16 16 LEU CB C 16 41.420 41.386 0.034 1
1 210 . 18 1 1 A 16 16 LEU N N 16 119.700 125.339 -5.639 1
1 211 . 18 1 1 A 17 17 LYS H H 17 7.755 9.062 -1.307 1
1 212 . 18 1 1 A 17 17 LYS HA H 17 3.951 4.120 -0.169 1
1 221 . 18 1 1 A 17 17 LYS C C 17 178.800 178.990 -0.190 1
1 222 . 18 1 1 A 17 17 LYS CA C 17 59.470 58.928 0.542 1
1 223 . 18 1 1 A 17 17 LYS CB C 17 32.350 32.578 -0.228 1
1 227 . 18 1 1 A 17 17 LYS N N 17 117.800 120.169 -2.369 1
1 228 . 18 1 1 A 18 18 HIS H H 18 7.847 8.620 -0.773 1
1 229 . 18 1 1 A 18 18 HIS HA H 18 4.549 4.428 0.121 1
1 233 . 18 1 1 A 18 18 HIS C C 18 177.200 175.978 1.222 1
1 234 . 18 1 1 A 18 18 HIS CA C 18 57.870 57.694 0.176 1
1 235 . 18 1 1 A 18 18 HIS CB C 18 28.730 29.913 -1.183 1
1 236 . 18 1 1 A 18 18 HIS N N 18 116.200 119.553 -3.353 1
1 237 . 18 1 1 A 19 19 VAL H H 19 8.415 7.885 0.530 1
1 238 . 18 1 1 A 19 19 VAL HA H 19 3.746 4.176 -0.430 1
1 246 . 18 1 1 A 19 19 VAL CA C 19 65.850 63.035 2.815 1
1 247 . 18 1 1 A 19 19 VAL CB C 19 31.600 32.949 -1.349 1
1 250 . 18 1 1 A 20 20 ASN H H 20 8.041 7.979 0.062 1
1 251 . 18 1 1 A 20 20 ASN HA H 20 4.545 4.666 -0.121 1
1 256 . 18 1 1 A 20 20 ASN C C 20 176.900 176.782 0.118 1
1 257 . 18 1 1 A 20 20 ASN CA C 20 55.070 56.144 -1.074 1
1 258 . 18 1 1 A 20 20 ASN CB C 20 38.270 38.204 0.066 1
1 259 . 18 1 1 A 20 20 ASN N N 20 117.900 120.030 -2.130 1
1 261 . 18 1 1 A 21 21 GLN H H 21 7.887 8.040 -0.153 1
1 262 . 18 1 1 A 21 21 GLN HA H 21 4.096 4.165 -0.069 1
1 269 . 18 1 1 A 21 21 GLN C C 21 176.900 176.960 -0.060 1
1 270 . 18 1 1 A 21 21 GLN CA C 21 57.510 57.733 -0.223 1
1 271 . 18 1 1 A 21 21 GLN CB C 21 29.100 28.886 0.214 1
1 273 . 18 1 1 A 21 21 GLN N N 21 117.900 118.192 -0.292 1
1 275 . 18 1 1 A 22 22 HIS H H 22 7.887 8.231 -0.344 1
1 276 . 18 1 1 A 22 22 HIS HA H 22 4.679 4.861 -0.182 1
1 280 . 18 1 1 A 22 22 HIS C C 22 174.300 175.131 -0.831 1
1 281 . 18 1 1 A 22 22 HIS CA C 22 55.770 55.139 0.631 1
1 282 . 18 1 1 A 22 22 HIS CB C 22 28.630 29.048 -0.418 1
1 283 . 18 1 1 A 22 22 HIS N N 22 116.100 115.266 0.834 1
1 284 . 18 1 1 A 23 23 TRP H H 23 7.929 7.849 0.080 1
1 285 . 18 1 1 A 23 23 TRP HA H 23 4.542 4.828 -0.286 1
1 292 . 18 1 1 A 23 23 TRP C C 23 176.600 175.393 1.207 1
1 293 . 18 1 1 A 23 23 TRP CA C 23 58.020 57.705 0.315 1
1 294 . 18 1 1 A 23 23 TRP CB C 23 29.700 30.857 -1.157 1
1 295 . 18 1 1 A 23 23 TRP N N 23 122.000 123.999 -1.999 1
1 297 . 18 1 1 A 24 24 GLN H H 24 8.258 8.180 0.078 1
1 298 . 18 1 1 A 24 24 GLN HA H 24 4.329 4.991 -0.662 1
1 305 . 18 1 1 A 24 24 GLN C C 24 176.200 175.880 0.320 1
1 306 . 18 1 1 A 24 24 GLN CA C 24 55.960 55.020 0.940 1
1 307 . 18 1 1 A 24 24 GLN CB C 24 29.440 32.136 -2.696 1
1 309 . 18 1 1 A 24 24 GLN N N 24 123.800 126.227 -2.427 1
1 311 . 18 1 1 A 25 25 GLY H H 25 7.470 8.765 -1.295 1
1 312 . 18 1 1 A 25 25 GLY HA2 H 25 3.939 4.034 -0.095 1
1 313 . 18 1 1 A 25 25 GLY HA3 H 25 3.800 4.043 -0.243 1
1 314 . 18 1 1 A 25 25 GLY C C 25 174.800 175.419 -0.619 1
1 315 . 18 1 1 A 25 25 GLY CA C 25 45.470 45.864 -0.394 1
1 316 . 18 1 1 A 25 25 GLY N N 25 108.100 111.957 -3.857 1
1 317 . 18 1 1 A 26 26 GLY H H 26 8.332 8.673 -0.341 1
1 318 . 18 1 1 A 26 26 GLY HA2 H 26 4.105 4.136 -0.031 1
1 319 . 18 1 1 A 26 26 GLY HA3 H 26 3.974 4.166 -0.192 1
1 320 . 18 1 1 A 26 26 GLY C C 26 174.900 175.124 -0.224 1
1 321 . 18 1 1 A 26 26 GLY CA C 26 45.410 45.730 -0.320 1
1 322 . 18 1 1 A 26 26 GLY N N 26 108.700 107.074 1.626 1
1 323 . 18 1 1 A 27 27 GLN H H 27 8.474 8.472 0.002 1
1 324 . 18 1 1 A 27 27 GLN HA H 27 4.106 4.153 -0.047 1
1 331 . 18 1 1 A 27 27 GLN C C 27 177.100 176.168 0.932 1
1 332 . 18 1 1 A 27 27 GLN CA C 27 57.540 56.590 0.950 1
1 333 . 18 1 1 A 27 27 GLN CB C 27 29.050 28.374 0.676 1
1 335 . 18 1 1 A 27 27 GLN N N 27 121.100 122.361 -1.261 1
1 337 . 18 1 1 A 28 28 LYS H H 28 8.448 8.063 0.385 1
1 338 . 18 1 1 A 28 28 LYS HA H 28 4.068 4.191 -0.123 1
1 347 . 18 1 1 A 28 28 LYS C C 28 177.900 178.052 -0.152 1
1 348 . 18 1 1 A 28 28 LYS CA C 28 58.410 57.968 0.442 1
1 349 . 18 1 1 A 28 28 LYS CB C 28 32.210 33.138 -0.928 1
1 353 . 18 1 1 A 28 28 LYS N N 28 120.500 118.388 2.112 1
1 354 . 18 1 1 A 29 29 ASN H H 29 8.273 7.653 0.620 1
1 355 . 18 1 1 A 29 29 ASN HA H 29 4.584 4.396 0.188 1
1 360 . 18 1 1 A 29 29 ASN C C 29 176.200 177.264 -1.064 1
1 361 . 18 1 1 A 29 29 ASN CA C 29 54.400 56.070 -1.670 1
1 362 . 18 1 1 A 29 29 ASN CB C 29 38.280 38.268 0.012 1
1 363 . 18 1 1 A 29 29 ASN N N 29 117.500 118.020 -0.520 1
1 365 . 18 1 1 A 30 30 MET H H 30 7.870 7.553 0.317 1
1 366 . 18 1 1 A 30 30 MET HA H 30 4.085 3.185 0.900 1
1 371 . 18 1 1 A 30 30 MET C C 30 177.000 177.919 -0.919 1
1 372 . 18 1 1 A 30 30 MET CA C 30 56.880 57.938 -1.058 1
1 373 . 18 1 1 A 30 30 MET CB C 30 32.340 31.573 0.767 1
1 375 . 18 1 1 A 30 30 MET N N 30 121.100 118.843 2.257 1
1 376 . 18 1 1 A 31 31 ASN H H 31 8.186 7.506 0.680 1
1 377 . 18 1 1 A 31 31 ASN HA H 31 4.311 4.451 -0.140 1
1 382 . 18 1 1 A 31 31 ASN C C 31 176.700 177.234 -0.534 1
1 383 . 18 1 1 A 31 31 ASN CA C 31 55.320 55.411 -0.091 1
1 384 . 18 1 1 A 31 31 ASN CB C 31 38.410 38.594 -0.184 1
1 385 . 18 1 1 A 31 31 ASN N N 31 117.900 116.369 1.531 1
1 387 . 18 1 1 A 32 32 LYS H H 32 7.792 7.075 0.717 1
1 388 . 18 1 1 A 32 32 LYS HA H 32 3.992 3.844 0.148 1
1 397 . 18 1 1 A 32 32 LYS C C 32 177.900 179.253 -1.353 1
1 398 . 18 1 1 A 32 32 LYS CA C 32 59.050 59.347 -0.297 1
1 399 . 18 1 1 A 32 32 LYS CB C 32 32.460 32.423 0.037 1
1 403 . 18 1 1 A 32 32 LYS N N 32 120.400 118.718 1.682 1
1 404 . 18 1 1 A 33 33 VAL H H 33 7.689 8.553 -0.864 1
1 405 . 18 1 1 A 33 33 VAL HA H 33 3.791 3.779 0.012 1
1 413 . 18 1 1 A 33 33 VAL C C 33 177.100 177.614 -0.514 1
1 414 . 18 1 1 A 33 33 VAL CA C 33 65.360 65.033 0.327 1
1 415 . 18 1 1 A 33 33 VAL CB C 33 31.920 31.412 0.508 1
1 418 . 18 1 1 A 33 33 VAL N N 33 120.200 115.730 4.470 1
1 419 . 18 1 1 A 34 34 ASP H H 34 8.408 7.942 0.466 1
1 420 . 18 1 1 A 34 34 ASP HA H 34 4.303 4.277 0.026 1
1 423 . 18 1 1 A 34 34 ASP C C 34 178.200 178.532 -0.332 1
1 424 . 18 1 1 A 34 34 ASP CA C 34 55.880 57.090 -1.210 1
1 425 . 18 1 1 A 34 34 ASP CB C 34 38.710 41.485 -2.775 1
1 426 . 18 1 1 A 34 34 ASP N N 34 120.100 121.222 -1.122 1
1 427 . 18 1 1 A 35 35 HIS H H 35 8.204 6.803 1.401 1
1 428 . 18 1 1 A 35 35 HIS HA H 35 4.343 4.168 0.175 1
1 431 . 18 1 1 A 35 35 HIS C C 35 176.800 177.640 -0.840 1
1 432 . 18 1 1 A 35 35 HIS CA C 35 58.310 60.290 -1.980 1
1 433 . 18 1 1 A 35 35 HIS CB C 35 28.070 30.167 -2.097 1
1 434 . 18 1 1 A 35 35 HIS N N 35 118.200 117.734 0.466 1
1 435 . 18 1 1 A 36 36 HIS H H 36 8.067 8.063 0.004 1
1 436 . 18 1 1 A 36 36 HIS HA H 36 4.602 4.099 0.503 1
1 440 . 18 1 1 A 36 36 HIS C C 36 177.100 177.647 -0.547 1
1 441 . 18 1 1 A 36 36 HIS CA C 36 58.520 59.420 -0.900 1
1 442 . 18 1 1 A 36 36 HIS CB C 36 28.720 29.919 -1.199 1
1 443 . 18 1 1 A 36 36 HIS N N 36 117.100 117.338 -0.238 1
1 444 . 18 1 1 A 37 37 LEU H H 37 8.473 8.405 0.068 1
1 445 . 18 1 1 A 37 37 LEU HA H 37 3.894 3.621 0.273 1
1 455 . 18 1 1 A 37 37 LEU C C 37 178.200 178.840 -0.640 1
1 456 . 18 1 1 A 37 37 LEU CA C 37 58.520 58.090 0.430 1
1 457 . 18 1 1 A 37 37 LEU CB C 37 41.810 41.578 0.232 1
1 461 . 18 1 1 A 37 37 LEU N N 37 119.600 119.621 -0.021 1
1 462 . 18 1 1 A 38 38 GLN H H 38 8.337 8.278 0.059 1
1 463 . 18 1 1 A 38 38 GLN HA H 38 3.882 3.991 -0.109 1
1 470 . 18 1 1 A 38 38 GLN C C 38 178.500 178.272 0.228 1
1 471 . 18 1 1 A 38 38 GLN CA C 38 59.200 59.403 -0.203 1
1 472 . 18 1 1 A 38 38 GLN CB C 38 27.850 28.277 -0.427 1
1 474 . 18 1 1 A 38 38 GLN N N 38 118.000 116.816 1.184 1
1 476 . 18 1 1 A 39 39 ASN H H 39 7.923 7.517 0.406 1
1 477 . 18 1 1 A 39 39 ASN HA H 39 4.390 4.503 -0.113 1
1 482 . 18 1 1 A 39 39 ASN C C 39 177.500 177.659 -0.159 1
1 483 . 18 1 1 A 39 39 ASN CA C 39 55.780 56.079 -0.299 1
1 484 . 18 1 1 A 39 39 ASN CB C 39 37.450 38.178 -0.728 1
1 485 . 18 1 1 A 39 39 ASN N N 39 118.700 117.849 0.851 1
1 487 . 18 1 1 A 40 40 VAL H H 40 7.907 8.529 -0.622 1
1 488 . 18 1 1 A 40 40 VAL HA H 40 3.629 3.573 0.056 1
1 496 . 18 1 1 A 40 40 VAL C C 40 177.500 178.018 -0.518 1
1 497 . 18 1 1 A 40 40 VAL CA C 40 67.080 66.102 0.978 1
1 498 . 18 1 1 A 40 40 VAL CB C 40 31.390 31.491 -0.101 1
1 501 . 18 1 1 A 40 40 VAL N N 40 120.400 120.193 0.207 1
1 502 . 18 1 1 A 41 41 ILE H H 41 8.103 8.066 0.037 1
1 503 . 18 1 1 A 41 41 ILE HA H 41 3.401 3.609 -0.208 1
1 513 . 18 1 1 A 41 41 ILE C C 41 178.000 178.558 -0.558 1
1 514 . 18 1 1 A 41 41 ILE CA C 41 66.430 65.356 1.074 1
1 515 . 18 1 1 A 41 41 ILE CB C 41 38.050 37.640 0.410 1
1 519 . 18 1 1 A 41 41 ILE N N 41 120.600 119.464 1.136 1
1 520 . 18 1 1 A 42 42 GLU H H 42 8.150 7.939 0.211 1
1 521 . 18 1 1 A 42 42 GLU HA H 42 4.062 4.016 0.046 1
1 526 . 18 1 1 A 42 42 GLU C C 42 178.500 178.955 -0.455 1
1 527 . 18 1 1 A 42 42 GLU CA C 42 59.120 59.423 -0.303 1
1 528 . 18 1 1 A 42 42 GLU CB C 42 28.160 29.273 -1.113 1
1 530 . 18 1 1 A 42 42 GLU N N 42 119.900 121.282 -1.382 1
1 531 . 18 1 1 A 43 43 ASP H H 43 8.453 9.163 -0.710 1
1 532 . 18 1 1 A 43 43 ASP HA H 43 4.445 4.416 0.029 1
1 535 . 18 1 1 A 43 43 ASP C C 43 178.400 178.518 -0.118 1
1 536 . 18 1 1 A 43 43 ASP CA C 43 56.490 58.221 -1.731 1
1 537 . 18 1 1 A 43 43 ASP CB C 43 37.820 41.746 -3.926 1
1 538 . 18 1 1 A 43 43 ASP N N 43 119.700 119.675 0.025 1
1 539 . 18 1 1 A 44 44 ILE H H 44 8.544 7.792 0.752 1
1 540 . 18 1 1 A 44 44 ILE HA H 44 3.590 3.694 -0.104 1
1 550 . 18 1 1 A 44 44 ILE C C 44 177.800 178.033 -0.233 1
1 551 . 18 1 1 A 44 44 ILE CA C 44 66.320 65.263 1.057 1
1 552 . 18 1 1 A 44 44 ILE CB C 44 37.690 37.936 -0.246 1
1 556 . 18 1 1 A 44 44 ILE N N 44 121.500 119.694 1.806 1
1 557 . 18 1 1 A 45 45 HIS H H 45 8.261 8.436 -0.175 1
1 558 . 18 1 1 A 45 45 HIS HA H 45 4.255 4.252 0.003 1
1 562 . 18 1 1 A 45 45 HIS C C 45 177.200 177.567 -0.367 1
1 563 . 18 1 1 A 45 45 HIS CA C 45 59.580 59.911 -0.331 1
1 564 . 18 1 1 A 45 45 HIS CB C 45 27.790 30.283 -2.493 1
1 565 . 18 1 1 A 45 45 HIS N N 45 118.800 119.626 -0.826 1
1 566 . 18 1 1 A 46 46 ASP H H 46 8.680 7.989 0.691 1
1 567 . 18 1 1 A 46 46 ASP HA H 46 4.338 4.541 -0.203 1
1 570 . 18 1 1 A 46 46 ASP C C 46 178.700 177.807 0.893 1
1 571 . 18 1 1 A 46 46 ASP CA C 46 57.010 56.107 0.903 1
1 572 . 18 1 1 A 46 46 ASP CB C 46 39.400 40.938 -1.538 1
1 573 . 18 1 1 A 46 46 ASP N N 46 119.200 118.483 0.717 1
1 574 . 18 1 1 A 47 47 PHE H H 47 8.380 9.304 -0.924 1
1 575 . 18 1 1 A 47 47 PHE HA H 47 4.070 4.225 -0.155 1
1 580 . 18 1 1 A 47 47 PHE C C 47 178.600 177.840 0.760 1
1 581 . 18 1 1 A 47 47 PHE CA C 47 61.250 59.929 1.321 1
1 582 . 18 1 1 A 47 47 PHE CB C 47 39.570 39.985 -0.415 1
1 583 . 18 1 1 A 47 47 PHE N N 47 121.800 120.682 1.118 1
1 584 . 18 1 1 A 48 48 MET H H 48 8.366 7.968 0.398 1
1 585 . 18 1 1 A 48 48 MET HA H 48 3.998 4.757 -0.759 1
1 590 . 18 1 1 A 48 48 MET C C 48 177.400 177.443 -0.043 1
1 591 . 18 1 1 A 48 48 MET CA C 48 58.470 57.895 0.575 1
1 592 . 18 1 1 A 48 48 MET CB C 48 33.170 32.806 0.364 1
1 594 . 18 1 1 A 48 48 MET N N 48 117.700 117.885 -0.185 1
1 595 . 18 1 1 A 49 49 GLN H H 49 7.659 8.335 -0.676 1
1 596 . 18 1 1 A 49 49 GLN HA H 49 4.258 4.339 -0.081 1
1 603 . 18 1 1 A 49 49 GLN C C 49 176.700 178.050 -1.350 1
1 604 . 18 1 1 A 49 49 GLN CA C 49 56.380 57.174 -0.794 1
1 605 . 18 1 1 A 49 49 GLN CB C 49 28.980 29.694 -0.714 1
1 607 . 18 1 1 A 49 49 GLN N N 49 116.700 116.704 -0.004 1
1 609 . 18 1 1 A 50 50 GLY H H 50 7.685 8.519 -0.834 1
1 610 . 18 1 1 A 50 50 GLY HA2 H 50 3.998 3.843 0.155 1
1 611 . 18 1 1 A 50 50 GLY HA3 H 50 3.998 3.893 0.105 1
1 612 . 18 1 1 A 50 50 GLY C C 50 174.900 175.192 -0.292 1
1 613 . 18 1 1 A 50 50 GLY CA C 50 45.460 45.589 -0.129 1
1 614 . 18 1 1 A 50 50 GLY N N 50 106.400 108.558 -2.158 1
1 615 . 18 1 1 A 51 51 GLY H H 51 8.031 9.151 -1.120 1
1 616 . 18 1 1 A 51 51 GLY HA2 H 51 3.817 3.899 -0.082 1
1 617 . 18 1 1 A 51 51 GLY HA3 H 51 3.817 3.921 -0.104 1
1 618 . 18 1 1 A 51 51 GLY C C 51 174.500 174.416 0.084 1
1 619 . 18 1 1 A 51 51 GLY CA C 51 45.190 45.658 -0.468 1
1 620 . 18 1 1 A 51 51 GLY N N 51 108.900 109.030 -0.130 1
1 621 . 18 1 1 A 52 52 GLY H H 52 8.126 8.850 -0.724 1
1 622 . 18 1 1 A 52 52 GLY HA2 H 52 3.362 3.581 -0.219 1
1 623 . 18 1 1 A 52 52 GLY HA3 H 52 3.362 4.000 -0.638 1
1 624 . 18 1 1 A 52 52 GLY C C 52 173.300 174.307 -1.007 1
1 625 . 18 1 1 A 52 52 GLY CA C 52 45.120 45.127 -0.007 1
1 626 . 18 1 1 A 52 52 GLY N N 52 108.100 107.716 0.384 1
1 627 . 18 1 1 A 53 53 SER H H 53 7.594 7.907 -0.313 1
1 628 . 18 1 1 A 53 53 SER HA H 53 4.530 4.675 -0.145 1
1 631 . 18 1 1 A 53 53 SER C C 53 175.300 175.225 0.075 1
1 632 . 18 1 1 A 53 53 SER CA C 53 57.770 57.189 0.581 1
1 633 . 18 1 1 A 53 53 SER CB C 53 64.750 61.346 3.404 1
1 634 . 18 1 1 A 53 53 SER N N 53 114.100 115.997 -1.897 1
1 635 . 18 1 1 A 54 54 GLY H H 54 9.003 8.675 0.328 1
1 636 . 18 1 1 A 54 54 GLY HA2 H 54 4.037 3.975 0.062 1
1 637 . 18 1 1 A 54 54 GLY HA3 H 54 3.911 4.115 -0.204 1
1 638 . 18 1 1 A 54 54 GLY C C 54 176.500 175.487 1.013 1
1 639 . 18 1 1 A 54 54 GLY CA C 54 47.040 46.846 0.194 1
1 640 . 18 1 1 A 54 54 GLY N N 54 110.400 111.306 -0.906 1
1 641 . 18 1 1 A 55 55 GLY H H 55 8.617 8.215 0.402 1
1 642 . 18 1 1 A 55 55 GLY HA2 H 55 3.946 3.863 0.083 1
1 643 . 18 1 1 A 55 55 GLY HA3 H 55 3.946 3.877 0.069 1
1 644 . 18 1 1 A 55 55 GLY C C 55 176.400 175.992 0.408 1
1 645 . 18 1 1 A 55 55 GLY CA C 55 46.630 46.959 -0.329 1
1 646 . 18 1 1 A 55 55 GLY N N 55 109.800 109.429 0.371 1
1 647 . 18 1 1 A 56 56 LYS H H 56 7.876 8.351 -0.475 1
1 648 . 18 1 1 A 56 56 LYS HA H 56 4.195 4.159 0.036 1
1 657 . 18 1 1 A 56 56 LYS C C 56 178.600 178.761 -0.161 1
1 658 . 18 1 1 A 56 56 LYS CA C 56 57.960 58.755 -0.795 1
1 659 . 18 1 1 A 56 56 LYS CB C 56 32.110 32.472 -0.362 1
1 663 . 18 1 1 A 56 56 LYS N N 56 121.800 122.515 -0.715 1
1 664 . 18 1 1 A 57 57 LEU H H 57 8.153 7.442 0.711 1
1 665 . 18 1 1 A 57 57 LEU HA H 57 3.992 4.577 -0.585 1
1 675 . 18 1 1 A 57 57 LEU C C 57 178.400 178.891 -0.491 1
1 676 . 18 1 1 A 57 57 LEU CA C 57 58.190 57.676 0.514 1
1 677 . 18 1 1 A 57 57 LEU CB C 57 41.360 41.966 -0.606 1
1 681 . 18 1 1 A 57 57 LEU N N 57 120.700 121.851 -1.151 1
1 682 . 18 1 1 A 58 58 GLN H H 58 8.019 7.976 0.043 1
1 683 . 18 1 1 A 58 58 GLN HA H 58 3.942 4.179 -0.237 1
1 690 . 18 1 1 A 58 58 GLN C C 58 179.100 178.268 0.832 1
1 691 . 18 1 1 A 58 58 GLN CA C 58 59.360 58.261 1.099 1
1 692 . 18 1 1 A 58 58 GLN CB C 58 28.030 28.467 -0.437 1
1 694 . 18 1 1 A 58 58 GLN N N 58 117.400 117.431 -0.031 1
1 696 . 18 1 1 A 59 59 GLU H H 59 7.838 7.973 -0.135 1
1 697 . 18 1 1 A 59 59 GLU HA H 59 4.030 4.151 -0.121 1
1 702 . 18 1 1 A 59 59 GLU C C 59 178.600 178.850 -0.250 1
1 703 . 18 1 1 A 59 59 GLU CA C 59 59.250 58.882 0.368 1
1 704 . 18 1 1 A 59 59 GLU CB C 59 28.960 29.781 -0.821 1
1 706 . 18 1 1 A 59 59 GLU N N 59 119.900 120.307 -0.407 1
1 707 . 18 1 1 A 60 60 MET H H 60 8.223 8.138 0.085 1
1 708 . 18 1 1 A 60 60 MET HA H 60 3.966 4.237 -0.271 1
1 713 . 18 1 1 A 60 60 MET C C 60 177.900 178.641 -0.741 1
1 714 . 18 1 1 A 60 60 MET CA C 60 59.350 58.139 1.211 1
1 715 . 18 1 1 A 60 60 MET CB C 60 33.210 32.361 0.849 1
1 717 . 18 1 1 A 60 60 MET N N 60 120.100 118.815 1.285 1
1 718 . 18 1 1 A 61 61 MET H H 61 8.134 8.603 -0.469 1
1 719 . 18 1 1 A 61 61 MET HA H 61 4.195 4.519 -0.324 1
1 724 . 18 1 1 A 61 61 MET C C 61 179.100 178.626 0.474 1
1 725 . 18 1 1 A 61 61 MET CA C 61 58.210 58.526 -0.316 1
1 726 . 18 1 1 A 61 61 MET CB C 61 31.340 32.649 -1.309 1
1 728 . 18 1 1 A 61 61 MET N N 61 117.000 118.469 -1.469 1
1 729 . 18 1 1 A 62 62 LYS H H 62 7.782 8.166 -0.384 1
1 730 . 18 1 1 A 62 62 LYS HA H 62 4.085 4.187 -0.102 1
1 739 . 18 1 1 A 62 62 LYS C C 62 179.600 179.704 -0.104 1
1 740 . 18 1 1 A 62 62 LYS CA C 62 59.610 59.767 -0.157 1
1 741 . 18 1 1 A 62 62 LYS CB C 62 32.180 32.235 -0.055 1
1 745 . 18 1 1 A 62 62 LYS N N 62 120.600 120.837 -0.237 1
1 746 . 18 1 1 A 63 63 GLU H H 63 8.041 8.248 -0.207 1
1 747 . 18 1 1 A 63 63 GLU HA H 63 4.057 4.191 -0.134 1
1 752 . 18 1 1 A 63 63 GLU C C 63 178.900 178.885 0.015 1
1 753 . 18 1 1 A 63 63 GLU CA C 63 59.170 59.140 0.030 1
1 754 . 18 1 1 A 63 63 GLU CB C 63 29.000 29.463 -0.463 1
1 756 . 18 1 1 A 63 63 GLU N N 63 120.200 119.744 0.456 1
1 757 . 18 1 1 A 64 64 PHE H H 64 8.604 8.587 0.017 1
1 758 . 18 1 1 A 64 64 PHE HA H 64 4.155 3.876 0.279 1
1 763 . 18 1 1 A 64 64 PHE C C 64 177.800 177.620 0.180 1
1 764 . 18 1 1 A 64 64 PHE CA C 64 59.820 61.011 -1.191 1
1 765 . 18 1 1 A 64 64 PHE CB C 64 38.470 38.550 -0.080 1
1 766 . 18 1 1 A 64 64 PHE N N 64 119.700 122.355 -2.655 1
1 767 . 18 1 1 A 65 65 GLN H H 65 8.177 8.122 0.055 1
1 768 . 18 1 1 A 65 65 GLN HA H 65 3.637 4.258 -0.621 1
1 775 . 18 1 1 A 65 65 GLN C C 65 177.800 177.622 0.178 1
1 776 . 18 1 1 A 65 65 GLN CA C 65 58.970 58.257 0.713 1
1 777 . 18 1 1 A 65 65 GLN CB C 65 28.280 28.855 -0.575 1
1 779 . 18 1 1 A 65 65 GLN N N 65 118.500 118.686 -0.186 1
1 781 . 18 1 1 A 66 66 GLN H H 66 7.622 7.902 -0.280 1
1 782 . 18 1 1 A 66 66 GLN HA H 66 4.040 4.229 -0.189 1
1 789 . 18 1 1 A 66 66 GLN C C 66 178.600 177.900 0.700 1
1 790 . 18 1 1 A 66 66 GLN CA C 66 59.150 58.375 0.775 1
1 791 . 18 1 1 A 66 66 GLN CB C 66 28.230 28.530 -0.300 1
1 793 . 18 1 1 A 66 66 GLN N N 66 117.400 117.950 -0.550 1
1 795 . 18 1 1 A 67 67 VAL H H 67 7.744 7.888 -0.144 1
1 796 . 18 1 1 A 67 67 VAL HA H 67 3.785 3.768 0.017 1
1 804 . 18 1 1 A 67 67 VAL C C 67 177.500 177.750 -0.250 1
1 805 . 18 1 1 A 67 67 VAL CA C 67 66.220 65.756 0.464 1
1 806 . 18 1 1 A 67 67 VAL CB C 67 31.390 32.086 -0.696 1
1 809 . 18 1 1 A 67 67 VAL N N 67 119.500 120.571 -1.071 1
1 810 . 18 1 1 A 68 68 LEU H H 68 7.983 7.980 0.003 1
1 811 . 18 1 1 A 68 68 LEU HA H 68 3.825 4.085 -0.260 1
1 821 . 18 1 1 A 68 68 LEU C C 68 179.100 178.291 0.809 1
1 822 . 18 1 1 A 68 68 LEU CA C 68 58.740 58.226 0.514 1
1 823 . 18 1 1 A 68 68 LEU CB C 68 41.090 41.816 -0.726 1
1 827 . 18 1 1 A 68 68 LEU N N 68 120.400 120.244 0.156 1
1 828 . 18 1 1 A 69 69 ASP H H 69 8.179 8.005 0.174 1
1 829 . 18 1 1 A 69 69 ASP HA H 69 4.380 4.517 -0.137 1
1 832 . 18 1 1 A 69 69 ASP C C 69 178.900 178.640 0.260 1
1 833 . 18 1 1 A 69 69 ASP CA C 69 57.320 56.791 0.529 1
1 834 . 18 1 1 A 69 69 ASP CB C 69 40.040 40.660 -0.620 1
1 835 . 18 1 1 A 69 69 ASP N N 69 119.000 118.519 0.481 1
1 836 . 18 1 1 A 70 70 GLU H H 70 8.166 7.924 0.242 1
1 837 . 18 1 1 A 70 70 GLU HA H 70 4.082 4.144 -0.062 1
1 842 . 18 1 1 A 70 70 GLU C C 70 179.600 179.128 0.472 1
1 843 . 18 1 1 A 70 70 GLU CA C 70 59.010 58.810 0.200 1
1 844 . 18 1 1 A 70 70 GLU CB C 70 28.900 29.416 -0.516 1
1 846 . 18 1 1 A 70 70 GLU N N 70 120.500 119.562 0.938 1
1 847 . 18 1 1 A 71 71 ILE H H 71 8.415 8.332 0.083 1
1 848 . 18 1 1 A 71 71 ILE HA H 71 3.790 3.510 0.280 1
1 858 . 18 1 1 A 71 71 ILE C C 71 177.400 177.551 -0.151 1
1 859 . 18 1 1 A 71 71 ILE CA C 71 64.890 65.207 -0.317 1
1 860 . 18 1 1 A 71 71 ILE CB C 71 37.680 37.140 0.540 1
1 864 . 18 1 1 A 71 71 ILE N N 71 119.200 119.673 -0.473 1
1 865 . 18 1 1 A 72 72 LYS H H 72 8.248 7.801 0.447 1
1 866 . 18 1 1 A 72 72 LYS HA H 72 3.625 2.979 0.646 1
1 873 . 18 1 1 A 72 72 LYS C C 72 178.400 178.739 -0.339 1
1 874 . 18 1 1 A 72 72 LYS CA C 72 59.850 59.294 0.556 1
1 875 . 18 1 1 A 72 72 LYS CB C 72 32.070 32.087 -0.017 1
1 879 . 18 1 1 A 72 72 LYS N N 72 120.800 121.140 -0.340 1
1 880 . 18 1 1 A 73 73 GLN H H 73 7.937 7.837 0.100 1
1 881 . 18 1 1 A 73 73 GLN HA H 73 4.042 3.902 0.140 1
1 888 . 18 1 1 A 73 73 GLN C C 73 178.400 178.188 0.212 1
1 889 . 18 1 1 A 73 73 GLN CA C 73 58.510 59.139 -0.629 1
1 890 . 18 1 1 A 73 73 GLN CB C 73 28.430 28.315 0.115 1
1 892 . 18 1 1 A 73 73 GLN N N 73 117.000 117.979 -0.979 1
1 894 . 18 1 1 A 74 74 GLN H H 74 7.712 8.164 -0.452 1
1 895 . 18 1 1 A 74 74 GLN HA H 74 4.080 3.930 0.150 1
1 902 . 18 1 1 A 74 74 GLN C C 74 177.800 178.071 -0.271 1
1 903 . 18 1 1 A 74 74 GLN CA C 74 57.270 58.465 -1.195 1
1 904 . 18 1 1 A 74 74 GLN CB C 74 28.700 27.876 0.824 1
1 906 . 18 1 1 A 74 74 GLN N N 74 118.200 118.197 0.003 1
1 908 . 18 1 1 A 75 75 LEU H H 75 7.956 7.716 0.240 1
1 909 . 18 1 1 A 75 75 LEU HA H 75 4.212 4.354 -0.142 1
1 919 . 18 1 1 A 75 75 LEU CA C 75 56.660 55.471 1.189 1
1 920 . 18 1 1 A 75 75 LEU CB C 75 42.000 40.852 1.148 1
1 924 . 18 1 1 A 75 75 LEU N N 75 120.700 118.332 2.368 1
1 925 . 18 1 1 A 76 76 GLN H H 76 8.315 7.698 0.617 1
1 926 . 18 1 1 A 76 76 GLN HA H 76 4.113 3.994 0.119 1
1 933 . 18 1 1 A 76 76 GLN C C 76 177.100 176.543 0.557 1
1 934 . 18 1 1 A 76 76 GLN CA C 76 57.400 58.834 -1.434 1
1 935 . 18 1 1 A 76 76 GLN CB C 76 28.640 28.536 0.104 1
1 937 . 18 1 1 A 76 76 GLN N N 76 120.100 121.242 -1.142 1
1 939 . 18 1 1 A 77 77 GLY H H 77 8.021 7.331 0.690 1
1 940 . 18 1 1 A 77 77 GLY HA2 H 77 4.042 4.044 -0.002 1
1 941 . 18 1 1 A 77 77 GLY HA3 H 77 3.869 4.062 -0.193 1
1 942 . 18 1 1 A 77 77 GLY C C 77 174.600 174.756 -0.156 1
1 943 . 18 1 1 A 77 77 GLY CA C 77 45.430 45.313 0.117 1
1 944 . 18 1 1 A 77 77 GLY N N 77 107.700 106.713 0.987 1
1 945 . 18 1 1 A 78 78 GLY H H 78 7.819 8.201 -0.382 1
1 946 . 18 1 1 A 78 78 GLY HA2 H 78 4.208 4.012 0.196 1
1 947 . 18 1 1 A 78 78 GLY HA3 H 78 3.801 4.015 -0.214 1
1 948 . 18 1 1 A 78 78 GLY C C 78 173.900 173.524 0.376 1
1 949 . 18 1 1 A 78 78 GLY CA C 78 45.140 46.174 -1.034 1
1 950 . 18 1 1 A 78 78 GLY N N 78 107.100 107.528 -0.428 1
1 951 . 18 1 1 A 79 79 ASP H H 79 7.912 8.231 -0.319 1
1 952 . 18 1 1 A 79 79 ASP HA H 79 4.722 4.678 0.044 1
1 955 . 18 1 1 A 79 79 ASP C C 79 176.200 175.824 0.376 1
1 956 . 18 1 1 A 79 79 ASP CA C 79 53.210 53.403 -0.193 1
1 957 . 18 1 1 A 79 79 ASP CB C 79 40.160 39.498 0.662 1
1 958 . 18 1 1 A 79 79 ASP N N 79 119.800 120.609 -0.809 1
1 959 . 18 1 1 A 80 80 ASN H H 80 8.450 8.454 -0.004 1
1 960 . 18 1 1 A 80 80 ASN HA H 80 4.593 4.602 -0.009 1
1 965 . 18 1 1 A 80 80 ASN C C 80 177.300 177.250 0.050 1
1 966 . 18 1 1 A 80 80 ASN CA C 80 54.680 55.169 -0.489 1
1 967 . 18 1 1 A 80 80 ASN CB C 80 38.790 38.081 0.709 1
1 968 . 18 1 1 A 80 80 ASN N N 80 121.700 124.502 -2.802 1
1 970 . 18 1 1 A 81 81 SER H H 81 8.444 7.938 0.506 1
1 971 . 18 1 1 A 81 81 SER HA H 81 4.263 4.417 -0.154 1
1 974 . 18 1 1 A 81 81 SER C C 81 176.100 176.753 -0.653 1
1 975 . 18 1 1 A 81 81 SER CA C 81 61.470 61.403 0.067 1
1 976 . 18 1 1 A 81 81 SER CB C 81 61.470 62.569 -1.099 1
1 977 . 18 1 1 A 81 81 SER N N 81 117.100 115.848 1.252 1
1 978 . 18 1 1 A 82 82 LEU H H 82 7.929 8.109 -0.180 1
1 979 . 18 1 1 A 82 82 LEU HA H 82 4.332 3.938 0.394 1
1 989 . 18 1 1 A 82 82 LEU C C 82 177.400 178.988 -1.588 1
1 990 . 18 1 1 A 82 82 LEU CA C 82 55.060 57.783 -2.723 1
1 991 . 18 1 1 A 82 82 LEU CB C 82 41.940 41.629 0.311 1
1 995 . 18 1 1 A 82 82 LEU N N 82 120.400 121.379 -0.979 1
1 996 . 18 1 1 A 83 83 HIS H H 83 8.014 8.259 -0.245 1
1 997 . 18 1 1 A 83 83 HIS HA H 83 4.173 4.109 0.064 1
1 1000 . 18 1 1 A 83 83 HIS C C 83 176.100 176.948 -0.848 1
1 1001 . 18 1 1 A 83 83 HIS CA C 83 59.940 59.973 -0.033 1
1 1002 . 18 1 1 A 83 83 HIS CB C 83 28.050 30.255 -2.205 1
1 1003 . 18 1 1 A 83 83 HIS N N 83 119.400 118.357 1.043 1
1 1004 . 18 1 1 A 84 84 ASN H H 84 8.598 8.297 0.301 1
1 1005 . 18 1 1 A 84 84 ASN HA H 84 4.735 4.466 0.269 1
1 1010 . 18 1 1 A 84 84 ASN C C 84 177.400 177.032 0.368 1
1 1011 . 18 1 1 A 84 84 ASN CA C 84 55.790 54.892 0.898 1
1 1012 . 18 1 1 A 84 84 ASN CB C 84 37.520 38.655 -1.135 1
1 1013 . 18 1 1 A 84 84 ASN N N 84 118.100 116.644 1.456 1
1 1015 . 18 1 1 A 85 85 VAL H H 85 7.933 7.662 0.271 1
1 1016 . 18 1 1 A 85 85 VAL HA H 85 3.849 3.832 0.017 1
1 1024 . 18 1 1 A 85 85 VAL C C 85 177.100 177.982 -0.882 1
1 1025 . 18 1 1 A 85 85 VAL CA C 85 65.490 65.308 0.182 1
1 1026 . 18 1 1 A 85 85 VAL CB C 85 31.760 32.041 -0.281 1
1 1029 . 18 1 1 A 85 85 VAL N N 85 120.500 119.195 1.305 1
1 1030 . 18 1 1 A 86 86 HIS H H 86 8.460 9.438 -0.978 1
1 1031 . 18 1 1 A 86 86 HIS HA H 86 4.054 4.092 -0.038 1
1 1035 . 18 1 1 A 86 86 HIS C C 86 176.300 177.308 -1.008 1
1 1036 . 18 1 1 A 86 86 HIS CA C 86 59.860 59.548 0.312 1
1 1037 . 18 1 1 A 86 86 HIS CB C 86 29.670 30.145 -0.475 1
1 1038 . 18 1 1 A 86 86 HIS N N 86 119.300 119.200 0.100 1
1 1039 . 18 1 1 A 87 87 GLU H H 87 7.897 8.124 -0.227 1
1 1040 . 18 1 1 A 87 87 GLU HA H 87 3.838 3.750 0.088 1
1 1045 . 18 1 1 A 87 87 GLU C C 87 178.300 179.333 -1.033 1
1 1046 . 18 1 1 A 87 87 GLU CA C 87 58.690 58.912 -0.222 1
1 1047 . 18 1 1 A 87 87 GLU CB C 87 28.460 28.945 -0.485 1
1 1049 . 18 1 1 A 87 87 GLU N N 87 117.100 119.563 -2.463 1
1 1050 . 18 1 1 A 88 88 ASN H H 88 8.103 8.446 -0.343 1
1 1051 . 18 1 1 A 88 88 ASN HA H 88 4.503 4.470 0.033 1
1 1056 . 18 1 1 A 88 88 ASN C C 88 177.700 177.944 -0.244 1
1 1057 . 18 1 1 A 88 88 ASN CA C 88 55.990 56.160 -0.170 1
1 1058 . 18 1 1 A 88 88 ASN CB C 88 39.010 38.440 0.570 1
1 1059 . 18 1 1 A 88 88 ASN N N 88 118.400 117.487 0.913 1
1 1061 . 18 1 1 A 89 89 ILE H H 89 8.501 7.662 0.839 1
1 1062 . 18 1 1 A 89 89 ILE HA H 89 3.670 3.752 -0.082 1
1 1072 . 18 1 1 A 89 89 ILE C C 89 177.000 177.822 -0.822 1
1 1073 . 18 1 1 A 89 89 ILE CA C 89 65.390 65.479 -0.089 1
1 1074 . 18 1 1 A 89 89 ILE CB C 89 37.440 37.765 -0.325 1
1 1078 . 18 1 1 A 89 89 ILE N N 89 118.700 119.948 -1.248 1
1 1079 . 18 1 1 A 90 90 LYS H H 90 8.017 8.012 0.005 1
1 1080 . 18 1 1 A 90 90 LYS HA H 90 3.775 3.866 -0.091 1
1 1089 . 18 1 1 A 90 90 LYS C C 90 178.800 178.858 -0.058 1
1 1090 . 18 1 1 A 90 90 LYS CA C 90 60.450 59.870 0.580 1
1 1091 . 18 1 1 A 90 90 LYS CB C 90 32.110 32.378 -0.268 1
1 1095 . 18 1 1 A 90 90 LYS N N 90 120.900 120.363 0.537 1
1 1096 . 18 1 1 A 91 91 GLU H H 91 7.732 8.124 -0.392 1
1 1097 . 18 1 1 A 91 91 GLU HA H 91 4.083 4.054 0.029 1
1 1102 . 18 1 1 A 91 91 GLU C C 91 179.100 179.164 -0.064 1
1 1103 . 18 1 1 A 91 91 GLU CA C 91 59.120 58.880 0.240 1
1 1104 . 18 1 1 A 91 91 GLU CB C 91 28.810 29.814 -1.004 1
1 1106 . 18 1 1 A 91 91 GLU N N 91 119.300 117.667 1.633 1
1 1107 . 18 1 1 A 92 92 ILE H H 92 8.110 8.635 -0.525 1
1 1108 . 18 1 1 A 92 92 ILE HA H 92 3.685 3.634 0.051 1
1 1118 . 18 1 1 A 92 92 ILE C C 92 178.000 178.342 -0.342 1
1 1119 . 18 1 1 A 92 92 ILE CA C 92 65.900 65.222 0.678 1
1 1120 . 18 1 1 A 92 92 ILE CB C 92 38.400 37.980 0.420 1
1 1124 . 18 1 1 A 92 92 ILE N N 92 121.100 120.780 0.320 1
1 1125 . 18 1 1 A 93 93 PHE H H 93 8.651 8.765 -0.114 1
1 1126 . 18 1 1 A 93 93 PHE HA H 93 3.873 3.463 0.410 1
1 1133 . 18 1 1 A 93 93 PHE C C 93 177.100 177.661 -0.561 1
1 1134 . 18 1 1 A 93 93 PHE CA C 93 61.020 61.467 -0.447 1
1 1135 . 18 1 1 A 93 93 PHE CB C 93 38.560 38.298 0.262 1
1 1138 . 18 1 1 A 93 93 PHE N N 93 119.400 121.450 -2.050 1
1 1139 . 18 1 1 A 94 94 HIS H H 94 8.126 7.657 0.469 1
1 1140 . 18 1 1 A 94 94 HIS HA H 94 4.368 3.673 0.695 1
1 1145 . 18 1 1 A 94 94 HIS C C 94 177.100 177.000 0.100 1
1 1146 . 18 1 1 A 94 94 HIS CA C 94 58.310 57.605 0.705 1
1 1147 . 18 1 1 A 94 94 HIS CB C 94 27.910 29.721 -1.811 1
1 1148 . 18 1 1 A 94 94 HIS N N 94 116.400 118.153 -1.753 1
1 1149 . 18 1 1 A 95 95 HIS H H 95 8.058 8.904 -0.846 1
1 1150 . 18 1 1 A 95 95 HIS HA H 95 4.465 4.044 0.421 1
1 1154 . 18 1 1 A 95 95 HIS C C 95 177.300 176.873 0.427 1
1 1155 . 18 1 1 A 95 95 HIS CA C 95 57.900 59.569 -1.669 1
1 1156 . 18 1 1 A 95 95 HIS CB C 95 28.490 30.189 -1.699 1
1 1157 . 18 1 1 A 95 95 HIS N N 95 117.000 118.471 -1.471 1
1 1158 . 18 1 1 A 96 96 LEU H H 96 8.525 8.165 0.360 1
1 1159 . 18 1 1 A 96 96 LEU HA H 96 3.865 3.740 0.125 1
1 1169 . 18 1 1 A 96 96 LEU C C 96 178.300 178.478 -0.178 1
1 1170 . 18 1 1 A 96 96 LEU CA C 96 58.250 58.303 -0.053 1
1 1171 . 18 1 1 A 96 96 LEU CB C 96 41.720 41.777 -0.057 1
1 1175 . 18 1 1 A 96 96 LEU N N 96 121.300 120.093 1.207 1
1 1176 . 18 1 1 A 97 97 GLU H H 97 8.076 8.209 -0.133 1
1 1177 . 18 1 1 A 97 97 GLU HA H 97 3.719 4.078 -0.359 1
1 1182 . 18 1 1 A 97 97 GLU C C 97 178.300 178.800 -0.500 1
1 1183 . 18 1 1 A 97 97 GLU CA C 97 59.300 58.638 0.662 1
1 1184 . 18 1 1 A 97 97 GLU CB C 97 28.960 29.659 -0.699 1
1 1186 . 18 1 1 A 97 97 GLU N N 97 117.100 118.552 -1.452 1
1 1187 . 18 1 1 A 98 98 GLU H H 98 7.329 8.036 -0.707 1
1 1188 . 18 1 1 A 98 98 GLU HA H 98 4.024 4.037 -0.013 1
1 1193 . 18 1 1 A 98 98 GLU C C 98 177.900 178.769 -0.869 1
1 1194 . 18 1 1 A 98 98 GLU CA C 98 58.190 58.492 -0.302 1
1 1195 . 18 1 1 A 98 98 GLU CB C 98 29.120 29.231 -0.111 1
1 1197 . 18 1 1 A 98 98 GLU N N 98 116.000 119.153 -3.153 1
1 1198 . 18 1 1 A 99 99 LEU H H 99 7.535 8.313 -0.778 1
1 1199 . 18 1 1 A 99 99 LEU HA H 99 4.183 4.096 0.087 1
1 1209 . 18 1 1 A 99 99 LEU C C 99 178.100 177.646 0.454 1
1 1210 . 18 1 1 A 99 99 LEU CA C 99 56.440 56.230 0.210 1
1 1211 . 18 1 1 A 99 99 LEU CB C 99 43.010 41.508 1.502 1
1 1215 . 18 1 1 A 99 99 LEU N N 99 118.200 118.689 -0.489 1
1 1216 . 18 1 1 A 100 100 VAL H H 100 7.561 6.855 0.706 1
1 1217 . 18 1 1 A 100 100 VAL HA H 100 4.033 4.537 -0.504 1
1 1225 . 18 1 1 A 100 100 VAL C C 100 175.400 177.852 -2.452 1
1 1226 . 18 1 1 A 100 100 VAL CA C 100 62.430 62.095 0.335 1
1 1227 . 18 1 1 A 100 100 VAL CB C 100 32.050 33.446 -1.396 1
1 1230 . 18 1 1 A 100 100 VAL N N 100 114.800 111.920 2.880 1
1 1231 . 18 1 1 A 101 101 HIS H H 101 7.827 8.689 -0.862 1
1 1232 . 18 1 1 A 101 101 HIS HA H 101 4.630 4.098 0.532 1
1 1237 . 18 1 1 A 101 101 HIS C C 101 173.500 177.201 -3.701 1
1 1238 . 18 1 1 A 101 101 HIS CA C 101 55.410 59.542 -4.132 1
1 1239 . 18 1 1 A 101 101 HIS CB C 101 28.870 30.100 -1.230 1
1 1240 . 18 1 1 A 101 101 HIS N N 101 120.300 123.442 -3.142 1
1 10 . 19 1 1 A 2 2 TYR H H 2 8.688 7.483 1.205 1
1 11 . 19 1 1 A 2 2 TYR HA H 2 4.737 4.207 0.530 1
1 16 . 19 1 1 A 2 2 TYR C C 2 175.900 176.341 -0.441 1
1 17 . 19 1 1 A 2 2 TYR CA C 2 57.920 60.377 -2.457 1
1 18 . 19 1 1 A 2 2 TYR CB C 2 38.340 38.796 -0.456 1
1 19 . 19 1 1 A 2 2 TYR N N 2 122.100 121.429 0.671 1
1 20 . 19 1 1 A 3 3 GLY H H 3 8.434 8.154 0.280 1
1 21 . 19 1 1 A 3 3 GLY HA2 H 3 3.909 4.055 -0.146 1
1 22 . 19 1 1 A 3 3 GLY HA3 H 3 3.841 4.079 -0.238 1
1 23 . 19 1 1 A 3 3 GLY C C 3 174.300 175.844 -1.544 1
1 24 . 19 1 1 A 3 3 GLY CA C 3 46.050 45.328 0.722 1
1 25 . 19 1 1 A 3 3 GLY N N 3 111.100 107.806 3.294 1
1 26 . 19 1 1 A 4 4 LYS H H 4 8.060 8.515 -0.455 1
1 27 . 19 1 1 A 4 4 LYS HA H 4 4.297 4.113 0.184 1
1 36 . 19 1 1 A 4 4 LYS C C 4 178.000 179.048 -1.048 1
1 37 . 19 1 1 A 4 4 LYS CA C 4 56.930 59.507 -2.577 1
1 38 . 19 1 1 A 4 4 LYS CB C 4 32.680 31.671 1.009 1
1 42 . 19 1 1 A 4 4 LYS N N 4 119.500 121.955 -2.455 1
1 43 . 19 1 1 A 5 5 LEU H H 5 8.243 8.209 0.034 1
1 44 . 19 1 1 A 5 5 LEU HA H 5 3.947 3.817 0.130 1
1 54 . 19 1 1 A 5 5 LEU C C 5 177.900 178.696 -0.796 1
1 55 . 19 1 1 A 5 5 LEU CA C 5 57.930 57.727 0.203 1
1 56 . 19 1 1 A 5 5 LEU CB C 5 41.620 41.673 -0.053 1
1 60 . 19 1 1 A 5 5 LEU N N 5 120.800 120.673 0.127 1
1 61 . 19 1 1 A 6 6 ASN H H 6 8.256 8.491 -0.235 1
1 62 . 19 1 1 A 6 6 ASN HA H 6 4.252 4.305 -0.053 1
1 67 . 19 1 1 A 6 6 ASN C C 6 177.300 177.324 -0.024 1
1 68 . 19 1 1 A 6 6 ASN CA C 6 56.900 56.525 0.375 1
1 69 . 19 1 1 A 6 6 ASN CB C 6 38.200 37.816 0.384 1
1 70 . 19 1 1 A 6 6 ASN N N 6 116.200 115.117 1.083 1
1 72 . 19 1 1 A 7 7 ASP H H 7 7.699 9.349 -1.650 1
1 73 . 19 1 1 A 7 7 ASP HA H 7 4.320 4.381 -0.061 1
1 76 . 19 1 1 A 7 7 ASP C C 7 178.000 178.167 -0.167 1
1 77 . 19 1 1 A 7 7 ASP CA C 7 56.980 57.420 -0.440 1
1 78 . 19 1 1 A 7 7 ASP CB C 7 39.870 41.081 -1.211 1
1 79 . 19 1 1 A 7 7 ASP N N 7 119.100 118.872 0.228 1
1 80 . 19 1 1 A 8 8 LEU H H 8 7.580 8.538 -0.958 1
1 81 . 19 1 1 A 8 8 LEU HA H 8 4.091 4.097 -0.006 1
1 91 . 19 1 1 A 8 8 LEU C C 8 178.800 178.909 -0.109 1
1 92 . 19 1 1 A 8 8 LEU CA C 8 57.790 57.680 0.110 1
1 93 . 19 1 1 A 8 8 LEU CB C 8 41.880 42.166 -0.286 1
1 97 . 19 1 1 A 8 8 LEU N N 8 120.400 119.665 0.735 1
1 98 . 19 1 1 A 9 9 LEU H H 9 8.125 8.892 -0.767 1
1 99 . 19 1 1 A 9 9 LEU HA H 9 3.891 3.984 -0.093 1
1 109 . 19 1 1 A 9 9 LEU C C 9 178.900 178.523 0.377 1
1 110 . 19 1 1 A 9 9 LEU CA C 9 58.350 58.559 -0.209 1
1 111 . 19 1 1 A 9 9 LEU CB C 9 41.510 41.731 -0.221 1
1 115 . 19 1 1 A 9 9 LEU N N 9 118.900 119.955 -1.055 1
1 116 . 19 1 1 A 10 10 GLU H H 10 8.011 8.666 -0.655 1
1 117 . 19 1 1 A 10 10 GLU HA H 10 4.072 3.904 0.168 1
1 122 . 19 1 1 A 10 10 GLU C C 10 179.000 178.897 0.103 1
1 123 . 19 1 1 A 10 10 GLU CA C 10 59.090 59.735 -0.645 1
1 124 . 19 1 1 A 10 10 GLU CB C 10 27.910 28.872 -0.962 1
1 126 . 19 1 1 A 10 10 GLU N N 10 119.300 118.783 0.517 1
1 127 . 19 1 1 A 11 11 ASP H H 11 8.128 7.902 0.226 1
1 128 . 19 1 1 A 11 11 ASP HA H 11 4.383 4.688 -0.305 1
1 131 . 19 1 1 A 11 11 ASP C C 11 178.500 178.729 -0.229 1
1 132 . 19 1 1 A 11 11 ASP CA C 11 56.580 56.728 -0.148 1
1 133 . 19 1 1 A 11 11 ASP CB C 11 38.600 40.545 -1.945 1
1 134 . 19 1 1 A 11 11 ASP N N 11 119.600 119.646 -0.046 1
1 135 . 19 1 1 A 12 12 LEU H H 12 8.394 7.821 0.573 1
1 136 . 19 1 1 A 12 12 LEU HA H 12 3.923 4.268 -0.345 1
1 146 . 19 1 1 A 12 12 LEU C C 12 178.200 178.630 -0.430 1
1 147 . 19 1 1 A 12 12 LEU CA C 12 57.880 57.842 0.038 1
1 148 . 19 1 1 A 12 12 LEU CB C 12 41.850 42.042 -0.192 1
1 152 . 19 1 1 A 12 12 LEU N N 12 120.500 121.692 -1.192 1
1 153 . 19 1 1 A 13 13 GLN H H 13 8.371 8.570 -0.199 1
1 154 . 19 1 1 A 13 13 GLN HA H 13 3.879 4.116 -0.237 1
1 161 . 19 1 1 A 13 13 GLN C C 13 178.600 177.919 0.681 1
1 162 . 19 1 1 A 13 13 GLN CA C 13 59.570 58.545 1.025 1
1 163 . 19 1 1 A 13 13 GLN CB C 13 28.440 28.424 0.016 1
1 165 . 19 1 1 A 13 13 GLN N N 13 118.400 117.284 1.116 1
1 167 . 19 1 1 A 14 14 GLU H H 14 7.913 8.135 -0.222 1
1 168 . 19 1 1 A 14 14 GLU HA H 14 4.021 4.114 -0.093 1
1 173 . 19 1 1 A 14 14 GLU C C 14 179.000 178.955 0.045 1
1 174 . 19 1 1 A 14 14 GLU CA C 14 59.030 59.369 -0.339 1
1 175 . 19 1 1 A 14 14 GLU CB C 14 28.720 29.462 -0.742 1
1 177 . 19 1 1 A 14 14 GLU N N 14 119.100 119.863 -0.763 1
1 178 . 19 1 1 A 15 15 VAL H H 15 7.991 7.650 0.341 1
1 179 . 19 1 1 A 15 15 VAL HA H 15 3.696 3.927 -0.231 1
1 187 . 19 1 1 A 15 15 VAL C C 15 178.300 178.147 0.153 1
1 188 . 19 1 1 A 15 15 VAL CA C 15 66.640 65.536 1.104 1
1 189 . 19 1 1 A 15 15 VAL CB C 15 31.470 31.538 -0.068 1
1 192 . 19 1 1 A 15 15 VAL N N 15 120.300 117.674 2.626 1
1 193 . 19 1 1 A 16 16 LEU H H 16 8.172 7.987 0.185 1
1 194 . 19 1 1 A 16 16 LEU HA H 16 3.876 4.243 -0.367 1
1 204 . 19 1 1 A 16 16 LEU C C 16 178.400 178.475 -0.075 1
1 205 . 19 1 1 A 16 16 LEU CA C 16 58.050 58.226 -0.176 1
1 206 . 19 1 1 A 16 16 LEU CB C 16 41.420 41.341 0.079 1
1 210 . 19 1 1 A 16 16 LEU N N 16 119.700 125.161 -5.461 1
1 211 . 19 1 1 A 17 17 LYS H H 17 7.755 9.136 -1.381 1
1 212 . 19 1 1 A 17 17 LYS HA H 17 3.951 4.057 -0.106 1
1 221 . 19 1 1 A 17 17 LYS C C 17 178.800 179.412 -0.612 1
1 222 . 19 1 1 A 17 17 LYS CA C 17 59.470 59.181 0.289 1
1 223 . 19 1 1 A 17 17 LYS CB C 17 32.350 32.339 0.011 1
1 227 . 19 1 1 A 17 17 LYS N N 17 117.800 119.204 -1.404 1
1 228 . 19 1 1 A 18 18 HIS H H 18 7.847 7.956 -0.109 1
1 229 . 19 1 1 A 18 18 HIS HA H 18 4.549 4.662 -0.113 1
1 233 . 19 1 1 A 18 18 HIS C C 18 177.200 176.781 0.419 1
1 234 . 19 1 1 A 18 18 HIS CA C 18 57.870 58.172 -0.302 1
1 235 . 19 1 1 A 18 18 HIS CB C 18 28.730 28.996 -0.266 1
1 236 . 19 1 1 A 18 18 HIS N N 18 116.200 117.293 -1.093 1
1 237 . 19 1 1 A 19 19 VAL H H 19 8.415 7.792 0.623 1
1 238 . 19 1 1 A 19 19 VAL HA H 19 3.746 3.956 -0.210 1
1 246 . 19 1 1 A 19 19 VAL CA C 19 65.850 65.302 0.548 1
1 247 . 19 1 1 A 19 19 VAL CB C 19 31.600 32.240 -0.640 1
1 250 . 19 1 1 A 20 20 ASN H H 20 8.041 8.429 -0.388 1
1 251 . 19 1 1 A 20 20 ASN HA H 20 4.545 4.681 -0.136 1
1 256 . 19 1 1 A 20 20 ASN C C 20 176.900 177.204 -0.304 1
1 257 . 19 1 1 A 20 20 ASN CA C 20 55.070 56.422 -1.352 1
1 258 . 19 1 1 A 20 20 ASN CB C 20 38.270 38.243 0.027 1
1 259 . 19 1 1 A 20 20 ASN N N 20 117.900 117.495 0.405 1
1 261 . 19 1 1 A 21 21 GLN H H 21 7.887 8.188 -0.301 1
1 262 . 19 1 1 A 21 21 GLN HA H 21 4.096 4.220 -0.124 1
1 269 . 19 1 1 A 21 21 GLN C C 21 176.900 176.767 0.133 1
1 270 . 19 1 1 A 21 21 GLN CA C 21 57.510 57.533 -0.023 1
1 271 . 19 1 1 A 21 21 GLN CB C 21 29.100 29.247 -0.147 1
1 273 . 19 1 1 A 21 21 GLN N N 21 117.900 119.135 -1.235 1
1 275 . 19 1 1 A 22 22 HIS H H 22 7.887 8.207 -0.320 1
1 276 . 19 1 1 A 22 22 HIS HA H 22 4.679 4.972 -0.293 1
1 280 . 19 1 1 A 22 22 HIS C C 22 174.300 174.821 -0.521 1
1 281 . 19 1 1 A 22 22 HIS CA C 22 55.770 55.608 0.162 1
1 282 . 19 1 1 A 22 22 HIS CB C 22 28.630 29.835 -1.205 1
1 283 . 19 1 1 A 22 22 HIS N N 22 116.100 115.110 0.990 1
1 284 . 19 1 1 A 23 23 TRP H H 23 7.929 7.874 0.055 1
1 285 . 19 1 1 A 23 23 TRP HA H 23 4.542 4.681 -0.139 1
1 292 . 19 1 1 A 23 23 TRP C C 23 176.600 175.522 1.078 1
1 293 . 19 1 1 A 23 23 TRP CA C 23 58.020 58.614 -0.594 1
1 294 . 19 1 1 A 23 23 TRP CB C 23 29.700 30.433 -0.733 1
1 295 . 19 1 1 A 23 23 TRP N N 23 122.000 124.049 -2.049 1
1 297 . 19 1 1 A 24 24 GLN H H 24 8.258 8.109 0.149 1
1 298 . 19 1 1 A 24 24 GLN HA H 24 4.329 4.985 -0.656 1
1 305 . 19 1 1 A 24 24 GLN C C 24 176.200 175.548 0.652 1
1 306 . 19 1 1 A 24 24 GLN CA C 24 55.960 55.242 0.718 1
1 307 . 19 1 1 A 24 24 GLN CB C 24 29.440 32.123 -2.683 1
1 309 . 19 1 1 A 24 24 GLN N N 24 123.800 126.685 -2.885 1
1 311 . 19 1 1 A 25 25 GLY H H 25 7.470 8.735 -1.265 1
1 312 . 19 1 1 A 25 25 GLY HA2 H 25 3.939 4.087 -0.148 1
1 313 . 19 1 1 A 25 25 GLY HA3 H 25 3.800 4.092 -0.292 1
1 314 . 19 1 1 A 25 25 GLY C C 25 174.800 175.327 -0.527 1
1 315 . 19 1 1 A 25 25 GLY CA C 25 45.470 45.808 -0.338 1
1 316 . 19 1 1 A 25 25 GLY N N 25 108.100 111.614 -3.514 1
1 317 . 19 1 1 A 26 26 GLY H H 26 8.332 8.753 -0.421 1
1 318 . 19 1 1 A 26 26 GLY HA2 H 26 4.105 4.068 0.037 1
1 319 . 19 1 1 A 26 26 GLY HA3 H 26 3.974 4.095 -0.121 1
1 320 . 19 1 1 A 26 26 GLY C C 26 174.900 175.237 -0.337 1
1 321 . 19 1 1 A 26 26 GLY CA C 26 45.410 46.054 -0.644 1
1 322 . 19 1 1 A 26 26 GLY N N 26 108.700 106.958 1.742 1
1 323 . 19 1 1 A 27 27 GLN H H 27 8.474 8.283 0.191 1
1 324 . 19 1 1 A 27 27 GLN HA H 27 4.106 4.070 0.036 1
1 331 . 19 1 1 A 27 27 GLN C C 27 177.100 177.238 -0.138 1
1 332 . 19 1 1 A 27 27 GLN CA C 27 57.540 57.440 0.100 1
1 333 . 19 1 1 A 27 27 GLN CB C 27 29.050 28.779 0.271 1
1 335 . 19 1 1 A 27 27 GLN N N 27 121.100 121.738 -0.638 1
1 337 . 19 1 1 A 28 28 LYS H H 28 8.448 8.237 0.211 1
1 338 . 19 1 1 A 28 28 LYS HA H 28 4.068 4.039 0.029 1
1 347 . 19 1 1 A 28 28 LYS C C 28 177.900 178.481 -0.581 1
1 348 . 19 1 1 A 28 28 LYS CA C 28 58.410 58.992 -0.582 1
1 349 . 19 1 1 A 28 28 LYS CB C 28 32.210 32.235 -0.025 1
1 353 . 19 1 1 A 28 28 LYS N N 28 120.500 117.903 2.597 1
1 354 . 19 1 1 A 29 29 ASN H H 29 8.273 7.945 0.328 1
1 355 . 19 1 1 A 29 29 ASN HA H 29 4.584 4.406 0.178 1
1 360 . 19 1 1 A 29 29 ASN C C 29 176.200 177.909 -1.709 1
1 361 . 19 1 1 A 29 29 ASN CA C 29 54.400 56.143 -1.743 1
1 362 . 19 1 1 A 29 29 ASN CB C 29 38.280 37.740 0.540 1
1 363 . 19 1 1 A 29 29 ASN N N 29 117.500 118.280 -0.780 1
1 365 . 19 1 1 A 30 30 MET H H 30 7.870 7.536 0.334 1
1 366 . 19 1 1 A 30 30 MET HA H 30 4.085 3.407 0.678 1
1 371 . 19 1 1 A 30 30 MET C C 30 177.000 176.955 0.045 1
1 372 . 19 1 1 A 30 30 MET CA C 30 56.880 57.829 -0.949 1
1 373 . 19 1 1 A 30 30 MET CB C 30 32.340 32.319 0.021 1
1 375 . 19 1 1 A 30 30 MET N N 30 121.100 118.966 2.134 1
1 376 . 19 1 1 A 31 31 ASN H H 31 8.186 7.727 0.459 1
1 377 . 19 1 1 A 31 31 ASN HA H 31 4.311 4.644 -0.333 1
1 382 . 19 1 1 A 31 31 ASN C C 31 176.700 176.793 -0.093 1
1 383 . 19 1 1 A 31 31 ASN CA C 31 55.320 54.421 0.899 1
1 384 . 19 1 1 A 31 31 ASN CB C 31 38.410 39.105 -0.695 1
1 385 . 19 1 1 A 31 31 ASN N N 31 117.900 115.972 1.928 1
1 387 . 19 1 1 A 32 32 LYS H H 32 7.792 7.467 0.325 1
1 388 . 19 1 1 A 32 32 LYS HA H 32 3.992 4.103 -0.111 1
1 397 . 19 1 1 A 32 32 LYS C C 32 177.900 178.796 -0.896 1
1 398 . 19 1 1 A 32 32 LYS CA C 32 59.050 58.575 0.475 1
1 399 . 19 1 1 A 32 32 LYS CB C 32 32.460 32.303 0.157 1
1 403 . 19 1 1 A 32 32 LYS N N 32 120.400 120.836 -0.436 1
1 404 . 19 1 1 A 33 33 VAL H H 33 7.689 8.413 -0.724 1
1 405 . 19 1 1 A 33 33 VAL HA H 33 3.791 3.771 0.020 1
1 413 . 19 1 1 A 33 33 VAL C C 33 177.100 177.741 -0.641 1
1 414 . 19 1 1 A 33 33 VAL CA C 33 65.360 64.862 0.498 1
1 415 . 19 1 1 A 33 33 VAL CB C 33 31.920 31.569 0.351 1
1 418 . 19 1 1 A 33 33 VAL N N 33 120.200 117.288 2.912 1
1 419 . 19 1 1 A 34 34 ASP H H 34 8.408 8.296 0.112 1
1 420 . 19 1 1 A 34 34 ASP HA H 34 4.303 4.320 -0.017 1
1 423 . 19 1 1 A 34 34 ASP C C 34 178.200 178.321 -0.121 1
1 424 . 19 1 1 A 34 34 ASP CA C 34 55.880 57.169 -1.289 1
1 425 . 19 1 1 A 34 34 ASP CB C 34 38.710 41.749 -3.039 1
1 426 . 19 1 1 A 34 34 ASP N N 34 120.100 121.685 -1.585 1
1 427 . 19 1 1 A 35 35 HIS H H 35 8.204 7.980 0.224 1
1 428 . 19 1 1 A 35 35 HIS HA H 35 4.343 4.324 0.019 1
1 431 . 19 1 1 A 35 35 HIS C C 35 176.800 177.268 -0.468 1
1 432 . 19 1 1 A 35 35 HIS CA C 35 58.310 59.144 -0.834 1
1 433 . 19 1 1 A 35 35 HIS CB C 35 28.070 29.848 -1.778 1
1 434 . 19 1 1 A 35 35 HIS N N 35 118.200 119.039 -0.839 1
1 435 . 19 1 1 A 36 36 HIS H H 36 8.067 7.690 0.377 1
1 436 . 19 1 1 A 36 36 HIS HA H 36 4.602 3.962 0.640 1
1 440 . 19 1 1 A 36 36 HIS C C 36 177.100 177.509 -0.409 1
1 441 . 19 1 1 A 36 36 HIS CA C 36 58.520 59.610 -1.090 1
1 442 . 19 1 1 A 36 36 HIS CB C 36 28.720 30.323 -1.603 1
1 443 . 19 1 1 A 36 36 HIS N N 36 117.100 116.923 0.177 1
1 444 . 19 1 1 A 37 37 LEU H H 37 8.473 8.277 0.196 1
1 445 . 19 1 1 A 37 37 LEU HA H 37 3.894 3.612 0.282 1
1 455 . 19 1 1 A 37 37 LEU C C 37 178.200 178.761 -0.561 1
1 456 . 19 1 1 A 37 37 LEU CA C 37 58.520 58.004 0.516 1
1 457 . 19 1 1 A 37 37 LEU CB C 37 41.810 41.271 0.539 1
1 461 . 19 1 1 A 37 37 LEU N N 37 119.600 119.354 0.246 1
1 462 . 19 1 1 A 38 38 GLN H H 38 8.337 8.283 0.054 1
1 463 . 19 1 1 A 38 38 GLN HA H 38 3.882 3.979 -0.097 1
1 470 . 19 1 1 A 38 38 GLN C C 38 178.500 178.419 0.081 1
1 471 . 19 1 1 A 38 38 GLN CA C 38 59.200 59.210 -0.010 1
1 472 . 19 1 1 A 38 38 GLN CB C 38 27.850 28.594 -0.744 1
1 474 . 19 1 1 A 38 38 GLN N N 38 118.000 116.889 1.111 1
1 476 . 19 1 1 A 39 39 ASN H H 39 7.923 7.989 -0.066 1
1 477 . 19 1 1 A 39 39 ASN HA H 39 4.390 4.467 -0.077 1
1 482 . 19 1 1 A 39 39 ASN C C 39 177.500 177.986 -0.486 1
1 483 . 19 1 1 A 39 39 ASN CA C 39 55.780 56.526 -0.746 1
1 484 . 19 1 1 A 39 39 ASN CB C 39 37.450 39.641 -2.191 1
1 485 . 19 1 1 A 39 39 ASN N N 39 118.700 117.943 0.757 1
1 487 . 19 1 1 A 40 40 VAL H H 40 7.907 8.028 -0.121 1
1 488 . 19 1 1 A 40 40 VAL HA H 40 3.629 3.497 0.132 1
1 496 . 19 1 1 A 40 40 VAL C C 40 177.500 177.927 -0.427 1
1 497 . 19 1 1 A 40 40 VAL CA C 40 67.080 66.156 0.924 1
1 498 . 19 1 1 A 40 40 VAL CB C 40 31.390 31.201 0.189 1
1 501 . 19 1 1 A 40 40 VAL N N 40 120.400 118.500 1.900 1
1 502 . 19 1 1 A 41 41 ILE H H 41 8.103 8.405 -0.302 1
1 503 . 19 1 1 A 41 41 ILE HA H 41 3.401 3.688 -0.287 1
1 513 . 19 1 1 A 41 41 ILE C C 41 178.000 178.560 -0.560 1
1 514 . 19 1 1 A 41 41 ILE CA C 41 66.430 64.816 1.614 1
1 515 . 19 1 1 A 41 41 ILE CB C 41 38.050 38.059 -0.009 1
1 519 . 19 1 1 A 41 41 ILE N N 41 120.600 119.121 1.479 1
1 520 . 19 1 1 A 42 42 GLU H H 42 8.150 8.017 0.133 1
1 521 . 19 1 1 A 42 42 GLU HA H 42 4.062 4.172 -0.110 1
1 526 . 19 1 1 A 42 42 GLU C C 42 178.500 178.626 -0.126 1
1 527 . 19 1 1 A 42 42 GLU CA C 42 59.120 59.109 0.011 1
1 528 . 19 1 1 A 42 42 GLU CB C 42 28.160 29.410 -1.250 1
1 530 . 19 1 1 A 42 42 GLU N N 42 119.900 122.083 -2.183 1
1 531 . 19 1 1 A 43 43 ASP H H 43 8.453 8.629 -0.176 1
1 532 . 19 1 1 A 43 43 ASP HA H 43 4.445 4.488 -0.043 1
1 535 . 19 1 1 A 43 43 ASP C C 43 178.400 178.069 0.331 1
1 536 . 19 1 1 A 43 43 ASP CA C 43 56.490 56.553 -0.063 1
1 537 . 19 1 1 A 43 43 ASP CB C 43 37.820 41.557 -3.737 1
1 538 . 19 1 1 A 43 43 ASP N N 43 119.700 120.268 -0.568 1
1 539 . 19 1 1 A 44 44 ILE H H 44 8.544 7.511 1.033 1
1 540 . 19 1 1 A 44 44 ILE HA H 44 3.590 4.067 -0.477 1
1 550 . 19 1 1 A 44 44 ILE C C 44 177.800 178.323 -0.523 1
1 551 . 19 1 1 A 44 44 ILE CA C 44 66.320 64.761 1.559 1
1 552 . 19 1 1 A 44 44 ILE CB C 44 37.690 37.921 -0.231 1
1 556 . 19 1 1 A 44 44 ILE N N 44 121.500 118.714 2.786 1
1 557 . 19 1 1 A 45 45 HIS H H 45 8.261 8.082 0.179 1
1 558 . 19 1 1 A 45 45 HIS HA H 45 4.255 4.489 -0.234 1
1 562 . 19 1 1 A 45 45 HIS C C 45 177.200 176.570 0.630 1
1 563 . 19 1 1 A 45 45 HIS CA C 45 59.580 59.015 0.565 1
1 564 . 19 1 1 A 45 45 HIS CB C 45 27.790 29.430 -1.640 1
1 565 . 19 1 1 A 45 45 HIS N N 45 118.800 119.034 -0.234 1
1 566 . 19 1 1 A 46 46 ASP H H 46 8.680 8.089 0.591 1
1 567 . 19 1 1 A 46 46 ASP HA H 46 4.338 4.539 -0.201 1
1 570 . 19 1 1 A 46 46 ASP C C 46 178.700 177.811 0.889 1
1 571 . 19 1 1 A 46 46 ASP CA C 46 57.010 54.904 2.106 1
1 572 . 19 1 1 A 46 46 ASP CB C 46 39.400 41.146 -1.746 1
1 573 . 19 1 1 A 46 46 ASP N N 46 119.200 119.291 -0.091 1
1 574 . 19 1 1 A 47 47 PHE H H 47 8.380 9.317 -0.937 1
1 575 . 19 1 1 A 47 47 PHE HA H 47 4.070 4.219 -0.149 1
1 580 . 19 1 1 A 47 47 PHE C C 47 178.600 177.777 0.823 1
1 581 . 19 1 1 A 47 47 PHE CA C 47 61.250 60.282 0.968 1
1 582 . 19 1 1 A 47 47 PHE CB C 47 39.570 39.796 -0.226 1
1 583 . 19 1 1 A 47 47 PHE N N 47 121.800 121.305 0.495 1
1 584 . 19 1 1 A 48 48 MET H H 48 8.366 8.359 0.007 1
1 585 . 19 1 1 A 48 48 MET HA H 48 3.998 4.501 -0.503 1
1 590 . 19 1 1 A 48 48 MET C C 48 177.400 178.191 -0.791 1
1 591 . 19 1 1 A 48 48 MET CA C 48 58.470 58.642 -0.172 1
1 592 . 19 1 1 A 48 48 MET CB C 48 33.170 32.681 0.489 1
1 594 . 19 1 1 A 48 48 MET N N 48 117.700 118.333 -0.633 1
1 595 . 19 1 1 A 49 49 GLN H H 49 7.659 8.363 -0.704 1
1 596 . 19 1 1 A 49 49 GLN HA H 49 4.258 4.084 0.174 1
1 603 . 19 1 1 A 49 49 GLN C C 49 176.700 178.438 -1.738 1
1 604 . 19 1 1 A 49 49 GLN CA C 49 56.380 58.546 -2.166 1
1 605 . 19 1 1 A 49 49 GLN CB C 49 28.980 28.069 0.911 1
1 607 . 19 1 1 A 49 49 GLN N N 49 116.700 117.451 -0.751 1
1 609 . 19 1 1 A 50 50 GLY H H 50 7.685 8.224 -0.539 1
1 610 . 19 1 1 A 50 50 GLY HA2 H 50 3.998 3.821 0.177 1
1 611 . 19 1 1 A 50 50 GLY HA3 H 50 3.998 3.880 0.118 1
1 612 . 19 1 1 A 50 50 GLY C C 50 174.900 175.127 -0.227 1
1 613 . 19 1 1 A 50 50 GLY CA C 50 45.460 45.838 -0.378 1
1 614 . 19 1 1 A 50 50 GLY N N 50 106.400 108.786 -2.386 1
1 615 . 19 1 1 A 51 51 GLY H H 51 8.031 9.014 -0.983 1
1 616 . 19 1 1 A 51 51 GLY HA2 H 51 3.817 3.907 -0.090 1
1 617 . 19 1 1 A 51 51 GLY HA3 H 51 3.817 3.939 -0.122 1
1 618 . 19 1 1 A 51 51 GLY C C 51 174.500 174.790 -0.290 1
1 619 . 19 1 1 A 51 51 GLY CA C 51 45.190 45.658 -0.468 1
1 620 . 19 1 1 A 51 51 GLY N N 51 108.900 109.011 -0.111 1
1 621 . 19 1 1 A 52 52 GLY H H 52 8.126 8.748 -0.622 1
1 622 . 19 1 1 A 52 52 GLY HA2 H 52 3.362 3.593 -0.231 1
1 623 . 19 1 1 A 52 52 GLY HA3 H 52 3.362 3.974 -0.612 1
1 624 . 19 1 1 A 52 52 GLY C C 52 173.300 174.408 -1.108 1
1 625 . 19 1 1 A 52 52 GLY CA C 52 45.120 45.131 -0.011 1
1 626 . 19 1 1 A 52 52 GLY N N 52 108.100 108.082 0.018 1
1 627 . 19 1 1 A 53 53 SER H H 53 7.594 7.733 -0.139 1
1 628 . 19 1 1 A 53 53 SER HA H 53 4.530 4.616 -0.086 1
1 631 . 19 1 1 A 53 53 SER C C 53 175.300 175.121 0.179 1
1 632 . 19 1 1 A 53 53 SER CA C 53 57.770 57.148 0.622 1
1 633 . 19 1 1 A 53 53 SER CB C 53 64.750 61.179 3.571 1
1 634 . 19 1 1 A 53 53 SER N N 53 114.100 115.817 -1.717 1
1 635 . 19 1 1 A 54 54 GLY H H 54 9.003 8.568 0.435 1
1 636 . 19 1 1 A 54 54 GLY HA2 H 54 4.037 3.975 0.062 1
1 637 . 19 1 1 A 54 54 GLY HA3 H 54 3.911 4.101 -0.190 1
1 638 . 19 1 1 A 54 54 GLY C C 54 176.500 175.534 0.966 1
1 639 . 19 1 1 A 54 54 GLY CA C 54 47.040 46.959 0.081 1
1 640 . 19 1 1 A 54 54 GLY N N 54 110.400 110.966 -0.566 1
1 641 . 19 1 1 A 55 55 GLY H H 55 8.617 8.322 0.295 1
1 642 . 19 1 1 A 55 55 GLY HA2 H 55 3.946 3.865 0.081 1
1 643 . 19 1 1 A 55 55 GLY HA3 H 55 3.946 3.885 0.061 1
1 644 . 19 1 1 A 55 55 GLY C C 55 176.400 175.456 0.944 1
1 645 . 19 1 1 A 55 55 GLY CA C 55 46.630 46.956 -0.326 1
1 646 . 19 1 1 A 55 55 GLY N N 55 109.800 109.495 0.305 1
1 647 . 19 1 1 A 56 56 LYS H H 56 7.876 8.797 -0.921 1
1 648 . 19 1 1 A 56 56 LYS HA H 56 4.195 4.222 -0.027 1
1 657 . 19 1 1 A 56 56 LYS C C 56 178.600 178.423 0.177 1
1 658 . 19 1 1 A 56 56 LYS CA C 56 57.960 57.981 -0.021 1
1 659 . 19 1 1 A 56 56 LYS CB C 56 32.110 32.333 -0.223 1
1 663 . 19 1 1 A 56 56 LYS N N 56 121.800 122.474 -0.674 1
1 664 . 19 1 1 A 57 57 LEU H H 57 8.153 7.934 0.219 1
1 665 . 19 1 1 A 57 57 LEU HA H 57 3.992 4.331 -0.339 1
1 675 . 19 1 1 A 57 57 LEU C C 57 178.400 178.659 -0.259 1
1 676 . 19 1 1 A 57 57 LEU CA C 57 58.190 57.574 0.616 1
1 677 . 19 1 1 A 57 57 LEU CB C 57 41.360 42.227 -0.867 1
1 681 . 19 1 1 A 57 57 LEU N N 57 120.700 121.826 -1.126 1
1 682 . 19 1 1 A 58 58 GLN H H 58 8.019 8.120 -0.101 1
1 683 . 19 1 1 A 58 58 GLN HA H 58 3.942 4.167 -0.225 1
1 690 . 19 1 1 A 58 58 GLN C C 58 179.100 178.841 0.259 1
1 691 . 19 1 1 A 58 58 GLN CA C 58 59.360 58.650 0.710 1
1 692 . 19 1 1 A 58 58 GLN CB C 58 28.030 28.623 -0.593 1
1 694 . 19 1 1 A 58 58 GLN N N 58 117.400 117.678 -0.278 1
1 696 . 19 1 1 A 59 59 GLU H H 59 7.838 8.037 -0.199 1
1 697 . 19 1 1 A 59 59 GLU HA H 59 4.030 4.129 -0.099 1
1 702 . 19 1 1 A 59 59 GLU C C 59 178.600 179.321 -0.721 1
1 703 . 19 1 1 A 59 59 GLU CA C 59 59.250 58.966 0.284 1
1 704 . 19 1 1 A 59 59 GLU CB C 59 28.960 30.189 -1.229 1
1 706 . 19 1 1 A 59 59 GLU N N 59 119.900 119.399 0.501 1
1 707 . 19 1 1 A 60 60 MET H H 60 8.223 8.262 -0.039 1
1 708 . 19 1 1 A 60 60 MET HA H 60 3.966 4.142 -0.176 1
1 713 . 19 1 1 A 60 60 MET C C 60 177.900 178.381 -0.481 1
1 714 . 19 1 1 A 60 60 MET CA C 60 59.350 58.004 1.346 1
1 715 . 19 1 1 A 60 60 MET CB C 60 33.210 32.290 0.920 1
1 717 . 19 1 1 A 60 60 MET N N 60 120.100 119.164 0.936 1
1 718 . 19 1 1 A 61 61 MET H H 61 8.134 8.521 -0.387 1
1 719 . 19 1 1 A 61 61 MET HA H 61 4.195 4.245 -0.050 1
1 724 . 19 1 1 A 61 61 MET C C 61 179.100 178.260 0.840 1
1 725 . 19 1 1 A 61 61 MET CA C 61 58.210 58.945 -0.735 1
1 726 . 19 1 1 A 61 61 MET CB C 61 31.340 32.312 -0.972 1
1 728 . 19 1 1 A 61 61 MET N N 61 117.000 119.262 -2.262 1
1 729 . 19 1 1 A 62 62 LYS H H 62 7.782 7.857 -0.075 1
1 730 . 19 1 1 A 62 62 LYS HA H 62 4.085 3.958 0.127 1
1 739 . 19 1 1 A 62 62 LYS C C 62 179.600 179.280 0.320 1
1 740 . 19 1 1 A 62 62 LYS CA C 62 59.610 60.014 -0.404 1
1 741 . 19 1 1 A 62 62 LYS CB C 62 32.180 32.309 -0.129 1
1 745 . 19 1 1 A 62 62 LYS N N 62 120.600 118.982 1.618 1
1 746 . 19 1 1 A 63 63 GLU H H 63 8.041 7.910 0.131 1
1 747 . 19 1 1 A 63 63 GLU HA H 63 4.057 3.657 0.400 1
1 752 . 19 1 1 A 63 63 GLU C C 63 178.900 178.540 0.360 1
1 753 . 19 1 1 A 63 63 GLU CA C 63 59.170 59.193 -0.023 1
1 754 . 19 1 1 A 63 63 GLU CB C 63 29.000 29.190 -0.190 1
1 756 . 19 1 1 A 63 63 GLU N N 63 120.200 119.823 0.377 1
1 757 . 19 1 1 A 64 64 PHE H H 64 8.604 9.209 -0.605 1
1 758 . 19 1 1 A 64 64 PHE HA H 64 4.155 3.876 0.279 1
1 763 . 19 1 1 A 64 64 PHE C C 64 177.800 177.253 0.547 1
1 764 . 19 1 1 A 64 64 PHE CA C 64 59.820 61.217 -1.397 1
1 765 . 19 1 1 A 64 64 PHE CB C 64 38.470 38.248 0.222 1
1 766 . 19 1 1 A 64 64 PHE N N 64 119.700 121.092 -1.392 1
1 767 . 19 1 1 A 65 65 GLN H H 65 8.177 8.354 -0.177 1
1 768 . 19 1 1 A 65 65 GLN HA H 65 3.637 4.319 -0.682 1
1 775 . 19 1 1 A 65 65 GLN C C 65 177.800 177.179 0.621 1
1 776 . 19 1 1 A 65 65 GLN CA C 65 58.970 57.871 1.099 1
1 777 . 19 1 1 A 65 65 GLN CB C 65 28.280 28.464 -0.184 1
1 779 . 19 1 1 A 65 65 GLN N N 65 118.500 117.706 0.794 1
1 781 . 19 1 1 A 66 66 GLN H H 66 7.622 7.761 -0.139 1
1 782 . 19 1 1 A 66 66 GLN HA H 66 4.040 4.209 -0.169 1
1 789 . 19 1 1 A 66 66 GLN C C 66 178.600 178.510 0.090 1
1 790 . 19 1 1 A 66 66 GLN CA C 66 59.150 58.105 1.045 1
1 791 . 19 1 1 A 66 66 GLN CB C 66 28.230 28.334 -0.104 1
1 793 . 19 1 1 A 66 66 GLN N N 66 117.400 118.036 -0.636 1
1 795 . 19 1 1 A 67 67 VAL H H 67 7.744 7.684 0.060 1
1 796 . 19 1 1 A 67 67 VAL HA H 67 3.785 3.757 0.028 1
1 804 . 19 1 1 A 67 67 VAL C C 67 177.500 178.132 -0.632 1
1 805 . 19 1 1 A 67 67 VAL CA C 67 66.220 66.268 -0.048 1
1 806 . 19 1 1 A 67 67 VAL CB C 67 31.390 31.856 -0.466 1
1 809 . 19 1 1 A 67 67 VAL N N 67 119.500 120.807 -1.307 1
1 810 . 19 1 1 A 68 68 LEU H H 68 7.983 7.745 0.238 1
1 811 . 19 1 1 A 68 68 LEU HA H 68 3.825 4.204 -0.379 1
1 821 . 19 1 1 A 68 68 LEU C C 68 179.100 178.308 0.792 1
1 822 . 19 1 1 A 68 68 LEU CA C 68 58.740 57.887 0.853 1
1 823 . 19 1 1 A 68 68 LEU CB C 68 41.090 41.946 -0.856 1
1 827 . 19 1 1 A 68 68 LEU N N 68 120.400 119.341 1.059 1
1 828 . 19 1 1 A 69 69 ASP H H 69 8.179 8.122 0.057 1
1 829 . 19 1 1 A 69 69 ASP HA H 69 4.380 4.389 -0.009 1
1 832 . 19 1 1 A 69 69 ASP C C 69 178.900 178.398 0.502 1
1 833 . 19 1 1 A 69 69 ASP CA C 69 57.320 56.456 0.864 1
1 834 . 19 1 1 A 69 69 ASP CB C 69 40.040 40.773 -0.733 1
1 835 . 19 1 1 A 69 69 ASP N N 69 119.000 119.622 -0.622 1
1 836 . 19 1 1 A 70 70 GLU H H 70 8.166 8.973 -0.807 1
1 837 . 19 1 1 A 70 70 GLU HA H 70 4.082 4.230 -0.148 1
1 842 . 19 1 1 A 70 70 GLU C C 70 179.600 179.583 0.017 1
1 843 . 19 1 1 A 70 70 GLU CA C 70 59.010 59.052 -0.042 1
1 844 . 19 1 1 A 70 70 GLU CB C 70 28.900 30.119 -1.219 1
1 846 . 19 1 1 A 70 70 GLU N N 70 120.500 118.577 1.923 1
1 847 . 19 1 1 A 71 71 ILE H H 71 8.415 8.366 0.049 1
1 848 . 19 1 1 A 71 71 ILE HA H 71 3.790 3.390 0.400 1
1 858 . 19 1 1 A 71 71 ILE C C 71 177.400 177.590 -0.190 1
1 859 . 19 1 1 A 71 71 ILE CA C 71 64.890 65.000 -0.110 1
1 860 . 19 1 1 A 71 71 ILE CB C 71 37.680 37.135 0.545 1
1 864 . 19 1 1 A 71 71 ILE N N 71 119.200 121.349 -2.149 1
1 865 . 19 1 1 A 72 72 LYS H H 72 8.248 7.826 0.422 1
1 866 . 19 1 1 A 72 72 LYS HA H 72 3.625 3.288 0.337 1
1 873 . 19 1 1 A 72 72 LYS C C 72 178.400 178.512 -0.112 1
1 874 . 19 1 1 A 72 72 LYS CA C 72 59.850 59.413 0.437 1
1 875 . 19 1 1 A 72 72 LYS CB C 72 32.070 32.097 -0.027 1
1 879 . 19 1 1 A 72 72 LYS N N 72 120.800 121.106 -0.306 1
1 880 . 19 1 1 A 73 73 GLN H H 73 7.937 7.906 0.031 1
1 881 . 19 1 1 A 73 73 GLN HA H 73 4.042 3.904 0.138 1
1 888 . 19 1 1 A 73 73 GLN C C 73 178.400 177.959 0.441 1
1 889 . 19 1 1 A 73 73 GLN CA C 73 58.510 59.306 -0.796 1
1 890 . 19 1 1 A 73 73 GLN CB C 73 28.430 28.086 0.344 1
1 892 . 19 1 1 A 73 73 GLN N N 73 117.000 118.008 -1.008 1
1 894 . 19 1 1 A 74 74 GLN H H 74 7.712 8.172 -0.460 1
1 895 . 19 1 1 A 74 74 GLN HA H 74 4.080 3.804 0.276 1
1 902 . 19 1 1 A 74 74 GLN C C 74 177.800 178.076 -0.276 1
1 903 . 19 1 1 A 74 74 GLN CA C 74 57.270 58.925 -1.655 1
1 904 . 19 1 1 A 74 74 GLN CB C 74 28.700 27.751 0.949 1
1 906 . 19 1 1 A 74 74 GLN N N 74 118.200 118.311 -0.111 1
1 908 . 19 1 1 A 75 75 LEU H H 75 7.956 7.742 0.214 1
1 909 . 19 1 1 A 75 75 LEU HA H 75 4.212 3.809 0.403 1
1 919 . 19 1 1 A 75 75 LEU CA C 75 56.660 57.656 -0.996 1
1 920 . 19 1 1 A 75 75 LEU CB C 75 42.000 41.574 0.426 1
1 924 . 19 1 1 A 75 75 LEU N N 75 120.700 120.346 0.354 1
1 925 . 19 1 1 A 76 76 GLN H H 76 8.315 8.143 0.172 1
1 926 . 19 1 1 A 76 76 GLN HA H 76 4.113 4.287 -0.174 1
1 933 . 19 1 1 A 76 76 GLN C C 76 177.100 175.349 1.751 1
1 934 . 19 1 1 A 76 76 GLN CA C 76 57.400 55.178 2.222 1
1 935 . 19 1 1 A 76 76 GLN CB C 76 28.640 28.163 0.477 1
1 937 . 19 1 1 A 76 76 GLN N N 76 120.100 117.857 2.243 1
1 939 . 19 1 1 A 77 77 GLY H H 77 8.021 8.231 -0.210 1
1 940 . 19 1 1 A 77 77 GLY HA2 H 77 4.042 4.005 0.037 1
1 941 . 19 1 1 A 77 77 GLY HA3 H 77 3.869 4.010 -0.141 1
1 942 . 19 1 1 A 77 77 GLY C C 77 174.600 174.097 0.503 1
1 943 . 19 1 1 A 77 77 GLY CA C 77 45.430 45.843 -0.413 1
1 944 . 19 1 1 A 77 77 GLY N N 77 107.700 108.090 -0.390 1
1 945 . 19 1 1 A 78 78 GLY H H 78 7.819 8.860 -1.041 1
1 946 . 19 1 1 A 78 78 GLY HA2 H 78 4.208 3.877 0.331 1
1 947 . 19 1 1 A 78 78 GLY HA3 H 78 3.801 3.886 -0.085 1
1 948 . 19 1 1 A 78 78 GLY C C 78 173.900 174.587 -0.687 1
1 949 . 19 1 1 A 78 78 GLY CA C 78 45.140 46.450 -1.310 1
1 950 . 19 1 1 A 78 78 GLY N N 78 107.100 108.670 -1.570 1
1 951 . 19 1 1 A 79 79 ASP H H 79 7.912 8.128 -0.216 1
1 952 . 19 1 1 A 79 79 ASP HA H 79 4.722 5.022 -0.300 1
1 955 . 19 1 1 A 79 79 ASP C C 79 176.200 176.821 -0.621 1
1 956 . 19 1 1 A 79 79 ASP CA C 79 53.210 53.036 0.174 1
1 957 . 19 1 1 A 79 79 ASP CB C 79 40.160 40.478 -0.318 1
1 958 . 19 1 1 A 79 79 ASP N N 79 119.800 119.258 0.542 1
1 959 . 19 1 1 A 80 80 ASN H H 80 8.450 8.388 0.062 1
1 960 . 19 1 1 A 80 80 ASN HA H 80 4.593 4.513 0.080 1
1 965 . 19 1 1 A 80 80 ASN C C 80 177.300 177.084 0.216 1
1 966 . 19 1 1 A 80 80 ASN CA C 80 54.680 55.470 -0.790 1
1 967 . 19 1 1 A 80 80 ASN CB C 80 38.790 38.059 0.731 1
1 968 . 19 1 1 A 80 80 ASN N N 80 121.700 118.821 2.879 1
1 970 . 19 1 1 A 81 81 SER H H 81 8.444 7.920 0.524 1
1 971 . 19 1 1 A 81 81 SER HA H 81 4.263 4.229 0.034 1
1 974 . 19 1 1 A 81 81 SER C C 81 176.100 177.079 -0.979 1
1 975 . 19 1 1 A 81 81 SER CA C 81 61.470 61.577 -0.107 1
1 976 . 19 1 1 A 81 81 SER CB C 81 61.470 62.702 -1.232 1
1 977 . 19 1 1 A 81 81 SER N N 81 117.100 114.906 2.194 1
1 978 . 19 1 1 A 82 82 LEU H H 82 7.929 8.147 -0.218 1
1 979 . 19 1 1 A 82 82 LEU HA H 82 4.332 4.031 0.301 1
1 989 . 19 1 1 A 82 82 LEU C C 82 177.400 179.105 -1.705 1
1 990 . 19 1 1 A 82 82 LEU CA C 82 55.060 57.872 -2.812 1
1 991 . 19 1 1 A 82 82 LEU CB C 82 41.940 41.741 0.199 1
1 995 . 19 1 1 A 82 82 LEU N N 82 120.400 122.011 -1.611 1
1 996 . 19 1 1 A 83 83 HIS H H 83 8.014 8.032 -0.018 1
1 997 . 19 1 1 A 83 83 HIS HA H 83 4.173 4.171 0.002 1
1 1000 . 19 1 1 A 83 83 HIS C C 83 176.100 176.586 -0.486 1
1 1001 . 19 1 1 A 83 83 HIS CA C 83 59.940 59.790 0.150 1
1 1002 . 19 1 1 A 83 83 HIS CB C 83 28.050 30.201 -2.151 1
1 1003 . 19 1 1 A 83 83 HIS N N 83 119.400 118.394 1.006 1
1 1004 . 19 1 1 A 84 84 ASN H H 84 8.598 8.241 0.357 1
1 1005 . 19 1 1 A 84 84 ASN HA H 84 4.735 4.633 0.102 1
1 1010 . 19 1 1 A 84 84 ASN C C 84 177.400 177.289 0.111 1
1 1011 . 19 1 1 A 84 84 ASN CA C 84 55.790 55.275 0.515 1
1 1012 . 19 1 1 A 84 84 ASN CB C 84 37.520 38.972 -1.452 1
1 1013 . 19 1 1 A 84 84 ASN N N 84 118.100 116.735 1.365 1
1 1015 . 19 1 1 A 85 85 VAL H H 85 7.933 7.604 0.329 1
1 1016 . 19 1 1 A 85 85 VAL HA H 85 3.849 3.827 0.022 1
1 1024 . 19 1 1 A 85 85 VAL C C 85 177.100 177.972 -0.872 1
1 1025 . 19 1 1 A 85 85 VAL CA C 85 65.490 65.556 -0.066 1
1 1026 . 19 1 1 A 85 85 VAL CB C 85 31.760 32.022 -0.262 1
1 1029 . 19 1 1 A 85 85 VAL N N 85 120.500 120.052 0.448 1
1 1030 . 19 1 1 A 86 86 HIS H H 86 8.460 9.350 -0.890 1
1 1031 . 19 1 1 A 86 86 HIS HA H 86 4.054 4.156 -0.102 1
1 1035 . 19 1 1 A 86 86 HIS C C 86 176.300 177.485 -1.185 1
1 1036 . 19 1 1 A 86 86 HIS CA C 86 59.860 60.199 -0.339 1
1 1037 . 19 1 1 A 86 86 HIS CB C 86 29.670 29.986 -0.316 1
1 1038 . 19 1 1 A 86 86 HIS N N 86 119.300 119.240 0.060 1
1 1039 . 19 1 1 A 87 87 GLU H H 87 7.897 7.772 0.125 1
1 1040 . 19 1 1 A 87 87 GLU HA H 87 3.838 3.796 0.042 1
1 1045 . 19 1 1 A 87 87 GLU C C 87 178.300 179.201 -0.901 1
1 1046 . 19 1 1 A 87 87 GLU CA C 87 58.690 58.636 0.054 1
1 1047 . 19 1 1 A 87 87 GLU CB C 87 28.460 29.282 -0.822 1
1 1049 . 19 1 1 A 87 87 GLU N N 87 117.100 117.876 -0.776 1
1 1050 . 19 1 1 A 88 88 ASN H H 88 8.103 8.563 -0.460 1
1 1051 . 19 1 1 A 88 88 ASN HA H 88 4.503 4.524 -0.021 1
1 1056 . 19 1 1 A 88 88 ASN C C 88 177.700 177.777 -0.077 1
1 1057 . 19 1 1 A 88 88 ASN CA C 88 55.990 56.002 -0.012 1
1 1058 . 19 1 1 A 88 88 ASN CB C 88 39.010 38.491 0.519 1
1 1059 . 19 1 1 A 88 88 ASN N N 88 118.400 117.570 0.830 1
1 1061 . 19 1 1 A 89 89 ILE H H 89 8.501 8.176 0.325 1
1 1062 . 19 1 1 A 89 89 ILE HA H 89 3.670 3.809 -0.139 1
1 1072 . 19 1 1 A 89 89 ILE C C 89 177.000 177.891 -0.891 1
1 1073 . 19 1 1 A 89 89 ILE CA C 89 65.390 65.431 -0.041 1
1 1074 . 19 1 1 A 89 89 ILE CB C 89 37.440 37.766 -0.326 1
1 1078 . 19 1 1 A 89 89 ILE N N 89 118.700 119.478 -0.778 1
1 1079 . 19 1 1 A 90 90 LYS H H 90 8.017 7.534 0.483 1
1 1080 . 19 1 1 A 90 90 LYS HA H 90 3.775 3.994 -0.219 1
1 1089 . 19 1 1 A 90 90 LYS C C 90 178.800 178.895 -0.095 1
1 1090 . 19 1 1 A 90 90 LYS CA C 90 60.450 59.796 0.654 1
1 1091 . 19 1 1 A 90 90 LYS CB C 90 32.110 32.280 -0.170 1
1 1095 . 19 1 1 A 90 90 LYS N N 90 120.900 120.365 0.535 1
1 1096 . 19 1 1 A 91 91 GLU H H 91 7.732 8.001 -0.269 1
1 1097 . 19 1 1 A 91 91 GLU HA H 91 4.083 4.035 0.048 1
1 1102 . 19 1 1 A 91 91 GLU C C 91 179.100 179.225 -0.125 1
1 1103 . 19 1 1 A 91 91 GLU CA C 91 59.120 58.645 0.475 1
1 1104 . 19 1 1 A 91 91 GLU CB C 91 28.810 29.363 -0.553 1
1 1106 . 19 1 1 A 91 91 GLU N N 91 119.300 118.579 0.721 1
1 1107 . 19 1 1 A 92 92 ILE H H 92 8.110 9.174 -1.064 1
1 1108 . 19 1 1 A 92 92 ILE HA H 92 3.685 3.750 -0.065 1
1 1118 . 19 1 1 A 92 92 ILE C C 92 178.000 178.147 -0.147 1
1 1119 . 19 1 1 A 92 92 ILE CA C 92 65.900 65.282 0.618 1
1 1120 . 19 1 1 A 92 92 ILE CB C 92 38.400 38.136 0.264 1
1 1124 . 19 1 1 A 92 92 ILE N N 92 121.100 120.581 0.519 1
1 1125 . 19 1 1 A 93 93 PHE H H 93 8.651 9.228 -0.577 1
1 1126 . 19 1 1 A 93 93 PHE HA H 93 3.873 3.149 0.724 1
1 1133 . 19 1 1 A 93 93 PHE C C 93 177.100 177.770 -0.670 1
1 1134 . 19 1 1 A 93 93 PHE CA C 93 61.020 61.203 -0.183 1
1 1135 . 19 1 1 A 93 93 PHE CB C 93 38.560 38.150 0.410 1
1 1138 . 19 1 1 A 93 93 PHE N N 93 119.400 120.851 -1.451 1
1 1139 . 19 1 1 A 94 94 HIS H H 94 8.126 7.469 0.657 1
1 1140 . 19 1 1 A 94 94 HIS HA H 94 4.368 3.559 0.809 1
1 1145 . 19 1 1 A 94 94 HIS C C 94 177.100 176.385 0.715 1
1 1146 . 19 1 1 A 94 94 HIS CA C 94 58.310 57.517 0.793 1
1 1147 . 19 1 1 A 94 94 HIS CB C 94 27.910 29.855 -1.945 1
1 1148 . 19 1 1 A 94 94 HIS N N 94 116.400 117.800 -1.400 1
1 1149 . 19 1 1 A 95 95 HIS H H 95 8.058 7.895 0.163 1
1 1150 . 19 1 1 A 95 95 HIS HA H 95 4.465 4.185 0.280 1
1 1154 . 19 1 1 A 95 95 HIS C C 95 177.300 177.691 -0.391 1
1 1155 . 19 1 1 A 95 95 HIS CA C 95 57.900 59.258 -1.358 1
1 1156 . 19 1 1 A 95 95 HIS CB C 95 28.490 30.308 -1.818 1
1 1157 . 19 1 1 A 95 95 HIS N N 95 117.000 115.553 1.447 1
1 1158 . 19 1 1 A 96 96 LEU H H 96 8.525 8.168 0.357 1
1 1159 . 19 1 1 A 96 96 LEU HA H 96 3.865 3.801 0.064 1
1 1169 . 19 1 1 A 96 96 LEU C C 96 178.300 178.535 -0.235 1
1 1170 . 19 1 1 A 96 96 LEU CA C 96 58.250 58.087 0.163 1
1 1171 . 19 1 1 A 96 96 LEU CB C 96 41.720 41.879 -0.159 1
1 1175 . 19 1 1 A 96 96 LEU N N 96 121.300 120.705 0.595 1
1 1176 . 19 1 1 A 97 97 GLU H H 97 8.076 7.820 0.256 1
1 1177 . 19 1 1 A 97 97 GLU HA H 97 3.719 4.155 -0.436 1
1 1182 . 19 1 1 A 97 97 GLU C C 97 178.300 178.707 -0.407 1
1 1183 . 19 1 1 A 97 97 GLU CA C 97 59.300 58.735 0.565 1
1 1184 . 19 1 1 A 97 97 GLU CB C 97 28.960 29.859 -0.899 1
1 1186 . 19 1 1 A 97 97 GLU N N 97 117.100 118.853 -1.753 1
1 1187 . 19 1 1 A 98 98 GLU H H 98 7.329 7.802 -0.473 1
1 1188 . 19 1 1 A 98 98 GLU HA H 98 4.024 4.108 -0.084 1
1 1193 . 19 1 1 A 98 98 GLU C C 98 177.900 179.200 -1.300 1
1 1194 . 19 1 1 A 98 98 GLU CA C 98 58.190 58.609 -0.419 1
1 1195 . 19 1 1 A 98 98 GLU CB C 98 29.120 29.552 -0.432 1
1 1197 . 19 1 1 A 98 98 GLU N N 98 116.000 118.989 -2.989 1
1 1198 . 19 1 1 A 99 99 LEU H H 99 7.535 8.388 -0.853 1
1 1199 . 19 1 1 A 99 99 LEU HA H 99 4.183 4.051 0.132 1
1 1209 . 19 1 1 A 99 99 LEU C C 99 178.100 177.710 0.390 1
1 1210 . 19 1 1 A 99 99 LEU CA C 99 56.440 57.112 -0.672 1
1 1211 . 19 1 1 A 99 99 LEU CB C 99 43.010 41.344 1.666 1
1 1215 . 19 1 1 A 99 99 LEU N N 99 118.200 119.753 -1.553 1
1 1216 . 19 1 1 A 100 100 VAL H H 100 7.561 7.039 0.522 1
1 1217 . 19 1 1 A 100 100 VAL HA H 100 4.033 4.281 -0.248 1
1 1225 . 19 1 1 A 100 100 VAL C C 100 175.400 177.623 -2.223 1
1 1226 . 19 1 1 A 100 100 VAL CA C 100 62.430 64.129 -1.699 1
1 1227 . 19 1 1 A 100 100 VAL CB C 100 32.050 33.004 -0.954 1
1 1230 . 19 1 1 A 100 100 VAL N N 100 114.800 113.593 1.207 1
1 1231 . 19 1 1 A 101 101 HIS H H 101 7.827 8.257 -0.430 1
1 1232 . 19 1 1 A 101 101 HIS HA H 101 4.630 4.133 0.497 1
1 1237 . 19 1 1 A 101 101 HIS C C 101 173.500 176.996 -3.496 1
1 1238 . 19 1 1 A 101 101 HIS CA C 101 55.410 59.843 -4.433 1
1 1239 . 19 1 1 A 101 101 HIS CB C 101 28.870 30.173 -1.303 1
1 1240 . 19 1 1 A 101 101 HIS N N 101 120.300 123.222 -2.922 1
1 10 . 20 1 1 A 2 2 TYR H H 2 8.688 7.558 1.130 1
1 11 . 20 1 1 A 2 2 TYR HA H 2 4.737 4.234 0.503 1
1 16 . 20 1 1 A 2 2 TYR C C 2 175.900 176.156 -0.256 1
1 17 . 20 1 1 A 2 2 TYR CA C 2 57.920 60.201 -2.281 1
1 18 . 20 1 1 A 2 2 TYR CB C 2 38.340 38.938 -0.598 1
1 19 . 20 1 1 A 2 2 TYR N N 2 122.100 123.669 -1.569 1
1 20 . 20 1 1 A 3 3 GLY H H 3 8.434 7.725 0.709 1
1 21 . 20 1 1 A 3 3 GLY HA2 H 3 3.909 3.945 -0.036 1
1 22 . 20 1 1 A 3 3 GLY HA3 H 3 3.841 4.001 -0.160 1
1 23 . 20 1 1 A 3 3 GLY C C 3 174.300 176.017 -1.717 1
1 24 . 20 1 1 A 3 3 GLY CA C 3 46.050 45.454 0.596 1
1 25 . 20 1 1 A 3 3 GLY N N 3 111.100 106.368 4.732 1
1 26 . 20 1 1 A 4 4 LYS H H 4 8.060 8.603 -0.543 1
1 27 . 20 1 1 A 4 4 LYS HA H 4 4.297 3.978 0.319 1
1 36 . 20 1 1 A 4 4 LYS C C 4 178.000 178.493 -0.493 1
1 37 . 20 1 1 A 4 4 LYS CA C 4 56.930 59.681 -2.751 1
1 38 . 20 1 1 A 4 4 LYS CB C 4 32.680 32.656 0.024 1
1 42 . 20 1 1 A 4 4 LYS N N 4 119.500 121.536 -2.036 1
1 43 . 20 1 1 A 5 5 LEU H H 5 8.243 8.215 0.028 1
1 44 . 20 1 1 A 5 5 LEU HA H 5 3.947 3.896 0.051 1
1 54 . 20 1 1 A 5 5 LEU C C 5 177.900 179.037 -1.137 1
1 55 . 20 1 1 A 5 5 LEU CA C 5 57.930 57.736 0.194 1
1 56 . 20 1 1 A 5 5 LEU CB C 5 41.620 41.538 0.082 1
1 60 . 20 1 1 A 5 5 LEU N N 5 120.800 120.504 0.296 1
1 61 . 20 1 1 A 6 6 ASN H H 6 8.256 8.282 -0.026 1
1 62 . 20 1 1 A 6 6 ASN HA H 6 4.252 4.353 -0.101 1
1 67 . 20 1 1 A 6 6 ASN C C 6 177.300 177.510 -0.210 1
1 68 . 20 1 1 A 6 6 ASN CA C 6 56.900 56.409 0.491 1
1 69 . 20 1 1 A 6 6 ASN CB C 6 38.200 38.157 0.043 1
1 70 . 20 1 1 A 6 6 ASN N N 6 116.200 117.269 -1.069 1
1 72 . 20 1 1 A 7 7 ASP H H 7 7.699 9.447 -1.748 1
1 73 . 20 1 1 A 7 7 ASP HA H 7 4.320 4.357 -0.037 1
1 76 . 20 1 1 A 7 7 ASP C C 7 178.000 178.106 -0.106 1
1 77 . 20 1 1 A 7 7 ASP CA C 7 56.980 57.381 -0.401 1
1 78 . 20 1 1 A 7 7 ASP CB C 7 39.870 41.549 -1.679 1
1 79 . 20 1 1 A 7 7 ASP N N 7 119.100 118.922 0.178 1
1 80 . 20 1 1 A 8 8 LEU H H 8 7.580 8.620 -1.040 1
1 81 . 20 1 1 A 8 8 LEU HA H 8 4.091 4.157 -0.066 1
1 91 . 20 1 1 A 8 8 LEU C C 8 178.800 178.867 -0.067 1
1 92 . 20 1 1 A 8 8 LEU CA C 8 57.790 57.698 0.092 1
1 93 . 20 1 1 A 8 8 LEU CB C 8 41.880 42.075 -0.195 1
1 97 . 20 1 1 A 8 8 LEU N N 8 120.400 119.489 0.911 1
1 98 . 20 1 1 A 9 9 LEU H H 9 8.125 8.907 -0.782 1
1 99 . 20 1 1 A 9 9 LEU HA H 9 3.891 4.016 -0.125 1
1 109 . 20 1 1 A 9 9 LEU C C 9 178.900 178.596 0.304 1
1 110 . 20 1 1 A 9 9 LEU CA C 9 58.350 58.628 -0.278 1
1 111 . 20 1 1 A 9 9 LEU CB C 9 41.510 41.608 -0.098 1
1 115 . 20 1 1 A 9 9 LEU N N 9 118.900 119.973 -1.073 1
1 116 . 20 1 1 A 10 10 GLU H H 10 8.011 8.760 -0.749 1
1 117 . 20 1 1 A 10 10 GLU HA H 10 4.072 3.931 0.141 1
1 122 . 20 1 1 A 10 10 GLU C C 10 179.000 178.575 0.425 1
1 123 . 20 1 1 A 10 10 GLU CA C 10 59.090 59.691 -0.601 1
1 124 . 20 1 1 A 10 10 GLU CB C 10 27.910 28.875 -0.965 1
1 126 . 20 1 1 A 10 10 GLU N N 10 119.300 118.800 0.500 1
1 127 . 20 1 1 A 11 11 ASP H H 11 8.128 7.927 0.201 1
1 128 . 20 1 1 A 11 11 ASP HA H 11 4.383 4.370 0.013 1
1 131 . 20 1 1 A 11 11 ASP C C 11 178.500 178.798 -0.298 1
1 132 . 20 1 1 A 11 11 ASP CA C 11 56.580 57.044 -0.464 1
1 133 . 20 1 1 A 11 11 ASP CB C 11 38.600 40.806 -2.206 1
1 134 . 20 1 1 A 11 11 ASP N N 11 119.600 119.741 -0.141 1
1 135 . 20 1 1 A 12 12 LEU H H 12 8.394 8.034 0.360 1
1 136 . 20 1 1 A 12 12 LEU HA H 12 3.923 4.225 -0.302 1
1 146 . 20 1 1 A 12 12 LEU C C 12 178.200 178.954 -0.754 1
1 147 . 20 1 1 A 12 12 LEU CA C 12 57.880 57.843 0.037 1
1 148 . 20 1 1 A 12 12 LEU CB C 12 41.850 42.050 -0.200 1
1 152 . 20 1 1 A 12 12 LEU N N 12 120.500 120.974 -0.474 1
1 153 . 20 1 1 A 13 13 GLN H H 13 8.371 8.768 -0.397 1
1 154 . 20 1 1 A 13 13 GLN HA H 13 3.879 4.117 -0.238 1
1 161 . 20 1 1 A 13 13 GLN C C 13 178.600 178.012 0.588 1
1 162 . 20 1 1 A 13 13 GLN CA C 13 59.570 57.921 1.649 1
1 163 . 20 1 1 A 13 13 GLN CB C 13 28.440 27.727 0.713 1
1 165 . 20 1 1 A 13 13 GLN N N 13 118.400 117.230 1.170 1
1 167 . 20 1 1 A 14 14 GLU H H 14 7.913 7.801 0.112 1
1 168 . 20 1 1 A 14 14 GLU HA H 14 4.021 4.232 -0.211 1
1 173 . 20 1 1 A 14 14 GLU C C 14 179.000 178.913 0.087 1
1 174 . 20 1 1 A 14 14 GLU CA C 14 59.030 58.802 0.228 1
1 175 . 20 1 1 A 14 14 GLU CB C 14 28.720 30.191 -1.471 1
1 177 . 20 1 1 A 14 14 GLU N N 14 119.100 119.491 -0.391 1
1 178 . 20 1 1 A 15 15 VAL H H 15 7.991 7.761 0.230 1
1 179 . 20 1 1 A 15 15 VAL HA H 15 3.696 3.911 -0.215 1
1 187 . 20 1 1 A 15 15 VAL C C 15 178.300 177.991 0.309 1
1 188 . 20 1 1 A 15 15 VAL CA C 15 66.640 65.408 1.232 1
1 189 . 20 1 1 A 15 15 VAL CB C 15 31.470 31.523 -0.053 1
1 192 . 20 1 1 A 15 15 VAL N N 15 120.300 117.525 2.775 1
1 193 . 20 1 1 A 16 16 LEU H H 16 8.172 7.885 0.287 1
1 194 . 20 1 1 A 16 16 LEU HA H 16 3.876 4.260 -0.384 1
1 204 . 20 1 1 A 16 16 LEU C C 16 178.400 178.520 -0.120 1
1 205 . 20 1 1 A 16 16 LEU CA C 16 58.050 57.750 0.300 1
1 206 . 20 1 1 A 16 16 LEU CB C 16 41.420 41.823 -0.403 1
1 210 . 20 1 1 A 16 16 LEU N N 16 119.700 124.534 -4.834 1
1 211 . 20 1 1 A 17 17 LYS H H 17 7.755 8.607 -0.852 1
1 212 . 20 1 1 A 17 17 LYS HA H 17 3.951 4.045 -0.094 1
1 221 . 20 1 1 A 17 17 LYS C C 17 178.800 179.149 -0.349 1
1 222 . 20 1 1 A 17 17 LYS CA C 17 59.470 58.998 0.472 1
1 223 . 20 1 1 A 17 17 LYS CB C 17 32.350 32.223 0.127 1
1 227 . 20 1 1 A 17 17 LYS N N 17 117.800 120.403 -2.603 1
1 228 . 20 1 1 A 18 18 HIS H H 18 7.847 8.158 -0.311 1
1 229 . 20 1 1 A 18 18 HIS HA H 18 4.549 4.704 -0.155 1
1 233 . 20 1 1 A 18 18 HIS C C 18 177.200 176.458 0.742 1
1 234 . 20 1 1 A 18 18 HIS CA C 18 57.870 58.404 -0.534 1
1 235 . 20 1 1 A 18 18 HIS CB C 18 28.730 29.122 -0.392 1
1 236 . 20 1 1 A 18 18 HIS N N 18 116.200 117.265 -1.065 1
1 237 . 20 1 1 A 19 19 VAL H H 19 8.415 7.873 0.542 1
1 238 . 20 1 1 A 19 19 VAL HA H 19 3.746 4.096 -0.350 1
1 246 . 20 1 1 A 19 19 VAL CA C 19 65.850 64.847 1.003 1
1 247 . 20 1 1 A 19 19 VAL CB C 19 31.600 32.272 -0.672 1
1 250 . 20 1 1 A 20 20 ASN H H 20 8.041 8.129 -0.088 1
1 251 . 20 1 1 A 20 20 ASN HA H 20 4.545 4.657 -0.112 1
1 256 . 20 1 1 A 20 20 ASN C C 20 176.900 177.241 -0.341 1
1 257 . 20 1 1 A 20 20 ASN CA C 20 55.070 56.278 -1.208 1
1 258 . 20 1 1 A 20 20 ASN CB C 20 38.270 38.110 0.160 1
1 259 . 20 1 1 A 20 20 ASN N N 20 117.900 119.509 -1.609 1
1 261 . 20 1 1 A 21 21 GLN H H 21 7.887 8.174 -0.287 1
1 262 . 20 1 1 A 21 21 GLN HA H 21 4.096 4.189 -0.093 1
1 269 . 20 1 1 A 21 21 GLN C C 21 176.900 177.143 -0.243 1
1 270 . 20 1 1 A 21 21 GLN CA C 21 57.510 56.982 0.528 1
1 271 . 20 1 1 A 21 21 GLN CB C 21 29.100 28.644 0.456 1
1 273 . 20 1 1 A 21 21 GLN N N 21 117.900 115.841 2.059 1
1 275 . 20 1 1 A 22 22 HIS H H 22 7.887 8.253 -0.366 1
1 276 . 20 1 1 A 22 22 HIS HA H 22 4.679 4.940 -0.261 1
1 280 . 20 1 1 A 22 22 HIS C C 22 174.300 175.022 -0.722 1
1 281 . 20 1 1 A 22 22 HIS CA C 22 55.770 55.965 -0.195 1
1 282 . 20 1 1 A 22 22 HIS CB C 22 28.630 30.737 -2.107 1
1 283 . 20 1 1 A 22 22 HIS N N 22 116.100 114.101 1.999 1
1 284 . 20 1 1 A 23 23 TRP H H 23 7.929 7.809 0.120 1
1 285 . 20 1 1 A 23 23 TRP HA H 23 4.542 4.620 -0.078 1
1 292 . 20 1 1 A 23 23 TRP C C 23 176.600 175.521 1.079 1
1 293 . 20 1 1 A 23 23 TRP CA C 23 58.020 58.669 -0.649 1
1 294 . 20 1 1 A 23 23 TRP CB C 23 29.700 30.466 -0.766 1
1 295 . 20 1 1 A 23 23 TRP N N 23 122.000 123.550 -1.550 1
1 297 . 20 1 1 A 24 24 GLN H H 24 8.258 8.323 -0.065 1
1 298 . 20 1 1 A 24 24 GLN HA H 24 4.329 4.784 -0.455 1
1 305 . 20 1 1 A 24 24 GLN C C 24 176.200 175.045 1.155 1
1 306 . 20 1 1 A 24 24 GLN CA C 24 55.960 54.719 1.241 1
1 307 . 20 1 1 A 24 24 GLN CB C 24 29.440 31.449 -2.009 1
1 309 . 20 1 1 A 24 24 GLN N N 24 123.800 126.393 -2.593 1
1 311 . 20 1 1 A 25 25 GLY H H 25 7.470 8.539 -1.069 1
1 312 . 20 1 1 A 25 25 GLY HA2 H 25 3.939 3.990 -0.051 1
1 313 . 20 1 1 A 25 25 GLY HA3 H 25 3.800 3.990 -0.190 1
1 314 . 20 1 1 A 25 25 GLY C C 25 174.800 173.823 0.977 1
1 315 . 20 1 1 A 25 25 GLY CA C 25 45.470 45.677 -0.207 1
1 316 . 20 1 1 A 25 25 GLY N N 25 108.100 108.853 -0.753 1
1 317 . 20 1 1 A 26 26 GLY H H 26 8.332 9.135 -0.803 1
1 318 . 20 1 1 A 26 26 GLY HA2 H 26 4.105 4.182 -0.077 1
1 319 . 20 1 1 A 26 26 GLY HA3 H 26 3.974 4.219 -0.245 1
1 320 . 20 1 1 A 26 26 GLY C C 26 174.900 174.408 0.492 1
1 321 . 20 1 1 A 26 26 GLY CA C 26 45.410 45.933 -0.523 1
1 322 . 20 1 1 A 26 26 GLY N N 26 108.700 107.828 0.872 1
1 323 . 20 1 1 A 27 27 GLN H H 27 8.474 8.931 -0.457 1
1 324 . 20 1 1 A 27 27 GLN HA H 27 4.106 3.987 0.119 1
1 331 . 20 1 1 A 27 27 GLN C C 27 177.100 177.077 0.023 1
1 332 . 20 1 1 A 27 27 GLN CA C 27 57.540 57.805 -0.265 1
1 333 . 20 1 1 A 27 27 GLN CB C 27 29.050 28.845 0.205 1
1 335 . 20 1 1 A 27 27 GLN N N 27 121.100 124.315 -3.215 1
1 337 . 20 1 1 A 28 28 LYS H H 28 8.448 8.361 0.087 1
1 338 . 20 1 1 A 28 28 LYS HA H 28 4.068 4.063 0.005 1
1 347 . 20 1 1 A 28 28 LYS C C 28 177.900 177.706 0.194 1
1 348 . 20 1 1 A 28 28 LYS CA C 28 58.410 58.275 0.135 1
1 349 . 20 1 1 A 28 28 LYS CB C 28 32.210 31.651 0.559 1
1 353 . 20 1 1 A 28 28 LYS N N 28 120.500 117.502 2.998 1
1 354 . 20 1 1 A 29 29 ASN H H 29 8.273 8.139 0.134 1
1 355 . 20 1 1 A 29 29 ASN HA H 29 4.584 4.433 0.151 1
1 360 . 20 1 1 A 29 29 ASN C C 29 176.200 177.229 -1.029 1
1 361 . 20 1 1 A 29 29 ASN CA C 29 54.400 55.579 -1.179 1
1 362 . 20 1 1 A 29 29 ASN CB C 29 38.280 38.261 0.019 1
1 363 . 20 1 1 A 29 29 ASN N N 29 117.500 117.190 0.310 1
1 365 . 20 1 1 A 30 30 MET H H 30 7.870 7.538 0.332 1
1 366 . 20 1 1 A 30 30 MET HA H 30 4.085 3.205 0.880 1
1 371 . 20 1 1 A 30 30 MET C C 30 177.000 177.830 -0.830 1
1 372 . 20 1 1 A 30 30 MET CA C 30 56.880 57.937 -1.057 1
1 373 . 20 1 1 A 30 30 MET CB C 30 32.340 31.747 0.593 1
1 375 . 20 1 1 A 30 30 MET N N 30 121.100 118.980 2.120 1
1 376 . 20 1 1 A 31 31 ASN H H 31 8.186 7.767 0.419 1
1 377 . 20 1 1 A 31 31 ASN HA H 31 4.311 4.399 -0.088 1
1 382 . 20 1 1 A 31 31 ASN C C 31 176.700 178.061 -1.361 1
1 383 . 20 1 1 A 31 31 ASN CA C 31 55.320 56.110 -0.790 1
1 384 . 20 1 1 A 31 31 ASN CB C 31 38.410 37.969 0.441 1
1 385 . 20 1 1 A 31 31 ASN N N 31 117.900 116.438 1.462 1
1 387 . 20 1 1 A 32 32 LYS H H 32 7.792 7.720 0.072 1
1 388 . 20 1 1 A 32 32 LYS HA H 32 3.992 3.929 0.063 1
1 397 . 20 1 1 A 32 32 LYS C C 32 177.900 179.281 -1.381 1
1 398 . 20 1 1 A 32 32 LYS CA C 32 59.050 59.263 -0.213 1
1 399 . 20 1 1 A 32 32 LYS CB C 32 32.460 32.318 0.142 1
1 403 . 20 1 1 A 32 32 LYS N N 32 120.400 119.748 0.652 1
1 404 . 20 1 1 A 33 33 VAL H H 33 7.689 8.600 -0.911 1
1 405 . 20 1 1 A 33 33 VAL HA H 33 3.791 3.940 -0.149 1
1 413 . 20 1 1 A 33 33 VAL C C 33 177.100 177.482 -0.382 1
1 414 . 20 1 1 A 33 33 VAL CA C 33 65.360 65.317 0.043 1
1 415 . 20 1 1 A 33 33 VAL CB C 33 31.920 31.601 0.319 1
1 418 . 20 1 1 A 33 33 VAL N N 33 120.200 115.070 5.130 1
1 419 . 20 1 1 A 34 34 ASP H H 34 8.408 8.327 0.081 1
1 420 . 20 1 1 A 34 34 ASP HA H 34 4.303 4.267 0.036 1
1 423 . 20 1 1 A 34 34 ASP C C 34 178.200 178.314 -0.114 1
1 424 . 20 1 1 A 34 34 ASP CA C 34 55.880 57.135 -1.255 1
1 425 . 20 1 1 A 34 34 ASP CB C 34 38.710 41.550 -2.840 1
1 426 . 20 1 1 A 34 34 ASP N N 34 120.100 121.328 -1.228 1
1 427 . 20 1 1 A 35 35 HIS H H 35 8.204 7.566 0.638 1
1 428 . 20 1 1 A 35 35 HIS HA H 35 4.343 4.206 0.137 1
1 431 . 20 1 1 A 35 35 HIS C C 35 176.800 177.085 -0.285 1
1 432 . 20 1 1 A 35 35 HIS CA C 35 58.310 58.664 -0.354 1
1 433 . 20 1 1 A 35 35 HIS CB C 35 28.070 29.601 -1.531 1
1 434 . 20 1 1 A 35 35 HIS N N 35 118.200 118.975 -0.775 1
1 435 . 20 1 1 A 36 36 HIS H H 36 8.067 7.879 0.188 1
1 436 . 20 1 1 A 36 36 HIS HA H 36 4.602 4.110 0.492 1
1 440 . 20 1 1 A 36 36 HIS C C 36 177.100 177.539 -0.439 1
1 441 . 20 1 1 A 36 36 HIS CA C 36 58.520 59.691 -1.171 1
1 442 . 20 1 1 A 36 36 HIS CB C 36 28.720 29.895 -1.175 1
1 443 . 20 1 1 A 36 36 HIS N N 36 117.100 116.775 0.325 1
1 444 . 20 1 1 A 37 37 LEU H H 37 8.473 8.573 -0.100 1
1 445 . 20 1 1 A 37 37 LEU HA H 37 3.894 3.575 0.319 1
1 455 . 20 1 1 A 37 37 LEU C C 37 178.200 178.870 -0.670 1
1 456 . 20 1 1 A 37 37 LEU CA C 37 58.520 57.848 0.672 1
1 457 . 20 1 1 A 37 37 LEU CB C 37 41.810 41.510 0.300 1
1 461 . 20 1 1 A 37 37 LEU N N 37 119.600 119.488 0.112 1
1 462 . 20 1 1 A 38 38 GLN H H 38 8.337 8.358 -0.021 1
1 463 . 20 1 1 A 38 38 GLN HA H 38 3.882 3.892 -0.010 1
1 470 . 20 1 1 A 38 38 GLN C C 38 178.500 177.743 0.757 1
1 471 . 20 1 1 A 38 38 GLN CA C 38 59.200 59.155 0.045 1
1 472 . 20 1 1 A 38 38 GLN CB C 38 27.850 28.154 -0.304 1
1 474 . 20 1 1 A 38 38 GLN N N 38 118.000 117.122 0.878 1
1 476 . 20 1 1 A 39 39 ASN H H 39 7.923 7.846 0.077 1
1 477 . 20 1 1 A 39 39 ASN HA H 39 4.390 4.392 -0.002 1
1 482 . 20 1 1 A 39 39 ASN C C 39 177.500 177.406 0.094 1
1 483 . 20 1 1 A 39 39 ASN CA C 39 55.780 55.517 0.263 1
1 484 . 20 1 1 A 39 39 ASN CB C 39 37.450 38.055 -0.605 1
1 485 . 20 1 1 A 39 39 ASN N N 39 118.700 117.312 1.388 1
1 487 . 20 1 1 A 40 40 VAL H H 40 7.907 8.183 -0.276 1
1 488 . 20 1 1 A 40 40 VAL HA H 40 3.629 3.533 0.096 1
1 496 . 20 1 1 A 40 40 VAL C C 40 177.500 177.952 -0.452 1
1 497 . 20 1 1 A 40 40 VAL CA C 40 67.080 66.076 1.004 1
1 498 . 20 1 1 A 40 40 VAL CB C 40 31.390 31.218 0.172 1
1 501 . 20 1 1 A 40 40 VAL N N 40 120.400 118.703 1.697 1
1 502 . 20 1 1 A 41 41 ILE H H 41 8.103 7.803 0.300 1
1 503 . 20 1 1 A 41 41 ILE HA H 41 3.401 3.685 -0.284 1
1 513 . 20 1 1 A 41 41 ILE C C 41 178.000 178.675 -0.675 1
1 514 . 20 1 1 A 41 41 ILE CA C 41 66.430 65.136 1.294 1
1 515 . 20 1 1 A 41 41 ILE CB C 41 38.050 37.622 0.428 1
1 519 . 20 1 1 A 41 41 ILE N N 41 120.600 119.234 1.366 1
1 520 . 20 1 1 A 42 42 GLU H H 42 8.150 8.047 0.103 1
1 521 . 20 1 1 A 42 42 GLU HA H 42 4.062 4.038 0.024 1
1 526 . 20 1 1 A 42 42 GLU C C 42 178.500 178.358 0.142 1
1 527 . 20 1 1 A 42 42 GLU CA C 42 59.120 59.248 -0.128 1
1 528 . 20 1 1 A 42 42 GLU CB C 42 28.160 29.229 -1.069 1
1 530 . 20 1 1 A 42 42 GLU N N 42 119.900 122.316 -2.416 1
1 531 . 20 1 1 A 43 43 ASP H H 43 8.453 8.694 -0.241 1
1 532 . 20 1 1 A 43 43 ASP HA H 43 4.445 4.452 -0.007 1
1 535 . 20 1 1 A 43 43 ASP C C 43 178.400 178.158 0.242 1
1 536 . 20 1 1 A 43 43 ASP CA C 43 56.490 56.476 0.014 1
1 537 . 20 1 1 A 43 43 ASP CB C 43 37.820 41.197 -3.377 1
1 538 . 20 1 1 A 43 43 ASP N N 43 119.700 120.135 -0.435 1
1 539 . 20 1 1 A 44 44 ILE H H 44 8.544 7.717 0.827 1
1 540 . 20 1 1 A 44 44 ILE HA H 44 3.590 3.997 -0.407 1
1 550 . 20 1 1 A 44 44 ILE C C 44 177.800 178.267 -0.467 1
1 551 . 20 1 1 A 44 44 ILE CA C 44 66.320 64.722 1.598 1
1 552 . 20 1 1 A 44 44 ILE CB C 44 37.690 37.937 -0.247 1
1 556 . 20 1 1 A 44 44 ILE N N 44 121.500 118.768 2.732 1
1 557 . 20 1 1 A 45 45 HIS H H 45 8.261 8.234 0.027 1
1 558 . 20 1 1 A 45 45 HIS HA H 45 4.255 4.123 0.132 1
1 562 . 20 1 1 A 45 45 HIS C C 45 177.200 177.313 -0.113 1
1 563 . 20 1 1 A 45 45 HIS CA C 45 59.580 59.644 -0.064 1
1 564 . 20 1 1 A 45 45 HIS CB C 45 27.790 30.124 -2.334 1
1 565 . 20 1 1 A 45 45 HIS N N 45 118.800 119.649 -0.849 1
1 566 . 20 1 1 A 46 46 ASP H H 46 8.680 7.829 0.851 1
1 567 . 20 1 1 A 46 46 ASP HA H 46 4.338 4.511 -0.173 1
1 570 . 20 1 1 A 46 46 ASP C C 46 178.700 177.812 0.888 1
1 571 . 20 1 1 A 46 46 ASP CA C 46 57.010 55.171 1.839 1
1 572 . 20 1 1 A 46 46 ASP CB C 46 39.400 40.884 -1.484 1
1 573 . 20 1 1 A 46 46 ASP N N 46 119.200 118.193 1.007 1
1 574 . 20 1 1 A 47 47 PHE H H 47 8.380 9.198 -0.818 1
1 575 . 20 1 1 A 47 47 PHE HA H 47 4.070 4.178 -0.108 1
1 580 . 20 1 1 A 47 47 PHE C C 47 178.600 177.866 0.734 1
1 581 . 20 1 1 A 47 47 PHE CA C 47 61.250 60.699 0.551 1
1 582 . 20 1 1 A 47 47 PHE CB C 47 39.570 39.160 0.410 1
1 583 . 20 1 1 A 47 47 PHE N N 47 121.800 120.804 0.996 1
1 584 . 20 1 1 A 48 48 MET H H 48 8.366 8.350 0.016 1
1 585 . 20 1 1 A 48 48 MET HA H 48 3.998 3.827 0.171 1
1 590 . 20 1 1 A 48 48 MET C C 48 177.400 178.022 -0.622 1
1 591 . 20 1 1 A 48 48 MET CA C 48 58.470 58.548 -0.078 1
1 592 . 20 1 1 A 48 48 MET CB C 48 33.170 32.006 1.164 1
1 594 . 20 1 1 A 48 48 MET N N 48 117.700 118.293 -0.593 1
1 595 . 20 1 1 A 49 49 GLN H H 49 7.659 8.154 -0.495 1
1 596 . 20 1 1 A 49 49 GLN HA H 49 4.258 4.058 0.200 1
1 603 . 20 1 1 A 49 49 GLN C C 49 176.700 178.202 -1.502 1
1 604 . 20 1 1 A 49 49 GLN CA C 49 56.380 57.928 -1.548 1
1 605 . 20 1 1 A 49 49 GLN CB C 49 28.980 28.409 0.571 1
1 607 . 20 1 1 A 49 49 GLN N N 49 116.700 116.335 0.365 1
1 609 . 20 1 1 A 50 50 GLY H H 50 7.685 8.145 -0.460 1
1 610 . 20 1 1 A 50 50 GLY HA2 H 50 3.998 3.788 0.210 1
1 611 . 20 1 1 A 50 50 GLY HA3 H 50 3.998 3.831 0.167 1
1 612 . 20 1 1 A 50 50 GLY C C 50 174.900 175.238 -0.338 1
1 613 . 20 1 1 A 50 50 GLY CA C 50 45.460 46.236 -0.776 1
1 614 . 20 1 1 A 50 50 GLY N N 50 106.400 108.774 -2.374 1
1 615 . 20 1 1 A 51 51 GLY H H 51 8.031 9.292 -1.261 1
1 616 . 20 1 1 A 51 51 GLY HA2 H 51 3.817 3.891 -0.074 1
1 617 . 20 1 1 A 51 51 GLY HA3 H 51 3.817 3.900 -0.083 1
1 618 . 20 1 1 A 51 51 GLY C C 51 174.500 174.569 -0.069 1
1 619 . 20 1 1 A 51 51 GLY CA C 51 45.190 45.496 -0.306 1
1 620 . 20 1 1 A 51 51 GLY N N 51 108.900 108.991 -0.091 1
1 621 . 20 1 1 A 52 52 GLY H H 52 8.126 8.267 -0.141 1
1 622 . 20 1 1 A 52 52 GLY HA2 H 52 3.362 3.705 -0.343 1
1 623 . 20 1 1 A 52 52 GLY HA3 H 52 3.362 3.987 -0.625 1
1 624 . 20 1 1 A 52 52 GLY C C 52 173.300 174.439 -1.139 1
1 625 . 20 1 1 A 52 52 GLY CA C 52 45.120 45.126 -0.006 1
1 626 . 20 1 1 A 52 52 GLY N N 52 108.100 107.675 0.425 1
1 627 . 20 1 1 A 53 53 SER H H 53 7.594 7.763 -0.169 1
1 628 . 20 1 1 A 53 53 SER HA H 53 4.530 4.667 -0.137 1
1 631 . 20 1 1 A 53 53 SER C C 53 175.300 175.162 0.138 1
1 632 . 20 1 1 A 53 53 SER CA C 53 57.770 57.224 0.546 1
1 633 . 20 1 1 A 53 53 SER CB C 53 64.750 61.246 3.504 1
1 634 . 20 1 1 A 53 53 SER N N 53 114.100 115.769 -1.669 1
1 635 . 20 1 1 A 54 54 GLY H H 54 9.003 8.638 0.365 1
1 636 . 20 1 1 A 54 54 GLY HA2 H 54 4.037 4.014 0.023 1
1 637 . 20 1 1 A 54 54 GLY HA3 H 54 3.911 4.162 -0.251 1
1 638 . 20 1 1 A 54 54 GLY C C 54 176.500 175.450 1.050 1
1 639 . 20 1 1 A 54 54 GLY CA C 54 47.040 47.051 -0.011 1
1 640 . 20 1 1 A 54 54 GLY N N 54 110.400 110.971 -0.571 1
1 641 . 20 1 1 A 55 55 GLY H H 55 8.617 8.263 0.354 1
1 642 . 20 1 1 A 55 55 GLY HA2 H 55 3.946 3.930 0.016 1
1 643 . 20 1 1 A 55 55 GLY HA3 H 55 3.946 3.948 -0.002 1
1 644 . 20 1 1 A 55 55 GLY C C 55 176.400 175.671 0.729 1
1 645 . 20 1 1 A 55 55 GLY CA C 55 46.630 46.939 -0.309 1
1 646 . 20 1 1 A 55 55 GLY N N 55 109.800 109.603 0.197 1
1 647 . 20 1 1 A 56 56 LYS H H 56 7.876 8.958 -1.082 1
1 648 . 20 1 1 A 56 56 LYS HA H 56 4.195 4.209 -0.014 1
1 657 . 20 1 1 A 56 56 LYS C C 56 178.600 178.887 -0.287 1
1 658 . 20 1 1 A 56 56 LYS CA C 56 57.960 58.534 -0.574 1
1 659 . 20 1 1 A 56 56 LYS CB C 56 32.110 31.814 0.296 1
1 663 . 20 1 1 A 56 56 LYS N N 56 121.800 121.829 -0.029 1
1 664 . 20 1 1 A 57 57 LEU H H 57 8.153 7.843 0.310 1
1 665 . 20 1 1 A 57 57 LEU HA H 57 3.992 4.119 -0.127 1
1 675 . 20 1 1 A 57 57 LEU C C 57 178.400 178.674 -0.274 1
1 676 . 20 1 1 A 57 57 LEU CA C 57 58.190 58.564 -0.374 1
1 677 . 20 1 1 A 57 57 LEU CB C 57 41.360 42.088 -0.728 1
1 681 . 20 1 1 A 57 57 LEU N N 57 120.700 121.668 -0.968 1
1 682 . 20 1 1 A 58 58 GLN H H 58 8.019 8.460 -0.441 1
1 683 . 20 1 1 A 58 58 GLN HA H 58 3.942 4.140 -0.198 1
1 690 . 20 1 1 A 58 58 GLN C C 58 179.100 178.395 0.705 1
1 691 . 20 1 1 A 58 58 GLN CA C 58 59.360 58.473 0.887 1
1 692 . 20 1 1 A 58 58 GLN CB C 58 28.030 28.344 -0.314 1
1 694 . 20 1 1 A 58 58 GLN N N 58 117.400 117.450 -0.050 1
1 696 . 20 1 1 A 59 59 GLU H H 59 7.838 7.886 -0.048 1
1 697 . 20 1 1 A 59 59 GLU HA H 59 4.030 4.144 -0.114 1
1 702 . 20 1 1 A 59 59 GLU C C 59 178.600 179.281 -0.681 1
1 703 . 20 1 1 A 59 59 GLU CA C 59 59.250 59.045 0.205 1
1 704 . 20 1 1 A 59 59 GLU CB C 59 28.960 29.883 -0.923 1
1 706 . 20 1 1 A 59 59 GLU N N 59 119.900 120.455 -0.555 1
1 707 . 20 1 1 A 60 60 MET H H 60 8.223 8.165 0.058 1
1 708 . 20 1 1 A 60 60 MET HA H 60 3.966 4.210 -0.244 1
1 713 . 20 1 1 A 60 60 MET C C 60 177.900 178.404 -0.504 1
1 714 . 20 1 1 A 60 60 MET CA C 60 59.350 57.996 1.354 1
1 715 . 20 1 1 A 60 60 MET CB C 60 33.210 32.378 0.832 1
1 717 . 20 1 1 A 60 60 MET N N 60 120.100 118.822 1.278 1
1 718 . 20 1 1 A 61 61 MET H H 61 8.134 8.326 -0.192 1
1 719 . 20 1 1 A 61 61 MET HA H 61 4.195 4.211 -0.016 1
1 724 . 20 1 1 A 61 61 MET C C 61 179.100 178.104 0.996 1
1 725 . 20 1 1 A 61 61 MET CA C 61 58.210 58.937 -0.727 1
1 726 . 20 1 1 A 61 61 MET CB C 61 31.340 32.008 -0.668 1
1 728 . 20 1 1 A 61 61 MET N N 61 117.000 119.648 -2.648 1
1 729 . 20 1 1 A 62 62 LYS H H 62 7.782 8.268 -0.486 1
1 730 . 20 1 1 A 62 62 LYS HA H 62 4.085 3.959 0.126 1
1 739 . 20 1 1 A 62 62 LYS C C 62 179.600 178.794 0.806 1
1 740 . 20 1 1 A 62 62 LYS CA C 62 59.610 60.091 -0.481 1
1 741 . 20 1 1 A 62 62 LYS CB C 62 32.180 32.337 -0.157 1
1 745 . 20 1 1 A 62 62 LYS N N 62 120.600 118.782 1.818 1
1 746 . 20 1 1 A 63 63 GLU H H 63 8.041 8.029 0.012 1
1 747 . 20 1 1 A 63 63 GLU HA H 63 4.057 3.937 0.120 1
1 752 . 20 1 1 A 63 63 GLU C C 63 178.900 178.860 0.040 1
1 753 . 20 1 1 A 63 63 GLU CA C 63 59.170 58.967 0.203 1
1 754 . 20 1 1 A 63 63 GLU CB C 63 29.000 29.073 -0.073 1
1 756 . 20 1 1 A 63 63 GLU N N 63 120.200 119.207 0.993 1
1 757 . 20 1 1 A 64 64 PHE H H 64 8.604 8.898 -0.294 1
1 758 . 20 1 1 A 64 64 PHE HA H 64 4.155 3.816 0.339 1
1 763 . 20 1 1 A 64 64 PHE C C 64 177.800 177.518 0.282 1
1 764 . 20 1 1 A 64 64 PHE CA C 64 59.820 61.029 -1.209 1
1 765 . 20 1 1 A 64 64 PHE CB C 64 38.470 38.488 -0.018 1
1 766 . 20 1 1 A 64 64 PHE N N 64 119.700 120.633 -0.933 1
1 767 . 20 1 1 A 65 65 GLN H H 65 8.177 8.342 -0.165 1
1 768 . 20 1 1 A 65 65 GLN HA H 65 3.637 4.039 -0.402 1
1 775 . 20 1 1 A 65 65 GLN C C 65 177.800 177.412 0.388 1
1 776 . 20 1 1 A 65 65 GLN CA C 65 58.970 58.116 0.854 1
1 777 . 20 1 1 A 65 65 GLN CB C 65 28.280 28.702 -0.422 1
1 779 . 20 1 1 A 65 65 GLN N N 65 118.500 118.216 0.284 1
1 781 . 20 1 1 A 66 66 GLN H H 66 7.622 7.724 -0.102 1
1 782 . 20 1 1 A 66 66 GLN HA H 66 4.040 4.122 -0.082 1
1 789 . 20 1 1 A 66 66 GLN C C 66 178.600 178.054 0.546 1
1 790 . 20 1 1 A 66 66 GLN CA C 66 59.150 58.223 0.927 1
1 791 . 20 1 1 A 66 66 GLN CB C 66 28.230 28.331 -0.101 1
1 793 . 20 1 1 A 66 66 GLN N N 66 117.400 117.966 -0.566 1
1 795 . 20 1 1 A 67 67 VAL H H 67 7.744 7.761 -0.017 1
1 796 . 20 1 1 A 67 67 VAL HA H 67 3.785 3.815 -0.030 1
1 804 . 20 1 1 A 67 67 VAL C C 67 177.500 177.738 -0.238 1
1 805 . 20 1 1 A 67 67 VAL CA C 67 66.220 66.063 0.157 1
1 806 . 20 1 1 A 67 67 VAL CB C 67 31.390 31.983 -0.593 1
1 809 . 20 1 1 A 67 67 VAL N N 67 119.500 120.704 -1.204 1
1 810 . 20 1 1 A 68 68 LEU H H 68 7.983 7.927 0.056 1
1 811 . 20 1 1 A 68 68 LEU HA H 68 3.825 3.991 -0.166 1
1 821 . 20 1 1 A 68 68 LEU C C 68 179.100 178.152 0.948 1
1 822 . 20 1 1 A 68 68 LEU CA C 68 58.740 58.124 0.616 1
1 823 . 20 1 1 A 68 68 LEU CB C 68 41.090 41.965 -0.875 1
1 827 . 20 1 1 A 68 68 LEU N N 68 120.400 120.112 0.288 1
1 828 . 20 1 1 A 69 69 ASP H H 69 8.179 8.221 -0.042 1
1 829 . 20 1 1 A 69 69 ASP HA H 69 4.380 4.419 -0.039 1
1 832 . 20 1 1 A 69 69 ASP C C 69 178.900 178.565 0.335 1
1 833 . 20 1 1 A 69 69 ASP CA C 69 57.320 56.649 0.671 1
1 834 . 20 1 1 A 69 69 ASP CB C 69 40.040 40.647 -0.607 1
1 835 . 20 1 1 A 69 69 ASP N N 69 119.000 118.154 0.846 1
1 836 . 20 1 1 A 70 70 GLU H H 70 8.166 8.153 0.013 1
1 837 . 20 1 1 A 70 70 GLU HA H 70 4.082 4.173 -0.091 1
1 842 . 20 1 1 A 70 70 GLU C C 70 179.600 179.024 0.576 1
1 843 . 20 1 1 A 70 70 GLU CA C 70 59.010 59.064 -0.054 1
1 844 . 20 1 1 A 70 70 GLU CB C 70 28.900 29.610 -0.710 1
1 846 . 20 1 1 A 70 70 GLU N N 70 120.500 118.926 1.574 1
1 847 . 20 1 1 A 71 71 ILE H H 71 8.415 8.340 0.075 1
1 848 . 20 1 1 A 71 71 ILE HA H 71 3.790 3.494 0.296 1
1 858 . 20 1 1 A 71 71 ILE C C 71 177.400 177.805 -0.405 1
1 859 . 20 1 1 A 71 71 ILE CA C 71 64.890 65.087 -0.197 1
1 860 . 20 1 1 A 71 71 ILE CB C 71 37.680 37.471 0.209 1
1 864 . 20 1 1 A 71 71 ILE N N 71 119.200 119.816 -0.616 1
1 865 . 20 1 1 A 72 72 LYS H H 72 8.248 7.969 0.279 1
1 866 . 20 1 1 A 72 72 LYS HA H 72 3.625 3.319 0.306 1
1 873 . 20 1 1 A 72 72 LYS C C 72 178.400 178.056 0.344 1
1 874 . 20 1 1 A 72 72 LYS CA C 72 59.850 59.296 0.554 1
1 875 . 20 1 1 A 72 72 LYS CB C 72 32.070 32.148 -0.078 1
1 879 . 20 1 1 A 72 72 LYS N N 72 120.800 121.137 -0.337 1
1 880 . 20 1 1 A 73 73 GLN H H 73 7.937 7.390 0.547 1
1 881 . 20 1 1 A 73 73 GLN HA H 73 4.042 4.019 0.023 1
1 888 . 20 1 1 A 73 73 GLN C C 73 178.400 178.618 -0.218 1
1 889 . 20 1 1 A 73 73 GLN CA C 73 58.510 59.072 -0.562 1
1 890 . 20 1 1 A 73 73 GLN CB C 73 28.430 28.140 0.290 1
1 892 . 20 1 1 A 73 73 GLN N N 73 117.000 118.421 -1.421 1
1 894 . 20 1 1 A 74 74 GLN H H 74 7.712 8.429 -0.717 1
1 895 . 20 1 1 A 74 74 GLN HA H 74 4.080 3.972 0.108 1
1 902 . 20 1 1 A 74 74 GLN C C 74 177.800 178.031 -0.231 1
1 903 . 20 1 1 A 74 74 GLN CA C 74 57.270 58.349 -1.079 1
1 904 . 20 1 1 A 74 74 GLN CB C 74 28.700 28.064 0.636 1
1 906 . 20 1 1 A 74 74 GLN N N 74 118.200 120.110 -1.910 1
1 908 . 20 1 1 A 75 75 LEU H H 75 7.956 7.484 0.472 1
1 909 . 20 1 1 A 75 75 LEU HA H 75 4.212 4.442 -0.230 1
1 919 . 20 1 1 A 75 75 LEU CA C 75 56.660 55.388 1.272 1
1 920 . 20 1 1 A 75 75 LEU CB C 75 42.000 40.779 1.221 1
1 924 . 20 1 1 A 75 75 LEU N N 75 120.700 118.400 2.300 1
1 925 . 20 1 1 A 76 76 GLN H H 76 8.315 7.333 0.982 1
1 926 . 20 1 1 A 76 76 GLN HA H 76 4.113 4.231 -0.118 1
1 933 . 20 1 1 A 76 76 GLN C C 76 177.100 176.149 0.951 1
1 934 . 20 1 1 A 76 76 GLN CA C 76 57.400 56.244 1.156 1
1 935 . 20 1 1 A 76 76 GLN CB C 76 28.640 29.056 -0.416 1
1 937 . 20 1 1 A 76 76 GLN N N 76 120.100 119.161 0.939 1
1 939 . 20 1 1 A 77 77 GLY H H 77 8.021 7.508 0.513 1
1 940 . 20 1 1 A 77 77 GLY HA2 H 77 4.042 4.093 -0.051 1
1 941 . 20 1 1 A 77 77 GLY HA3 H 77 3.869 4.098 -0.229 1
1 942 . 20 1 1 A 77 77 GLY C C 77 174.600 174.114 0.486 1
1 943 . 20 1 1 A 77 77 GLY CA C 77 45.430 45.013 0.417 1
1 944 . 20 1 1 A 77 77 GLY N N 77 107.700 106.986 0.714 1
1 945 . 20 1 1 A 78 78 GLY H H 78 7.819 8.522 -0.703 1
1 946 . 20 1 1 A 78 78 GLY HA2 H 78 4.208 4.001 0.207 1
1 947 . 20 1 1 A 78 78 GLY HA3 H 78 3.801 4.010 -0.209 1
1 948 . 20 1 1 A 78 78 GLY C C 78 173.900 174.261 -0.361 1
1 949 . 20 1 1 A 78 78 GLY CA C 78 45.140 45.239 -0.099 1
1 950 . 20 1 1 A 78 78 GLY N N 78 107.100 112.925 -5.825 1
1 951 . 20 1 1 A 79 79 ASP H H 79 7.912 8.294 -0.382 1
1 952 . 20 1 1 A 79 79 ASP HA H 79 4.722 4.506 0.216 1
1 955 . 20 1 1 A 79 79 ASP C C 79 176.200 176.244 -0.044 1
1 956 . 20 1 1 A 79 79 ASP CA C 79 53.210 54.034 -0.824 1
1 957 . 20 1 1 A 79 79 ASP CB C 79 40.160 39.804 0.356 1
1 958 . 20 1 1 A 79 79 ASP N N 79 119.800 121.602 -1.802 1
1 959 . 20 1 1 A 80 80 ASN H H 80 8.450 9.049 -0.599 1
1 960 . 20 1 1 A 80 80 ASN HA H 80 4.593 4.612 -0.019 1
1 965 . 20 1 1 A 80 80 ASN C C 80 177.300 177.116 0.184 1
1 966 . 20 1 1 A 80 80 ASN CA C 80 54.680 55.500 -0.820 1
1 967 . 20 1 1 A 80 80 ASN CB C 80 38.790 38.223 0.567 1
1 968 . 20 1 1 A 80 80 ASN N N 80 121.700 120.558 1.142 1
1 970 . 20 1 1 A 81 81 SER H H 81 8.444 8.150 0.294 1
1 971 . 20 1 1 A 81 81 SER HA H 81 4.263 4.160 0.103 1
1 974 . 20 1 1 A 81 81 SER C C 81 176.100 176.706 -0.606 1
1 975 . 20 1 1 A 81 81 SER CA C 81 61.470 61.816 -0.346 1
1 976 . 20 1 1 A 81 81 SER CB C 81 61.470 62.796 -1.326 1
1 977 . 20 1 1 A 81 81 SER N N 81 117.100 116.078 1.022 1
1 978 . 20 1 1 A 82 82 LEU H H 82 7.929 8.513 -0.584 1
1 979 . 20 1 1 A 82 82 LEU HA H 82 4.332 3.983 0.349 1
1 989 . 20 1 1 A 82 82 LEU C C 82 177.400 179.350 -1.950 1
1 990 . 20 1 1 A 82 82 LEU CA C 82 55.060 57.809 -2.749 1
1 991 . 20 1 1 A 82 82 LEU CB C 82 41.940 41.822 0.118 1
1 995 . 20 1 1 A 82 82 LEU N N 82 120.400 121.388 -0.988 1
1 996 . 20 1 1 A 83 83 HIS H H 83 8.014 7.782 0.232 1
1 997 . 20 1 1 A 83 83 HIS HA H 83 4.173 4.217 -0.044 1
1 1000 . 20 1 1 A 83 83 HIS C C 83 176.100 176.484 -0.384 1
1 1001 . 20 1 1 A 83 83 HIS CA C 83 59.940 58.897 1.043 1
1 1002 . 20 1 1 A 83 83 HIS CB C 83 28.050 29.753 -1.703 1
1 1003 . 20 1 1 A 83 83 HIS N N 83 119.400 118.497 0.903 1
1 1004 . 20 1 1 A 84 84 ASN H H 84 8.598 8.034 0.564 1
1 1005 . 20 1 1 A 84 84 ASN HA H 84 4.735 4.731 0.004 1
1 1010 . 20 1 1 A 84 84 ASN C C 84 177.400 177.019 0.381 1
1 1011 . 20 1 1 A 84 84 ASN CA C 84 55.790 54.563 1.227 1
1 1012 . 20 1 1 A 84 84 ASN CB C 84 37.520 39.112 -1.592 1
1 1013 . 20 1 1 A 84 84 ASN N N 84 118.100 117.814 0.286 1
1 1015 . 20 1 1 A 85 85 VAL H H 85 7.933 7.819 0.114 1
1 1016 . 20 1 1 A 85 85 VAL HA H 85 3.849 3.809 0.040 1
1 1024 . 20 1 1 A 85 85 VAL C C 85 177.100 177.922 -0.822 1
1 1025 . 20 1 1 A 85 85 VAL CA C 85 65.490 65.513 -0.023 1
1 1026 . 20 1 1 A 85 85 VAL CB C 85 31.760 31.919 -0.159 1
1 1029 . 20 1 1 A 85 85 VAL N N 85 120.500 119.777 0.723 1
1 1030 . 20 1 1 A 86 86 HIS H H 86 8.460 9.345 -0.885 1
1 1031 . 20 1 1 A 86 86 HIS HA H 86 4.054 4.094 -0.040 1
1 1035 . 20 1 1 A 86 86 HIS C C 86 176.300 177.220 -0.920 1
1 1036 . 20 1 1 A 86 86 HIS CA C 86 59.860 59.615 0.245 1
1 1037 . 20 1 1 A 86 86 HIS CB C 86 29.670 30.105 -0.435 1
1 1038 . 20 1 1 A 86 86 HIS N N 86 119.300 119.298 0.002 1
1 1039 . 20 1 1 A 87 87 GLU H H 87 7.897 8.286 -0.389 1
1 1040 . 20 1 1 A 87 87 GLU HA H 87 3.838 4.103 -0.265 1
1 1045 . 20 1 1 A 87 87 GLU C C 87 178.300 179.522 -1.222 1
1 1046 . 20 1 1 A 87 87 GLU CA C 87 58.690 58.650 0.040 1
1 1047 . 20 1 1 A 87 87 GLU CB C 87 28.460 29.225 -0.765 1
1 1049 . 20 1 1 A 87 87 GLU N N 87 117.100 118.866 -1.766 1
1 1050 . 20 1 1 A 88 88 ASN H H 88 8.103 9.007 -0.904 1
1 1051 . 20 1 1 A 88 88 ASN HA H 88 4.503 4.492 0.011 1
1 1056 . 20 1 1 A 88 88 ASN C C 88 177.700 177.851 -0.151 1
1 1057 . 20 1 1 A 88 88 ASN CA C 88 55.990 56.199 -0.209 1
1 1058 . 20 1 1 A 88 88 ASN CB C 88 39.010 38.443 0.567 1
1 1059 . 20 1 1 A 88 88 ASN N N 88 118.400 118.460 -0.060 1
1 1061 . 20 1 1 A 89 89 ILE H H 89 8.501 8.151 0.350 1
1 1062 . 20 1 1 A 89 89 ILE HA H 89 3.670 3.727 -0.057 1
1 1072 . 20 1 1 A 89 89 ILE C C 89 177.000 178.113 -1.113 1
1 1073 . 20 1 1 A 89 89 ILE CA C 89 65.390 65.190 0.200 1
1 1074 . 20 1 1 A 89 89 ILE CB C 89 37.440 37.616 -0.176 1
1 1078 . 20 1 1 A 89 89 ILE N N 89 118.700 119.482 -0.782 1
1 1079 . 20 1 1 A 90 90 LYS H H 90 8.017 8.040 -0.023 1
1 1080 . 20 1 1 A 90 90 LYS HA H 90 3.775 3.909 -0.134 1
1 1089 . 20 1 1 A 90 90 LYS C C 90 178.800 178.990 -0.190 1
1 1090 . 20 1 1 A 90 90 LYS CA C 90 60.450 59.938 0.512 1
1 1091 . 20 1 1 A 90 90 LYS CB C 90 32.110 32.303 -0.193 1
1 1095 . 20 1 1 A 90 90 LYS N N 90 120.900 119.471 1.429 1
1 1096 . 20 1 1 A 91 91 GLU H H 91 7.732 7.854 -0.122 1
1 1097 . 20 1 1 A 91 91 GLU HA H 91 4.083 4.015 0.068 1
1 1102 . 20 1 1 A 91 91 GLU C C 91 179.100 179.228 -0.128 1
1 1103 . 20 1 1 A 91 91 GLU CA C 91 59.120 58.739 0.381 1
1 1104 . 20 1 1 A 91 91 GLU CB C 91 28.810 29.454 -0.644 1
1 1106 . 20 1 1 A 91 91 GLU N N 91 119.300 118.502 0.798 1
1 1107 . 20 1 1 A 92 92 ILE H H 92 8.110 9.101 -0.991 1
1 1108 . 20 1 1 A 92 92 ILE HA H 92 3.685 3.770 -0.085 1
1 1118 . 20 1 1 A 92 92 ILE C C 92 178.000 177.903 0.097 1
1 1119 . 20 1 1 A 92 92 ILE CA C 92 65.900 65.388 0.512 1
1 1120 . 20 1 1 A 92 92 ILE CB C 92 38.400 37.980 0.420 1
1 1124 . 20 1 1 A 92 92 ILE N N 92 121.100 120.466 0.634 1
1 1125 . 20 1 1 A 93 93 PHE H H 93 8.651 9.489 -0.838 1
1 1126 . 20 1 1 A 93 93 PHE HA H 93 3.873 3.170 0.703 1
1 1133 . 20 1 1 A 93 93 PHE C C 93 177.100 177.919 -0.819 1
1 1134 . 20 1 1 A 93 93 PHE CA C 93 61.020 60.797 0.223 1
1 1135 . 20 1 1 A 93 93 PHE CB C 93 38.560 38.594 -0.034 1
1 1138 . 20 1 1 A 93 93 PHE N N 93 119.400 120.926 -1.526 1
1 1139 . 20 1 1 A 94 94 HIS H H 94 8.126 7.382 0.744 1
1 1140 . 20 1 1 A 94 94 HIS HA H 94 4.368 3.762 0.606 1
1 1145 . 20 1 1 A 94 94 HIS C C 94 177.100 176.513 0.587 1
1 1146 . 20 1 1 A 94 94 HIS CA C 94 58.310 57.078 1.232 1
1 1147 . 20 1 1 A 94 94 HIS CB C 94 27.910 29.971 -2.061 1
1 1148 . 20 1 1 A 94 94 HIS N N 94 116.400 117.881 -1.481 1
1 1149 . 20 1 1 A 95 95 HIS H H 95 8.058 8.104 -0.046 1
1 1150 . 20 1 1 A 95 95 HIS HA H 95 4.465 4.110 0.355 1
1 1154 . 20 1 1 A 95 95 HIS C C 95 177.300 177.811 -0.511 1
1 1155 . 20 1 1 A 95 95 HIS CA C 95 57.900 59.299 -1.399 1
1 1156 . 20 1 1 A 95 95 HIS CB C 95 28.490 30.529 -2.039 1
1 1157 . 20 1 1 A 95 95 HIS N N 95 117.000 115.401 1.599 1
1 1158 . 20 1 1 A 96 96 LEU H H 96 8.525 7.793 0.732 1
1 1159 . 20 1 1 A 96 96 LEU HA H 96 3.865 3.909 -0.044 1
1 1169 . 20 1 1 A 96 96 LEU C C 96 178.300 178.575 -0.275 1
1 1170 . 20 1 1 A 96 96 LEU CA C 96 58.250 57.961 0.289 1
1 1171 . 20 1 1 A 96 96 LEU CB C 96 41.720 41.971 -0.251 1
1 1175 . 20 1 1 A 96 96 LEU N N 96 121.300 121.192 0.108 1
1 1176 . 20 1 1 A 97 97 GLU H H 97 8.076 8.317 -0.241 1
1 1177 . 20 1 1 A 97 97 GLU HA H 97 3.719 4.117 -0.398 1
1 1182 . 20 1 1 A 97 97 GLU C C 97 178.300 178.765 -0.465 1
1 1183 . 20 1 1 A 97 97 GLU CA C 97 59.300 58.653 0.647 1
1 1184 . 20 1 1 A 97 97 GLU CB C 97 28.960 29.683 -0.723 1
1 1186 . 20 1 1 A 97 97 GLU N N 97 117.100 118.641 -1.541 1
1 1187 . 20 1 1 A 98 98 GLU H H 98 7.329 7.739 -0.410 1
1 1188 . 20 1 1 A 98 98 GLU HA H 98 4.024 4.197 -0.173 1
1 1193 . 20 1 1 A 98 98 GLU C C 98 177.900 179.060 -1.160 1
1 1194 . 20 1 1 A 98 98 GLU CA C 98 58.190 58.590 -0.400 1
1 1195 . 20 1 1 A 98 98 GLU CB C 98 29.120 29.530 -0.410 1
1 1197 . 20 1 1 A 98 98 GLU N N 98 116.000 119.235 -3.235 1
1 1198 . 20 1 1 A 99 99 LEU H H 99 7.535 8.303 -0.768 1
1 1199 . 20 1 1 A 99 99 LEU HA H 99 4.183 4.088 0.095 1
1 1209 . 20 1 1 A 99 99 LEU C C 99 178.100 178.228 -0.128 1
1 1210 . 20 1 1 A 99 99 LEU CA C 99 56.440 57.760 -1.320 1
1 1211 . 20 1 1 A 99 99 LEU CB C 99 43.010 41.380 1.630 1
1 1215 . 20 1 1 A 99 99 LEU N N 99 118.200 120.340 -2.140 1
1 1216 . 20 1 1 A 100 100 VAL H H 100 7.561 7.212 0.349 1
1 1217 . 20 1 1 A 100 100 VAL HA H 100 4.033 4.183 -0.150 1
1 1225 . 20 1 1 A 100 100 VAL C C 100 175.400 178.001 -2.601 1
1 1226 . 20 1 1 A 100 100 VAL CA C 100 62.430 64.611 -2.181 1
1 1227 . 20 1 1 A 100 100 VAL CB C 100 32.050 32.316 -0.266 1
1 1230 . 20 1 1 A 100 100 VAL N N 100 114.800 114.257 0.543 1
1 1231 . 20 1 1 A 101 101 HIS H H 101 7.827 7.982 -0.155 1
1 1232 . 20 1 1 A 101 101 HIS HA H 101 4.630 4.203 0.427 1
1 1237 . 20 1 1 A 101 101 HIS C C 101 173.500 175.148 -1.648 1
1 1238 . 20 1 1 A 101 101 HIS CA C 101 55.410 59.162 -3.752 1
1 1239 . 20 1 1 A 101 101 HIS CB C 101 28.870 30.130 -1.260 1
1 1240 . 20 1 1 A 101 101 HIS N N 101 120.300 123.093 -2.793 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 98 0.773 1
2 1 1 1 "RMS(OBS, PRED)" CA 100 0.915 1
3 1 1 1 "RMS(OBS, PRED)" CB 90 1.029 1
4 1 1 1 "RMS(OBS, PRED)" H 100 0.557 1
5 1 1 1 "RMS(OBS, PRED)" HA 110 0.251 1
6 1 1 1 "RMS(OBS, PRED)" N 99 1.727 1
7 1 2 1 "RMS(OBS, PRED)" C 98 0.738 1
8 1 2 1 "RMS(OBS, PRED)" CA 100 1.054 1
9 1 2 1 "RMS(OBS, PRED)" CB 90 0.981 1
10 1 2 1 "RMS(OBS, PRED)" H 100 0.567 1
11 1 2 1 "RMS(OBS, PRED)" HA 110 0.270 1
12 1 2 1 "RMS(OBS, PRED)" N 99 1.611 1
13 1 3 1 "RMS(OBS, PRED)" C 98 0.788 1
14 1 3 1 "RMS(OBS, PRED)" CA 100 1.028 1
15 1 3 1 "RMS(OBS, PRED)" CB 90 1.159 1
16 1 3 1 "RMS(OBS, PRED)" H 100 0.596 1
17 1 3 1 "RMS(OBS, PRED)" HA 110 0.255 1
18 1 3 1 "RMS(OBS, PRED)" N 99 1.593 1
19 1 4 1 "RMS(OBS, PRED)" C 98 0.814 1
20 1 4 1 "RMS(OBS, PRED)" CA 100 1.081 1
21 1 4 1 "RMS(OBS, PRED)" CB 90 1.103 1
22 1 4 1 "RMS(OBS, PRED)" H 100 0.585 1
23 1 4 1 "RMS(OBS, PRED)" HA 110 0.258 1
24 1 4 1 "RMS(OBS, PRED)" N 99 1.578 1
25 1 5 1 "RMS(OBS, PRED)" C 98 0.766 1
26 1 5 1 "RMS(OBS, PRED)" CA 100 0.992 1
27 1 5 1 "RMS(OBS, PRED)" CB 90 1.139 1
28 1 5 1 "RMS(OBS, PRED)" H 100 0.552 1
29 1 5 1 "RMS(OBS, PRED)" HA 110 0.280 1
30 1 5 1 "RMS(OBS, PRED)" N 99 1.590 1
31 1 6 1 "RMS(OBS, PRED)" C 98 0.742 1
32 1 6 1 "RMS(OBS, PRED)" CA 100 1.014 1
33 1 6 1 "RMS(OBS, PRED)" CB 90 1.161 1
34 1 6 1 "RMS(OBS, PRED)" H 100 0.535 1
35 1 6 1 "RMS(OBS, PRED)" HA 110 0.265 1
36 1 6 1 "RMS(OBS, PRED)" N 99 1.628 1
37 1 7 1 "RMS(OBS, PRED)" C 98 0.767 1
38 1 7 1 "RMS(OBS, PRED)" CA 100 0.950 1
39 1 7 1 "RMS(OBS, PRED)" CB 90 1.122 1
40 1 7 1 "RMS(OBS, PRED)" H 100 0.589 1
41 1 7 1 "RMS(OBS, PRED)" HA 110 0.305 1
42 1 7 1 "RMS(OBS, PRED)" N 99 1.637 1
43 1 8 1 "RMS(OBS, PRED)" C 98 0.718 1
44 1 8 1 "RMS(OBS, PRED)" CA 100 0.971 1
45 1 8 1 "RMS(OBS, PRED)" CB 90 1.204 1
46 1 8 1 "RMS(OBS, PRED)" H 100 0.513 1
47 1 8 1 "RMS(OBS, PRED)" HA 110 0.254 1
48 1 8 1 "RMS(OBS, PRED)" N 99 1.581 1
49 1 9 1 "RMS(OBS, PRED)" C 98 0.726 1
50 1 9 1 "RMS(OBS, PRED)" CA 100 1.045 1
51 1 9 1 "RMS(OBS, PRED)" CB 90 1.107 1
52 1 9 1 "RMS(OBS, PRED)" H 100 0.530 1
53 1 9 1 "RMS(OBS, PRED)" HA 110 0.256 1
54 1 9 1 "RMS(OBS, PRED)" N 99 1.817 1
55 1 10 1 "RMS(OBS, PRED)" C 98 0.743 1
56 1 10 1 "RMS(OBS, PRED)" CA 100 0.945 1
57 1 10 1 "RMS(OBS, PRED)" CB 90 1.120 1
58 1 10 1 "RMS(OBS, PRED)" H 100 0.525 1
59 1 10 1 "RMS(OBS, PRED)" HA 110 0.249 1
60 1 10 1 "RMS(OBS, PRED)" N 99 1.753 1
61 1 11 1 "RMS(OBS, PRED)" C 98 0.780 1
62 1 11 1 "RMS(OBS, PRED)" CA 100 0.961 1
63 1 11 1 "RMS(OBS, PRED)" CB 90 1.091 1
64 1 11 1 "RMS(OBS, PRED)" H 100 0.560 1
65 1 11 1 "RMS(OBS, PRED)" HA 110 0.260 1
66 1 11 1 "RMS(OBS, PRED)" N 99 1.576 1
67 1 12 1 "RMS(OBS, PRED)" C 98 0.829 1
68 1 12 1 "RMS(OBS, PRED)" CA 100 0.945 1
69 1 12 1 "RMS(OBS, PRED)" CB 90 1.054 1
70 1 12 1 "RMS(OBS, PRED)" H 100 0.561 1
71 1 12 1 "RMS(OBS, PRED)" HA 110 0.266 1
72 1 12 1 "RMS(OBS, PRED)" N 99 1.661 1
73 1 13 1 "RMS(OBS, PRED)" C 98 0.832 1
74 1 13 1 "RMS(OBS, PRED)" CA 100 1.025 1
75 1 13 1 "RMS(OBS, PRED)" CB 90 1.105 1
76 1 13 1 "RMS(OBS, PRED)" H 100 0.488 1
77 1 13 1 "RMS(OBS, PRED)" HA 110 0.263 1
78 1 13 1 "RMS(OBS, PRED)" N 99 1.532 1
79 1 14 1 "RMS(OBS, PRED)" C 98 0.811 1
80 1 14 1 "RMS(OBS, PRED)" CA 100 1.008 1
81 1 14 1 "RMS(OBS, PRED)" CB 90 1.031 1
82 1 14 1 "RMS(OBS, PRED)" H 100 0.521 1
83 1 14 1 "RMS(OBS, PRED)" HA 110 0.278 1
84 1 14 1 "RMS(OBS, PRED)" N 99 1.595 1
85 1 15 1 "RMS(OBS, PRED)" C 98 0.741 1
86 1 15 1 "RMS(OBS, PRED)" CA 100 0.854 1
87 1 15 1 "RMS(OBS, PRED)" CB 90 1.074 1
88 1 15 1 "RMS(OBS, PRED)" H 100 0.518 1
89 1 15 1 "RMS(OBS, PRED)" HA 110 0.281 1
90 1 15 1 "RMS(OBS, PRED)" N 99 1.691 1
91 1 16 1 "RMS(OBS, PRED)" C 98 0.812 1
92 1 16 1 "RMS(OBS, PRED)" CA 100 1.042 1
93 1 16 1 "RMS(OBS, PRED)" CB 90 1.038 1
94 1 16 1 "RMS(OBS, PRED)" H 100 0.558 1
95 1 16 1 "RMS(OBS, PRED)" HA 110 0.265 1
96 1 16 1 "RMS(OBS, PRED)" N 99 1.597 1
97 1 17 1 "RMS(OBS, PRED)" C 98 0.789 1
98 1 17 1 "RMS(OBS, PRED)" CA 100 0.982 1
99 1 17 1 "RMS(OBS, PRED)" CB 90 1.017 1
100 1 17 1 "RMS(OBS, PRED)" H 100 0.543 1
101 1 17 1 "RMS(OBS, PRED)" HA 110 0.267 1
102 1 17 1 "RMS(OBS, PRED)" N 99 1.778 1
103 1 18 1 "RMS(OBS, PRED)" C 98 0.763 1
104 1 18 1 "RMS(OBS, PRED)" CA 100 0.984 1
105 1 18 1 "RMS(OBS, PRED)" CB 90 1.104 1
106 1 18 1 "RMS(OBS, PRED)" H 100 0.573 1
107 1 18 1 "RMS(OBS, PRED)" HA 110 0.269 1
108 1 18 1 "RMS(OBS, PRED)" N 99 1.670 1
109 1 19 1 "RMS(OBS, PRED)" C 98 0.786 1
110 1 19 1 "RMS(OBS, PRED)" CA 100 1.025 1
111 1 19 1 "RMS(OBS, PRED)" CB 90 1.103 1
112 1 19 1 "RMS(OBS, PRED)" H 100 0.525 1
113 1 19 1 "RMS(OBS, PRED)" HA 110 0.270 1
114 1 19 1 "RMS(OBS, PRED)" N 99 1.565 1
115 1 20 1 "RMS(OBS, PRED)" C 98 0.746 1
116 1 20 1 "RMS(OBS, PRED)" CA 100 0.972 1
117 1 20 1 "RMS(OBS, PRED)" CB 90 1.059 1
118 1 20 1 "RMS(OBS, PRED)" H 100 0.543 1
119 1 20 1 "RMS(OBS, PRED)" HA 110 0.238 1
120 1 20 1 "RMS(OBS, PRED)" N 99 1.741 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 10 . 1 1 A 2 2 TYR H H 2 8.688 7.376 1.312 2
1 11 . 1 1 A 2 2 TYR HA H 2 4.737 4.227 0.510 2
1 16 . 1 1 A 2 2 TYR C C 2 175.900 176.258 -0.358 2
1 17 . 1 1 A 2 2 TYR CA C 2 57.920 60.432 -2.512 2
1 18 . 1 1 A 2 2 TYR CB C 2 38.340 38.763 -0.423 2
1 19 . 1 1 A 2 2 TYR N N 2 122.100 123.662 -1.562 2
1 20 . 1 1 A 3 3 GLY H H 3 8.434 8.212 0.222 2
1 21 . 1 1 A 3 3 GLY HA2 H 3 3.909 4.032 -0.123 2
1 22 . 1 1 A 3 3 GLY HA3 H 3 3.841 4.065 -0.224 2
1 23 . 1 1 A 3 3 GLY C C 3 174.300 175.923 -1.623 2
1 24 . 1 1 A 3 3 GLY CA C 3 46.050 45.417 0.633 2
1 25 . 1 1 A 3 3 GLY N N 3 111.100 108.135 2.965 2
1 26 . 1 1 A 4 4 LYS H H 4 8.060 8.408 -0.348 2
1 27 . 1 1 A 4 4 LYS HA H 4 4.297 4.092 0.205 2
1 36 . 1 1 A 4 4 LYS C C 4 178.000 179.039 -1.039 2
1 37 . 1 1 A 4 4 LYS CA C 4 56.930 59.370 -2.440 2
1 38 . 1 1 A 4 4 LYS CB C 4 32.680 32.151 0.529 2
1 42 . 1 1 A 4 4 LYS N N 4 119.500 121.519 -2.019 2
1 43 . 1 1 A 5 5 LEU H H 5 8.243 8.181 0.062 2
1 44 . 1 1 A 5 5 LEU HA H 5 3.947 3.885 0.062 2
1 54 . 1 1 A 5 5 LEU C C 5 177.900 178.835 -0.935 2
1 55 . 1 1 A 5 5 LEU CA C 5 57.930 57.786 0.144 2
1 56 . 1 1 A 5 5 LEU CB C 5 41.620 41.663 -0.043 2
1 60 . 1 1 A 5 5 LEU N N 5 120.800 120.219 0.581 2
1 61 . 1 1 A 6 6 ASN H H 6 8.256 8.325 -0.069 2
1 62 . 1 1 A 6 6 ASN HA H 6 4.252 4.358 -0.106 2
1 67 . 1 1 A 6 6 ASN C C 6 177.300 177.506 -0.206 2
1 68 . 1 1 A 6 6 ASN CA C 6 56.900 56.330 0.570 2
1 69 . 1 1 A 6 6 ASN CB C 6 38.200 38.061 0.139 2
1 70 . 1 1 A 6 6 ASN N N 6 116.200 116.689 -0.489 2
1 72 . 1 1 A 7 7 ASP H H 7 7.699 9.064 -1.365 2
1 73 . 1 1 A 7 7 ASP HA H 7 4.320 4.392 -0.072 2
1 76 . 1 1 A 7 7 ASP C C 7 178.000 178.439 -0.439 2
1 77 . 1 1 A 7 7 ASP CA C 7 56.980 57.390 -0.410 2
1 78 . 1 1 A 7 7 ASP CB C 7 39.870 41.200 -1.330 2
1 79 . 1 1 A 7 7 ASP N N 7 119.100 119.355 -0.255 2
1 80 . 1 1 A 8 8 LEU H H 8 7.580 8.562 -0.982 2
1 81 . 1 1 A 8 8 LEU HA H 8 4.091 4.121 -0.030 2
1 91 . 1 1 A 8 8 LEU C C 8 178.800 178.915 -0.115 2
1 92 . 1 1 A 8 8 LEU CA C 8 57.790 57.783 0.007 2
1 93 . 1 1 A 8 8 LEU CB C 8 41.880 41.759 0.121 2
1 97 . 1 1 A 8 8 LEU N N 8 120.400 119.869 0.531 2
1 98 . 1 1 A 9 9 LEU H H 9 8.125 9.096 -0.971 2
1 99 . 1 1 A 9 9 LEU HA H 9 3.891 3.966 -0.074 2
1 109 . 1 1 A 9 9 LEU C C 9 178.900 178.475 0.425 2
1 110 . 1 1 A 9 9 LEU CA C 9 58.350 58.608 -0.258 2
1 111 . 1 1 A 9 9 LEU CB C 9 41.510 41.872 -0.362 2
1 115 . 1 1 A 9 9 LEU N N 9 118.900 120.084 -1.184 2
1 116 . 1 1 A 10 10 GLU H H 10 8.011 8.784 -0.773 2
1 117 . 1 1 A 10 10 GLU HA H 10 4.072 4.051 0.021 2
1 122 . 1 1 A 10 10 GLU C C 10 179.000 178.669 0.331 2
1 123 . 1 1 A 10 10 GLU CA C 10 59.090 59.788 -0.698 2
1 124 . 1 1 A 10 10 GLU CB C 10 27.910 29.219 -1.309 2
1 126 . 1 1 A 10 10 GLU N N 10 119.300 118.435 0.865 2
1 127 . 1 1 A 11 11 ASP H H 11 8.128 7.902 0.226 2
1 128 . 1 1 A 11 11 ASP HA H 11 4.383 4.434 -0.051 2
1 131 . 1 1 A 11 11 ASP C C 11 178.500 178.680 -0.180 2
1 132 . 1 1 A 11 11 ASP CA C 11 56.580 57.122 -0.542 2
1 133 . 1 1 A 11 11 ASP CB C 11 38.600 40.873 -2.273 2
1 134 . 1 1 A 11 11 ASP N N 11 119.600 119.922 -0.322 2
1 135 . 1 1 A 12 12 LEU H H 12 8.394 8.274 0.120 2
1 136 . 1 1 A 12 12 LEU HA H 12 3.923 4.185 -0.262 2
1 146 . 1 1 A 12 12 LEU C C 12 178.200 178.590 -0.390 2
1 147 . 1 1 A 12 12 LEU CA C 12 57.880 57.965 -0.085 2
1 148 . 1 1 A 12 12 LEU CB C 12 41.850 41.809 0.041 2
1 152 . 1 1 A 12 12 LEU N N 12 120.500 121.057 -0.557 2
1 153 . 1 1 A 13 13 GLN H H 13 8.371 8.891 -0.520 2
1 154 . 1 1 A 13 13 GLN HA H 13 3.879 4.081 -0.202 2
1 161 . 1 1 A 13 13 GLN C C 13 178.600 177.926 0.674 2
1 162 . 1 1 A 13 13 GLN CA C 13 59.570 58.064 1.506 2
1 163 . 1 1 A 13 13 GLN CB C 13 28.440 27.635 0.805 2
1 165 . 1 1 A 13 13 GLN N N 13 118.400 117.158 1.242 2
1 167 . 1 1 A 14 14 GLU H H 14 7.913 7.919 -0.006 2
1 168 . 1 1 A 14 14 GLU HA H 14 4.021 4.135 -0.114 2
1 173 . 1 1 A 14 14 GLU C C 14 179.000 178.900 0.100 2
1 174 . 1 1 A 14 14 GLU CA C 14 59.030 58.917 0.113 2
1 175 . 1 1 A 14 14 GLU CB C 14 28.720 29.776 -1.056 2
1 177 . 1 1 A 14 14 GLU N N 14 119.100 119.649 -0.549 2
1 178 . 1 1 A 15 15 VAL H H 15 7.991 7.948 0.043 2
1 179 . 1 1 A 15 15 VAL HA H 15 3.696 3.897 -0.201 2
1 187 . 1 1 A 15 15 VAL C C 15 178.300 177.908 0.392 2
1 188 . 1 1 A 15 15 VAL CA C 15 66.640 65.542 1.098 2
1 189 . 1 1 A 15 15 VAL CB C 15 31.470 31.539 -0.069 2
1 192 . 1 1 A 15 15 VAL N N 15 120.300 118.200 2.100 2
1 193 . 1 1 A 16 16 LEU H H 16 8.172 7.783 0.389 2
1 194 . 1 1 A 16 16 LEU HA H 16 3.876 4.185 -0.309 2
1 204 . 1 1 A 16 16 LEU C C 16 178.400 178.563 -0.163 2
1 205 . 1 1 A 16 16 LEU CA C 16 58.050 57.891 0.159 2
1 206 . 1 1 A 16 16 LEU CB C 16 41.420 41.628 -0.208 2
1 210 . 1 1 A 16 16 LEU N N 16 119.700 123.800 -4.100 2
1 211 . 1 1 A 17 17 LYS H H 17 7.755 8.953 -1.198 2
1 212 . 1 1 A 17 17 LYS HA H 17 3.951 4.051 -0.100 2
1 221 . 1 1 A 17 17 LYS C C 17 178.800 178.838 -0.038 2
1 222 . 1 1 A 17 17 LYS CA C 17 59.470 58.970 0.500 2
1 223 . 1 1 A 17 17 LYS CB C 17 32.350 32.450 -0.100 2
1 227 . 1 1 A 17 17 LYS N N 17 117.800 119.427 -1.628 2
1 228 . 1 1 A 18 18 HIS H H 18 7.847 8.129 -0.282 2
1 229 . 1 1 A 18 18 HIS HA H 18 4.549 4.581 -0.032 2
1 233 . 1 1 A 18 18 HIS C C 18 177.200 176.419 0.781 2
1 234 . 1 1 A 18 18 HIS CA C 18 57.870 57.676 0.194 2
1 235 . 1 1 A 18 18 HIS CB C 18 28.730 29.367 -0.637 2
1 236 . 1 1 A 18 18 HIS N N 18 116.200 117.704 -1.504 2
1 237 . 1 1 A 19 19 VAL H H 19 8.415 7.842 0.573 2
1 238 . 1 1 A 19 19 VAL HA H 19 3.746 4.093 -0.347 2
1 246 . 1 1 A 19 19 VAL CA C 19 65.850 64.293 1.557 2
1 247 . 1 1 A 19 19 VAL CB C 19 31.600 32.669 -1.069 2
1 250 . 1 1 A 20 20 ASN H H 20 8.041 8.235 -0.194 2
1 251 . 1 1 A 20 20 ASN HA H 20 4.545 4.603 -0.058 2
1 256 . 1 1 A 20 20 ASN C C 20 176.900 177.305 -0.405 2
1 257 . 1 1 A 20 20 ASN CA C 20 55.070 56.380 -1.310 2
1 258 . 1 1 A 20 20 ASN CB C 20 38.270 38.442 -0.172 2
1 259 . 1 1 A 20 20 ASN N N 20 117.900 119.441 -1.541 2
1 261 . 1 1 A 21 21 GLN H H 21 7.887 7.990 -0.103 2
1 262 . 1 1 A 21 21 GLN HA H 21 4.096 4.261 -0.165 2
1 269 . 1 1 A 21 21 GLN C C 21 176.900 177.204 -0.304 2
1 270 . 1 1 A 21 21 GLN CA C 21 57.510 57.332 0.178 2
1 271 . 1 1 A 21 21 GLN CB C 21 29.100 29.241 -0.140 2
1 273 . 1 1 A 21 21 GLN N N 21 117.900 117.626 0.274 2
1 275 . 1 1 A 22 22 HIS H H 22 7.887 8.269 -0.382 2
1 276 . 1 1 A 22 22 HIS HA H 22 4.679 4.838 -0.159 2
1 280 . 1 1 A 22 22 HIS C C 22 174.300 175.093 -0.793 2
1 281 . 1 1 A 22 22 HIS CA C 22 55.770 55.642 0.128 2
1 282 . 1 1 A 22 22 HIS CB C 22 28.630 29.581 -0.951 2
1 283 . 1 1 A 22 22 HIS N N 22 116.100 114.543 1.557 2
1 284 . 1 1 A 23 23 TRP H H 23 7.929 7.839 0.090 2
1 285 . 1 1 A 23 23 TRP HA H 23 4.542 4.716 -0.174 2
1 292 . 1 1 A 23 23 TRP C C 23 176.600 175.470 1.130 2
1 293 . 1 1 A 23 23 TRP CA C 23 58.020 58.176 -0.156 2
1 294 . 1 1 A 23 23 TRP CB C 23 29.700 30.686 -0.986 2
1 295 . 1 1 A 23 23 TRP N N 23 122.000 123.792 -1.792 2
1 297 . 1 1 A 24 24 GLN H H 24 8.258 8.248 0.010 2
1 298 . 1 1 A 24 24 GLN HA H 24 4.329 4.814 -0.486 2
1 305 . 1 1 A 24 24 GLN C C 24 176.200 175.424 0.776 2
1 306 . 1 1 A 24 24 GLN CA C 24 55.960 54.964 0.996 2
1 307 . 1 1 A 24 24 GLN CB C 24 29.440 31.931 -2.491 2
1 309 . 1 1 A 24 24 GLN N N 24 123.800 126.103 -2.303 2
1 311 . 1 1 A 25 25 GLY H H 25 7.470 8.765 -1.295 2
1 312 . 1 1 A 25 25 GLY HA2 H 25 3.939 3.932 0.007 2
1 313 . 1 1 A 25 25 GLY HA3 H 25 3.800 3.946 -0.146 2
1 314 . 1 1 A 25 25 GLY C C 25 174.800 174.953 -0.153 2
1 315 . 1 1 A 25 25 GLY CA C 25 45.470 46.432 -0.962 2
1 316 . 1 1 A 25 25 GLY N N 25 108.100 110.748 -2.648 2
1 317 . 1 1 A 26 26 GLY H H 26 8.332 8.701 -0.369 2
1 318 . 1 1 A 26 26 GLY HA2 H 26 4.105 4.172 -0.067 2
1 319 . 1 1 A 26 26 GLY HA3 H 26 3.974 4.212 -0.238 2
1 320 . 1 1 A 26 26 GLY C C 26 174.900 174.873 0.027 2
1 321 . 1 1 A 26 26 GLY CA C 26 45.410 45.518 -0.108 2
1 322 . 1 1 A 26 26 GLY N N 26 108.700 108.037 0.663 2
1 323 . 1 1 A 27 27 GLN H H 27 8.474 8.594 -0.120 2
1 324 . 1 1 A 27 27 GLN HA H 27 4.106 4.107 -0.001 2
1 331 . 1 1 A 27 27 GLN C C 27 177.100 176.673 0.427 2
1 332 . 1 1 A 27 27 GLN CA C 27 57.540 57.182 0.358 2
1 333 . 1 1 A 27 27 GLN CB C 27 29.050 28.612 0.438 2
1 335 . 1 1 A 27 27 GLN N N 27 121.100 122.851 -1.751 2
1 337 . 1 1 A 28 28 LYS H H 28 8.448 8.278 0.170 2
1 338 . 1 1 A 28 28 LYS HA H 28 4.068 4.051 0.017 2
1 347 . 1 1 A 28 28 LYS C C 28 177.900 178.280 -0.380 2
1 348 . 1 1 A 28 28 LYS CA C 28 58.410 58.671 -0.261 2
1 349 . 1 1 A 28 28 LYS CB C 28 32.210 32.363 -0.153 2
1 353 . 1 1 A 28 28 LYS N N 28 120.500 118.099 2.402 2
1 354 . 1 1 A 29 29 ASN H H 29 8.273 8.015 0.258 2
1 355 . 1 1 A 29 29 ASN HA H 29 4.584 4.427 0.157 2
1 360 . 1 1 A 29 29 ASN C C 29 176.200 177.395 -1.196 2
1 361 . 1 1 A 29 29 ASN CA C 29 54.400 55.822 -1.422 2
1 362 . 1 1 A 29 29 ASN CB C 29 38.280 38.269 0.011 2
1 363 . 1 1 A 29 29 ASN N N 29 117.500 117.786 -0.286 2
1 365 . 1 1 A 30 30 MET H H 30 7.870 7.508 0.362 2
1 366 . 1 1 A 30 30 MET HA H 30 4.085 2.898 1.187 2
1 371 . 1 1 A 30 30 MET C C 30 177.000 177.568 -0.568 2
1 372 . 1 1 A 30 30 MET CA C 30 56.880 57.729 -0.849 2
1 373 . 1 1 A 30 30 MET CB C 30 32.340 31.701 0.639 2
1 375 . 1 1 A 30 30 MET N N 30 121.100 118.665 2.435 2
1 376 . 1 1 A 31 31 ASN H H 31 8.186 7.516 0.670 2
1 377 . 1 1 A 31 31 ASN HA H 31 4.311 4.496 -0.185 2
1 382 . 1 1 A 31 31 ASN C C 31 176.700 177.550 -0.850 2
1 383 . 1 1 A 31 31 ASN CA C 31 55.320 55.288 0.033 2
1 384 . 1 1 A 31 31 ASN CB C 31 38.410 38.646 -0.236 2
1 385 . 1 1 A 31 31 ASN N N 31 117.900 116.180 1.720 2
1 387 . 1 1 A 32 32 LYS H H 32 7.792 7.339 0.453 2
1 388 . 1 1 A 32 32 LYS HA H 32 3.992 3.984 0.008 2
1 397 . 1 1 A 32 32 LYS C C 32 177.900 179.001 -1.101 2
1 398 . 1 1 A 32 32 LYS CA C 32 59.050 59.041 0.009 2
1 399 . 1 1 A 32 32 LYS CB C 32 32.460 32.366 0.094 2
1 403 . 1 1 A 32 32 LYS N N 32 120.400 119.197 1.203 2
1 404 . 1 1 A 33 33 VAL H H 33 7.689 8.327 -0.638 2
1 405 . 1 1 A 33 33 VAL HA H 33 3.791 3.766 0.025 2
1 413 . 1 1 A 33 33 VAL C C 33 177.100 177.579 -0.479 2
1 414 . 1 1 A 33 33 VAL CA C 33 65.360 65.033 0.327 2
1 415 . 1 1 A 33 33 VAL CB C 33 31.920 31.595 0.325 2
1 418 . 1 1 A 33 33 VAL N N 33 120.200 115.999 4.201 2
1 419 . 1 1 A 34 34 ASP H H 34 8.408 8.085 0.323 2
1 420 . 1 1 A 34 34 ASP HA H 34 4.303 4.276 0.027 2
1 423 . 1 1 A 34 34 ASP C C 34 178.200 178.316 -0.116 2
1 424 . 1 1 A 34 34 ASP CA C 34 55.880 57.058 -1.178 2
1 425 . 1 1 A 34 34 ASP CB C 34 38.710 41.318 -2.608 2
1 426 . 1 1 A 34 34 ASP N N 34 120.100 121.777 -1.677 2
1 427 . 1 1 A 35 35 HIS H H 35 8.204 7.610 0.594 2
1 428 . 1 1 A 35 35 HIS HA H 35 4.343 4.248 0.094 2
1 431 . 1 1 A 35 35 HIS C C 35 176.800 177.363 -0.563 2
1 432 . 1 1 A 35 35 HIS CA C 35 58.310 59.311 -1.001 2
1 433 . 1 1 A 35 35 HIS CB C 35 28.070 30.013 -1.943 2
1 434 . 1 1 A 35 35 HIS N N 35 118.200 118.560 -0.360 2
1 435 . 1 1 A 36 36 HIS H H 36 8.067 8.196 -0.129 2
1 436 . 1 1 A 36 36 HIS HA H 36 4.602 4.176 0.426 2
1 440 . 1 1 A 36 36 HIS C C 36 177.100 177.628 -0.528 2
1 441 . 1 1 A 36 36 HIS CA C 36 58.520 59.537 -1.017 2
1 442 . 1 1 A 36 36 HIS CB C 36 28.720 30.043 -1.323 2
1 443 . 1 1 A 36 36 HIS N N 36 117.100 117.149 -0.049 2
1 444 . 1 1 A 37 37 LEU H H 37 8.473 8.371 0.102 2
1 445 . 1 1 A 37 37 LEU HA H 37 3.894 3.659 0.235 2
1 455 . 1 1 A 37 37 LEU C C 37 178.200 178.704 -0.504 2
1 456 . 1 1 A 37 37 LEU CA C 37 58.520 57.986 0.534 2
1 457 . 1 1 A 37 37 LEU CB C 37 41.810 41.510 0.300 2
1 461 . 1 1 A 37 37 LEU N N 37 119.600 119.670 -0.070 2
1 462 . 1 1 A 38 38 GLN H H 38 8.337 8.332 0.005 2
1 463 . 1 1 A 38 38 GLN HA H 38 3.882 3.941 -0.059 2
1 470 . 1 1 A 38 38 GLN C C 38 178.500 178.176 0.324 2
1 471 . 1 1 A 38 38 GLN CA C 38 59.200 59.267 -0.067 2
1 472 . 1 1 A 38 38 GLN CB C 38 27.850 28.260 -0.410 2
1 474 . 1 1 A 38 38 GLN N N 38 118.000 117.127 0.873 2
1 476 . 1 1 A 39 39 ASN H H 39 7.923 7.726 0.197 2
1 477 . 1 1 A 39 39 ASN HA H 39 4.390 4.530 -0.140 2
1 482 . 1 1 A 39 39 ASN C C 39 177.500 177.717 -0.217 2
1 483 . 1 1 A 39 39 ASN CA C 39 55.780 56.002 -0.222 2
1 484 . 1 1 A 39 39 ASN CB C 39 37.450 38.488 -1.038 2
1 485 . 1 1 A 39 39 ASN N N 39 118.700 117.670 1.030 2
1 487 . 1 1 A 40 40 VAL H H 40 7.907 8.221 -0.314 2
1 488 . 1 1 A 40 40 VAL HA H 40 3.629 3.542 0.087 2
1 496 . 1 1 A 40 40 VAL C C 40 177.500 177.863 -0.363 2
1 497 . 1 1 A 40 40 VAL CA C 40 67.080 66.247 0.833 2
1 498 . 1 1 A 40 40 VAL CB C 40 31.390 31.400 -0.010 2
1 501 . 1 1 A 40 40 VAL N N 40 120.400 119.674 0.726 2
1 502 . 1 1 A 41 41 ILE H H 41 8.103 8.150 -0.047 2
1 503 . 1 1 A 41 41 ILE HA H 41 3.401 3.645 -0.244 2
1 513 . 1 1 A 41 41 ILE C C 41 178.000 178.569 -0.569 2
1 514 . 1 1 A 41 41 ILE CA C 41 66.430 65.239 1.191 2
1 515 . 1 1 A 41 41 ILE CB C 41 38.050 37.725 0.325 2
1 519 . 1 1 A 41 41 ILE N N 41 120.600 119.479 1.121 2
1 520 . 1 1 A 42 42 GLU H H 42 8.150 7.955 0.195 2
1 521 . 1 1 A 42 42 GLU HA H 42 4.062 4.098 -0.036 2
1 526 . 1 1 A 42 42 GLU C C 42 178.500 178.578 -0.078 2
1 527 . 1 1 A 42 42 GLU CA C 42 59.120 59.276 -0.157 2
1 528 . 1 1 A 42 42 GLU CB C 42 28.160 29.209 -1.049 2
1 530 . 1 1 A 42 42 GLU N N 42 119.900 121.627 -1.727 2
1 531 . 1 1 A 43 43 ASP H H 43 8.453 8.998 -0.545 2
1 532 . 1 1 A 43 43 ASP HA H 43 4.445 4.439 0.006 2
1 535 . 1 1 A 43 43 ASP C C 43 178.400 178.477 -0.077 2
1 536 . 1 1 A 43 43 ASP CA C 43 56.490 57.564 -1.074 2
1 537 . 1 1 A 43 43 ASP CB C 43 37.820 41.604 -3.784 2
1 538 . 1 1 A 43 43 ASP N N 43 119.700 120.129 -0.430 2
1 539 . 1 1 A 44 44 ILE H H 44 8.544 7.745 0.799 2
1 540 . 1 1 A 44 44 ILE HA H 44 3.590 3.823 -0.233 2
1 550 . 1 1 A 44 44 ILE C C 44 177.800 178.187 -0.387 2
1 551 . 1 1 A 44 44 ILE CA C 44 66.320 65.242 1.078 2
1 552 . 1 1 A 44 44 ILE CB C 44 37.690 37.971 -0.281 2
1 556 . 1 1 A 44 44 ILE N N 44 121.500 119.411 2.089 2
1 557 . 1 1 A 45 45 HIS H H 45 8.261 8.251 0.010 2
1 558 . 1 1 A 45 45 HIS HA H 45 4.255 4.273 -0.018 2
1 562 . 1 1 A 45 45 HIS C C 45 177.200 176.767 0.433 2
1 563 . 1 1 A 45 45 HIS CA C 45 59.580 59.517 0.063 2
1 564 . 1 1 A 45 45 HIS CB C 45 27.790 29.929 -2.139 2
1 565 . 1 1 A 45 45 HIS N N 45 118.800 119.487 -0.687 2
1 566 . 1 1 A 46 46 ASP H H 46 8.680 8.152 0.528 2
1 567 . 1 1 A 46 46 ASP HA H 46 4.338 4.521 -0.183 2
1 570 . 1 1 A 46 46 ASP C C 46 178.700 177.885 0.815 2
1 571 . 1 1 A 46 46 ASP CA C 46 57.010 55.386 1.624 2
1 572 . 1 1 A 46 46 ASP CB C 46 39.400 40.902 -1.502 2
1 573 . 1 1 A 46 46 ASP N N 46 119.200 118.968 0.232 2
1 574 . 1 1 A 47 47 PHE H H 47 8.380 9.299 -0.919 2
1 575 . 1 1 A 47 47 PHE HA H 47 4.070 4.234 -0.164 2
1 580 . 1 1 A 47 47 PHE C C 47 178.600 177.618 0.982 2
1 581 . 1 1 A 47 47 PHE CA C 47 61.250 60.210 1.040 2
1 582 . 1 1 A 47 47 PHE CB C 47 39.570 39.749 -0.179 2
1 583 . 1 1 A 47 47 PHE N N 47 121.800 121.109 0.691 2
1 584 . 1 1 A 48 48 MET H H 48 8.366 8.127 0.239 2
1 585 . 1 1 A 48 48 MET HA H 48 3.998 4.438 -0.440 2
1 590 . 1 1 A 48 48 MET C C 48 177.400 177.799 -0.399 2
1 591 . 1 1 A 48 48 MET CA C 48 58.470 58.164 0.306 2
1 592 . 1 1 A 48 48 MET CB C 48 33.170 32.748 0.422 2
1 594 . 1 1 A 48 48 MET N N 48 117.700 117.803 -0.103 2
1 595 . 1 1 A 49 49 GLN H H 49 7.659 8.239 -0.580 2
1 596 . 1 1 A 49 49 GLN HA H 49 4.258 4.215 0.043 2
1 603 . 1 1 A 49 49 GLN C C 49 176.700 178.331 -1.631 2
1 604 . 1 1 A 49 49 GLN CA C 49 56.380 57.948 -1.568 2
1 605 . 1 1 A 49 49 GLN CB C 49 28.980 29.071 -0.091 2
1 607 . 1 1 A 49 49 GLN N N 49 116.700 117.468 -0.768 2
1 609 . 1 1 A 50 50 GLY H H 50 7.685 8.388 -0.703 2
1 610 . 1 1 A 50 50 GLY HA2 H 50 3.998 3.828 0.171 2
1 611 . 1 1 A 50 50 GLY HA3 H 50 3.998 3.868 0.131 2
1 612 . 1 1 A 50 50 GLY C C 50 174.900 175.123 -0.223 2
1 613 . 1 1 A 50 50 GLY CA C 50 45.460 45.917 -0.457 2
1 614 . 1 1 A 50 50 GLY N N 50 106.400 108.626 -2.226 2
1 615 . 1 1 A 51 51 GLY H H 51 8.031 8.967 -0.936 2
1 616 . 1 1 A 51 51 GLY HA2 H 51 3.817 3.829 -0.012 2
1 617 . 1 1 A 51 51 GLY HA3 H 51 3.817 3.861 -0.044 2
1 618 . 1 1 A 51 51 GLY C C 51 174.500 174.502 -0.002 2
1 619 . 1 1 A 51 51 GLY CA C 51 45.190 45.642 -0.452 2
1 620 . 1 1 A 51 51 GLY N N 51 108.900 109.185 -0.285 2
1 621 . 1 1 A 52 52 GLY H H 52 8.126 8.358 -0.232 2
1 622 . 1 1 A 52 52 GLY HA2 H 52 3.362 3.554 -0.192 2
1 623 . 1 1 A 52 52 GLY HA3 H 52 3.362 3.958 -0.597 2
1 624 . 1 1 A 52 52 GLY C C 52 173.300 174.220 -0.920 2
1 625 . 1 1 A 52 52 GLY CA C 52 45.120 45.175 -0.055 2
1 626 . 1 1 A 52 52 GLY N N 52 108.100 108.020 0.080 2
1 627 . 1 1 A 53 53 SER H H 53 7.594 7.872 -0.278 2
1 628 . 1 1 A 53 53 SER HA H 53 4.530 4.665 -0.135 2
1 631 . 1 1 A 53 53 SER C C 53 175.300 175.377 -0.077 2
1 632 . 1 1 A 53 53 SER CA C 53 57.770 57.708 0.062 2
1 633 . 1 1 A 53 53 SER CB C 53 64.750 62.129 2.621 2
1 634 . 1 1 A 53 53 SER N N 53 114.100 115.831 -1.731 2
1 635 . 1 1 A 54 54 GLY H H 54 9.003 8.614 0.389 2
1 636 . 1 1 A 54 54 GLY HA2 H 54 4.037 3.982 0.055 2
1 637 . 1 1 A 54 54 GLY HA3 H 54 3.911 4.089 -0.178 2
1 638 . 1 1 A 54 54 GLY C C 54 176.500 175.508 0.992 2
1 639 . 1 1 A 54 54 GLY CA C 54 47.040 47.047 -0.007 2
1 640 . 1 1 A 54 54 GLY N N 54 110.400 111.084 -0.684 2
1 641 . 1 1 A 55 55 GLY H H 55 8.617 8.287 0.330 2
1 642 . 1 1 A 55 55 GLY HA2 H 55 3.946 3.877 0.069 2
1 643 . 1 1 A 55 55 GLY HA3 H 55 3.946 3.891 0.055 2
1 644 . 1 1 A 55 55 GLY C C 55 176.400 175.686 0.714 2
1 645 . 1 1 A 55 55 GLY CA C 55 46.630 46.878 -0.248 2
1 646 . 1 1 A 55 55 GLY N N 55 109.800 109.546 0.253 2
1 647 . 1 1 A 56 56 LYS H H 56 7.876 8.591 -0.715 2
1 648 . 1 1 A 56 56 LYS HA H 56 4.195 4.198 -0.003 2
1 657 . 1 1 A 56 56 LYS C C 56 178.600 178.857 -0.257 2
1 658 . 1 1 A 56 56 LYS CA C 56 57.960 58.681 -0.721 2
1 659 . 1 1 A 56 56 LYS CB C 56 32.110 32.194 -0.084 2
1 663 . 1 1 A 56 56 LYS N N 56 121.800 122.040 -0.240 2
1 664 . 1 1 A 57 57 LEU H H 57 8.153 7.835 0.318 2
1 665 . 1 1 A 57 57 LEU HA H 57 3.992 4.290 -0.297 2
1 675 . 1 1 A 57 57 LEU C C 57 178.400 178.802 -0.402 2
1 676 . 1 1 A 57 57 LEU CA C 57 58.190 58.057 0.133 2
1 677 . 1 1 A 57 57 LEU CB C 57 41.360 42.029 -0.669 2
1 681 . 1 1 A 57 57 LEU N N 57 120.700 121.668 -0.968 2
1 682 . 1 1 A 58 58 GLN H H 58 8.019 8.165 -0.146 2
1 683 . 1 1 A 58 58 GLN HA H 58 3.942 4.141 -0.199 2
1 690 . 1 1 A 58 58 GLN C C 58 179.100 178.311 0.789 2
1 691 . 1 1 A 58 58 GLN CA C 58 59.360 58.369 0.991 2
1 692 . 1 1 A 58 58 GLN CB C 58 28.030 28.392 -0.362 2
1 694 . 1 1 A 58 58 GLN N N 58 117.400 117.561 -0.161 2
1 696 . 1 1 A 59 59 GLU H H 59 7.838 8.051 -0.213 2
1 697 . 1 1 A 59 59 GLU HA H 59 4.030 4.144 -0.115 2
1 702 . 1 1 A 59 59 GLU C C 59 178.600 179.168 -0.568 2
1 703 . 1 1 A 59 59 GLU CA C 59 59.250 58.987 0.263 2
1 704 . 1 1 A 59 59 GLU CB C 59 28.960 29.893 -0.933 2
1 706 . 1 1 A 59 59 GLU N N 59 119.900 120.077 -0.177 2
1 707 . 1 1 A 60 60 MET H H 60 8.223 8.169 0.054 2
1 708 . 1 1 A 60 60 MET HA H 60 3.966 4.224 -0.258 2
1 713 . 1 1 A 60 60 MET C C 60 177.900 178.426 -0.526 2
1 714 . 1 1 A 60 60 MET CA C 60 59.350 57.811 1.539 2
1 715 . 1 1 A 60 60 MET CB C 60 33.210 32.327 0.883 2
1 717 . 1 1 A 60 60 MET N N 60 120.100 118.926 1.174 2
1 718 . 1 1 A 61 61 MET H H 61 8.134 8.310 -0.176 2
1 719 . 1 1 A 61 61 MET HA H 61 4.195 4.306 -0.111 2
1 724 . 1 1 A 61 61 MET C C 61 179.100 178.315 0.785 2
1 725 . 1 1 A 61 61 MET CA C 61 58.210 58.796 -0.586 2
1 726 . 1 1 A 61 61 MET CB C 61 31.340 32.294 -0.954 2
1 728 . 1 1 A 61 61 MET N N 61 117.000 119.471 -2.471 2
1 729 . 1 1 A 62 62 LYS H H 62 7.782 7.977 -0.195 2
1 730 . 1 1 A 62 62 LYS HA H 62 4.085 4.022 0.063 2
1 739 . 1 1 A 62 62 LYS C C 62 179.600 179.215 0.385 2
1 740 . 1 1 A 62 62 LYS CA C 62 59.610 59.911 -0.301 2
1 741 . 1 1 A 62 62 LYS CB C 62 32.180 32.222 -0.042 2
1 745 . 1 1 A 62 62 LYS N N 62 120.600 119.234 1.366 2
1 746 . 1 1 A 63 63 GLU H H 63 8.041 8.023 0.018 2
1 747 . 1 1 A 63 63 GLU HA H 63 4.057 3.917 0.141 2
1 752 . 1 1 A 63 63 GLU C C 63 178.900 178.824 0.076 2
1 753 . 1 1 A 63 63 GLU CA C 63 59.170 59.034 0.136 2
1 754 . 1 1 A 63 63 GLU CB C 63 29.000 29.246 -0.246 2
1 756 . 1 1 A 63 63 GLU N N 63 120.200 119.766 0.434 2
1 757 . 1 1 A 64 64 PHE H H 64 8.604 8.897 -0.293 2
1 758 . 1 1 A 64 64 PHE HA H 64 4.155 3.852 0.303 2
1 763 . 1 1 A 64 64 PHE C C 64 177.800 177.713 0.087 2
1 764 . 1 1 A 64 64 PHE CA C 64 59.820 61.052 -1.232 2
1 765 . 1 1 A 64 64 PHE CB C 64 38.470 38.475 -0.005 2
1 766 . 1 1 A 64 64 PHE N N 64 119.700 120.969 -1.269 2
1 767 . 1 1 A 65 65 GLN H H 65 8.177 8.283 -0.106 2
1 768 . 1 1 A 65 65 GLN HA H 65 3.637 4.162 -0.525 2
1 775 . 1 1 A 65 65 GLN C C 65 177.800 177.718 0.083 2
1 776 . 1 1 A 65 65 GLN CA C 65 58.970 58.224 0.746 2
1 777 . 1 1 A 65 65 GLN CB C 65 28.280 28.624 -0.344 2
1 779 . 1 1 A 65 65 GLN N N 65 118.500 118.520 -0.020 2
1 781 . 1 1 A 66 66 GLN H H 66 7.622 7.995 -0.373 2
1 782 . 1 1 A 66 66 GLN HA H 66 4.040 4.253 -0.213 2
1 789 . 1 1 A 66 66 GLN C C 66 178.600 178.291 0.309 2
1 790 . 1 1 A 66 66 GLN CA C 66 59.150 58.115 1.035 2
1 791 . 1 1 A 66 66 GLN CB C 66 28.230 28.529 -0.299 2
1 793 . 1 1 A 66 66 GLN N N 66 117.400 118.208 -0.808 2
1 795 . 1 1 A 67 67 VAL H H 67 7.744 7.611 0.133 2
1 796 . 1 1 A 67 67 VAL HA H 67 3.785 3.767 0.018 2
1 804 . 1 1 A 67 67 VAL C C 67 177.500 177.835 -0.335 2
1 805 . 1 1 A 67 67 VAL CA C 67 66.220 66.117 0.103 2
1 806 . 1 1 A 67 67 VAL CB C 67 31.390 31.793 -0.403 2
1 809 . 1 1 A 67 67 VAL N N 67 119.500 120.717 -1.217 2
1 810 . 1 1 A 68 68 LEU H H 68 7.983 7.878 0.105 2
1 811 . 1 1 A 68 68 LEU HA H 68 3.825 4.081 -0.256 2
1 821 . 1 1 A 68 68 LEU C C 68 179.100 178.221 0.879 2
1 822 . 1 1 A 68 68 LEU CA C 68 58.740 58.243 0.497 2
1 823 . 1 1 A 68 68 LEU CB C 68 41.090 41.887 -0.797 2
1 827 . 1 1 A 68 68 LEU N N 68 120.400 120.014 0.386 2
1 828 . 1 1 A 69 69 ASP H H 69 8.179 8.090 0.089 2
1 829 . 1 1 A 69 69 ASP HA H 69 4.380 4.448 -0.068 2
1 832 . 1 1 A 69 69 ASP C C 69 178.900 178.386 0.514 2
1 833 . 1 1 A 69 69 ASP CA C 69 57.320 56.520 0.800 2
1 834 . 1 1 A 69 69 ASP CB C 69 40.040 40.715 -0.675 2
1 835 . 1 1 A 69 69 ASP N N 69 119.000 118.443 0.557 2
1 836 . 1 1 A 70 70 GLU H H 70 8.166 8.158 0.008 2
1 837 . 1 1 A 70 70 GLU HA H 70 4.082 4.158 -0.076 2
1 842 . 1 1 A 70 70 GLU C C 70 179.600 179.058 0.542 2
1 843 . 1 1 A 70 70 GLU CA C 70 59.010 59.030 -0.020 2
1 844 . 1 1 A 70 70 GLU CB C 70 28.900 29.864 -0.964 2
1 846 . 1 1 A 70 70 GLU N N 70 120.500 119.282 1.218 2
1 847 . 1 1 A 71 71 ILE H H 71 8.415 8.205 0.210 2
1 848 . 1 1 A 71 71 ILE HA H 71 3.790 3.438 0.352 2
1 858 . 1 1 A 71 71 ILE C C 71 177.400 177.633 -0.233 2
1 859 . 1 1 A 71 71 ILE CA C 71 64.890 65.017 -0.127 2
1 860 . 1 1 A 71 71 ILE CB C 71 37.680 37.349 0.331 2
1 864 . 1 1 A 71 71 ILE N N 71 119.200 120.277 -1.077 2
1 865 . 1 1 A 72 72 LYS H H 72 8.248 7.924 0.324 2
1 866 . 1 1 A 72 72 LYS HA H 72 3.625 3.276 0.349 2
1 873 . 1 1 A 72 72 LYS C C 72 178.400 178.417 -0.017 2
1 874 . 1 1 A 72 72 LYS CA C 72 59.850 59.316 0.534 2
1 875 . 1 1 A 72 72 LYS CB C 72 32.070 32.113 -0.043 2
1 879 . 1 1 A 72 72 LYS N N 72 120.800 121.106 -0.306 2
1 880 . 1 1 A 73 73 GLN H H 73 7.937 7.805 0.132 2
1 881 . 1 1 A 73 73 GLN HA H 73 4.042 3.986 0.056 2
1 888 . 1 1 A 73 73 GLN C C 73 178.400 178.451 -0.051 2
1 889 . 1 1 A 73 73 GLN CA C 73 58.510 59.006 -0.496 2
1 890 . 1 1 A 73 73 GLN CB C 73 28.430 28.337 0.093 2
1 892 . 1 1 A 73 73 GLN N N 73 117.000 118.022 -1.022 2
1 894 . 1 1 A 74 74 GLN H H 74 7.712 7.999 -0.287 2
1 895 . 1 1 A 74 74 GLN HA H 74 4.080 3.939 0.141 2
1 902 . 1 1 A 74 74 GLN C C 74 177.800 178.208 -0.408 2
1 903 . 1 1 A 74 74 GLN CA C 74 57.270 58.495 -1.225 2
1 904 . 1 1 A 74 74 GLN CB C 74 28.700 27.888 0.812 2
1 906 . 1 1 A 74 74 GLN N N 74 118.200 119.055 -0.855 2
1 908 . 1 1 A 75 75 LEU H H 75 7.956 7.620 0.336 2
1 909 . 1 1 A 75 75 LEU HA H 75 4.212 4.137 0.075 2
1 919 . 1 1 A 75 75 LEU CA C 75 56.660 56.372 0.288 2
1 920 . 1 1 A 75 75 LEU CB C 75 42.000 41.129 0.871 2
1 924 . 1 1 A 75 75 LEU N N 75 120.700 119.224 1.476 2
1 925 . 1 1 A 76 76 GLN H H 76 8.315 8.007 0.308 2
1 926 . 1 1 A 76 76 GLN HA H 76 4.113 4.241 -0.128 2
1 933 . 1 1 A 76 76 GLN C C 76 177.100 175.865 1.235 2
1 934 . 1 1 A 76 76 GLN CA C 76 57.400 56.735 0.665 2
1 935 . 1 1 A 76 76 GLN CB C 76 28.640 28.369 0.271 2
1 937 . 1 1 A 76 76 GLN N N 76 120.100 118.547 1.553 2
1 939 . 1 1 A 77 77 GLY H H 77 8.021 7.820 0.201 2
1 940 . 1 1 A 77 77 GLY HA2 H 77 4.042 4.086 -0.044 2
1 941 . 1 1 A 77 77 GLY HA3 H 77 3.869 4.093 -0.224 2
1 942 . 1 1 A 77 77 GLY C C 77 174.600 174.124 0.477 2
1 943 . 1 1 A 77 77 GLY CA C 77 45.430 45.317 0.113 2
1 944 . 1 1 A 77 77 GLY N N 77 107.700 108.070 -0.370 2
1 945 . 1 1 A 78 78 GLY H H 78 7.819 8.720 -0.901 2
1 946 . 1 1 A 78 78 GLY HA2 H 78 4.208 3.967 0.241 2
1 947 . 1 1 A 78 78 GLY HA3 H 78 3.801 3.975 -0.174 2
1 948 . 1 1 A 78 78 GLY C C 78 173.900 174.255 -0.355 2
1 949 . 1 1 A 78 78 GLY CA C 78 45.140 45.579 -0.439 2
1 950 . 1 1 A 78 78 GLY N N 78 107.100 110.179 -3.079 2
1 951 . 1 1 A 79 79 ASP H H 79 7.912 8.162 -0.250 2
1 952 . 1 1 A 79 79 ASP HA H 79 4.722 4.764 -0.042 2
1 955 . 1 1 A 79 79 ASP C C 79 176.200 176.538 -0.339 2
1 956 . 1 1 A 79 79 ASP CA C 79 53.210 53.578 -0.368 2
1 957 . 1 1 A 79 79 ASP CB C 79 40.160 40.148 0.012 2
1 958 . 1 1 A 79 79 ASP N N 79 119.800 119.835 -0.035 2
1 959 . 1 1 A 80 80 ASN H H 80 8.450 8.594 -0.144 2
1 960 . 1 1 A 80 80 ASN HA H 80 4.593 4.542 0.051 2
1 965 . 1 1 A 80 80 ASN C C 80 177.300 177.195 0.105 2
1 966 . 1 1 A 80 80 ASN CA C 80 54.680 55.171 -0.491 2
1 967 . 1 1 A 80 80 ASN CB C 80 38.790 37.872 0.918 2
1 968 . 1 1 A 80 80 ASN N N 80 121.700 119.712 1.988 2
1 970 . 1 1 A 81 81 SER H H 81 8.444 7.963 0.481 2
1 971 . 1 1 A 81 81 SER HA H 81 4.263 4.231 0.032 2
1 974 . 1 1 A 81 81 SER C C 81 176.100 176.754 -0.654 2
1 975 . 1 1 A 81 81 SER CA C 81 61.470 61.611 -0.141 2
1 976 . 1 1 A 81 81 SER CB C 81 61.470 62.874 -1.404 2
1 977 . 1 1 A 81 81 SER N N 81 117.100 115.888 1.212 2
1 978 . 1 1 A 82 82 LEU H H 82 7.929 8.199 -0.270 2
1 979 . 1 1 A 82 82 LEU HA H 82 4.332 3.967 0.365 2
1 989 . 1 1 A 82 82 LEU C C 82 177.400 179.157 -1.757 2
1 990 . 1 1 A 82 82 LEU CA C 82 55.060 57.856 -2.796 2
1 991 . 1 1 A 82 82 LEU CB C 82 41.940 41.615 0.325 2
1 995 . 1 1 A 82 82 LEU N N 82 120.400 121.515 -1.115 2
1 996 . 1 1 A 83 83 HIS H H 83 8.014 7.955 0.059 2
1 997 . 1 1 A 83 83 HIS HA H 83 4.173 4.189 -0.016 2
1 1000 . 1 1 A 83 83 HIS C C 83 176.100 176.761 -0.661 2
1 1001 . 1 1 A 83 83 HIS CA C 83 59.940 59.616 0.324 2
1 1002 . 1 1 A 83 83 HIS CB C 83 28.050 30.073 -2.023 2
1 1003 . 1 1 A 83 83 HIS N N 83 119.400 118.355 1.045 2
1 1004 . 1 1 A 84 84 ASN H H 84 8.598 8.379 0.219 2
1 1005 . 1 1 A 84 84 ASN HA H 84 4.735 4.683 0.052 2
1 1010 . 1 1 A 84 84 ASN C C 84 177.400 177.232 0.168 2
1 1011 . 1 1 A 84 84 ASN CA C 84 55.790 55.002 0.788 2
1 1012 . 1 1 A 84 84 ASN CB C 84 37.520 39.036 -1.516 2
1 1013 . 1 1 A 84 84 ASN N N 84 118.100 117.081 1.019 2
1 1015 . 1 1 A 85 85 VAL H H 85 7.933 7.749 0.184 2
1 1016 . 1 1 A 85 85 VAL HA H 85 3.849 3.820 0.029 2
1 1024 . 1 1 A 85 85 VAL C C 85 177.100 177.967 -0.867 2
1 1025 . 1 1 A 85 85 VAL CA C 85 65.490 65.453 0.037 2
1 1026 . 1 1 A 85 85 VAL CB C 85 31.760 31.975 -0.215 2
1 1029 . 1 1 A 85 85 VAL N N 85 120.500 119.935 0.565 2
1 1030 . 1 1 A 86 86 HIS H H 86 8.460 9.402 -0.942 2
1 1031 . 1 1 A 86 86 HIS HA H 86 4.054 4.093 -0.039 2
1 1035 . 1 1 A 86 86 HIS C C 86 176.300 177.335 -1.035 2
1 1036 . 1 1 A 86 86 HIS CA C 86 59.860 59.770 0.090 2
1 1037 . 1 1 A 86 86 HIS CB C 86 29.670 30.046 -0.376 2
1 1038 . 1 1 A 86 86 HIS N N 86 119.300 119.224 0.076 2
1 1039 . 1 1 A 87 87 GLU H H 87 7.897 8.198 -0.301 2
1 1040 . 1 1 A 87 87 GLU HA H 87 3.838 3.760 0.077 2
1 1045 . 1 1 A 87 87 GLU C C 87 178.300 179.089 -0.789 2
1 1046 . 1 1 A 87 87 GLU CA C 87 58.690 58.780 -0.090 2
1 1047 . 1 1 A 87 87 GLU CB C 87 28.460 29.209 -0.749 2
1 1049 . 1 1 A 87 87 GLU N N 87 117.100 118.558 -1.458 2
1 1050 . 1 1 A 88 88 ASN H H 88 8.103 8.749 -0.646 2
1 1051 . 1 1 A 88 88 ASN HA H 88 4.503 4.465 0.038 2
1 1056 . 1 1 A 88 88 ASN C C 88 177.700 177.839 -0.139 2
1 1057 . 1 1 A 88 88 ASN CA C 88 55.990 56.137 -0.147 2
1 1058 . 1 1 A 88 88 ASN CB C 88 39.010 38.416 0.594 2
1 1059 . 1 1 A 88 88 ASN N N 88 118.400 117.674 0.726 2
1 1061 . 1 1 A 89 89 ILE H H 89 8.501 8.000 0.501 2
1 1062 . 1 1 A 89 89 ILE HA H 89 3.670 3.755 -0.085 2
1 1072 . 1 1 A 89 89 ILE C C 89 177.000 178.003 -1.003 2
1 1073 . 1 1 A 89 89 ILE CA C 89 65.390 65.354 0.036 2
1 1074 . 1 1 A 89 89 ILE CB C 89 37.440 37.739 -0.299 2
1 1078 . 1 1 A 89 89 ILE N N 89 118.700 119.714 -1.014 2
1 1079 . 1 1 A 90 90 LYS H H 90 8.017 7.889 0.128 2
1 1080 . 1 1 A 90 90 LYS HA H 90 3.775 3.931 -0.156 2
1 1089 . 1 1 A 90 90 LYS C C 90 178.800 178.933 -0.133 2
1 1090 . 1 1 A 90 90 LYS CA C 90 60.450 59.830 0.620 2
1 1091 . 1 1 A 90 90 LYS CB C 90 32.110 32.298 -0.188 2
1 1095 . 1 1 A 90 90 LYS N N 90 120.900 120.307 0.593 2
1 1096 . 1 1 A 91 91 GLU H H 91 7.732 7.935 -0.203 2
1 1097 . 1 1 A 91 91 GLU HA H 91 4.083 4.046 0.037 2
1 1102 . 1 1 A 91 91 GLU C C 91 179.100 179.074 0.026 2
1 1103 . 1 1 A 91 91 GLU CA C 91 59.120 58.863 0.257 2
1 1104 . 1 1 A 91 91 GLU CB C 91 28.810 29.683 -0.873 2
1 1106 . 1 1 A 91 91 GLU N N 91 119.300 118.232 1.068 2
1 1107 . 1 1 A 92 92 ILE H H 92 8.110 8.966 -0.856 2
1 1108 . 1 1 A 92 92 ILE HA H 92 3.685 3.727 -0.042 2
1 1118 . 1 1 A 92 92 ILE C C 92 178.000 178.241 -0.241 2
1 1119 . 1 1 A 92 92 ILE CA C 92 65.900 65.279 0.621 2
1 1120 . 1 1 A 92 92 ILE CB C 92 38.400 37.992 0.408 2
1 1124 . 1 1 A 92 92 ILE N N 92 121.100 120.741 0.359 2
1 1125 . 1 1 A 93 93 PHE H H 93 8.651 8.914 -0.263 2
1 1126 . 1 1 A 93 93 PHE HA H 93 3.873 3.248 0.625 2
1 1133 . 1 1 A 93 93 PHE C C 93 177.100 177.687 -0.587 2
1 1134 . 1 1 A 93 93 PHE CA C 93 61.020 61.052 -0.032 2
1 1135 . 1 1 A 93 93 PHE CB C 93 38.560 38.352 0.208 2
1 1138 . 1 1 A 93 93 PHE N N 93 119.400 121.337 -1.937 2
1 1139 . 1 1 A 94 94 HIS H H 94 8.126 7.604 0.522 2
1 1140 . 1 1 A 94 94 HIS HA H 94 4.368 3.916 0.452 2
1 1145 . 1 1 A 94 94 HIS C C 94 177.100 176.651 0.449 2
1 1146 . 1 1 A 94 94 HIS CA C 94 58.310 57.699 0.611 2
1 1147 . 1 1 A 94 94 HIS CB C 94 27.910 29.322 -1.412 2
1 1148 . 1 1 A 94 94 HIS N N 94 116.400 116.886 -0.486 2
1 1149 . 1 1 A 95 95 HIS H H 95 8.058 8.102 -0.044 2
1 1150 . 1 1 A 95 95 HIS HA H 95 4.465 4.230 0.235 2
1 1154 . 1 1 A 95 95 HIS C C 95 177.300 177.465 -0.165 2
1 1155 . 1 1 A 95 95 HIS CA C 95 57.900 59.217 -1.317 2
1 1156 . 1 1 A 95 95 HIS CB C 95 28.490 30.470 -1.980 2
1 1157 . 1 1 A 95 95 HIS N N 95 117.000 117.028 -0.028 2
1 1158 . 1 1 A 96 96 LEU H H 96 8.525 7.977 0.548 2
1 1159 . 1 1 A 96 96 LEU HA H 96 3.865 3.860 0.005 2
1 1169 . 1 1 A 96 96 LEU C C 96 178.300 178.578 -0.278 2
1 1170 . 1 1 A 96 96 LEU CA C 96 58.250 57.994 0.256 2
1 1171 . 1 1 A 96 96 LEU CB C 96 41.720 41.919 -0.199 2
1 1175 . 1 1 A 96 96 LEU N N 96 121.300 120.823 0.477 2
1 1176 . 1 1 A 97 97 GLU H H 97 8.076 8.147 -0.071 2
1 1177 . 1 1 A 97 97 GLU HA H 97 3.719 4.056 -0.337 2
1 1182 . 1 1 A 97 97 GLU C C 97 178.300 178.522 -0.222 2
1 1183 . 1 1 A 97 97 GLU CA C 97 59.300 58.677 0.623 2
1 1184 . 1 1 A 97 97 GLU CB C 97 28.960 29.548 -0.588 2
1 1186 . 1 1 A 97 97 GLU N N 97 117.100 118.399 -1.299 2
1 1187 . 1 1 A 98 98 GLU H H 98 7.329 7.799 -0.470 2
1 1188 . 1 1 A 98 98 GLU HA H 98 4.024 4.155 -0.131 2
1 1193 . 1 1 A 98 98 GLU C C 98 177.900 178.884 -0.984 2
1 1194 . 1 1 A 98 98 GLU CA C 98 58.190 58.495 -0.305 2
1 1195 . 1 1 A 98 98 GLU CB C 98 29.120 29.694 -0.574 2
1 1197 . 1 1 A 98 98 GLU N N 98 116.000 119.215 -3.215 2
1 1198 . 1 1 A 99 99 LEU H H 99 7.535 8.188 -0.653 2
1 1199 . 1 1 A 99 99 LEU HA H 99 4.183 4.127 0.056 2
1 1209 . 1 1 A 99 99 LEU C C 99 178.100 177.588 0.512 2
1 1210 . 1 1 A 99 99 LEU CA C 99 56.440 56.489 -0.049 2
1 1211 . 1 1 A 99 99 LEU CB C 99 43.010 41.396 1.614 2
1 1215 . 1 1 A 99 99 LEU N N 99 118.200 119.392 -1.192 2
1 1216 . 1 1 A 100 100 VAL H H 100 7.561 7.181 0.380 2
1 1217 . 1 1 A 100 100 VAL HA H 100 4.033 4.492 -0.459 2
1 1225 . 1 1 A 100 100 VAL C C 100 175.400 177.654 -2.254 2
1 1226 . 1 1 A 100 100 VAL CA C 100 62.430 62.603 -0.173 2
1 1227 . 1 1 A 100 100 VAL CB C 100 32.050 33.304 -1.254 2
1 1230 . 1 1 A 100 100 VAL N N 100 114.800 112.496 2.304 2
1 1231 . 1 1 A 101 101 HIS H H 101 7.827 8.000 -0.173 2
1 1232 . 1 1 A 101 101 HIS HA H 101 4.630 4.258 0.372 2
1 1237 . 1 1 A 101 101 HIS C C 101 173.500 176.046 -2.546 2
1 1238 . 1 1 A 101 101 HIS CA C 101 55.410 58.816 -3.406 2
1 1239 . 1 1 A 101 101 HIS CB C 101 28.870 29.887 -1.017 2
1 1240 . 1 1 A 101 101 HIS N N 101 120.300 122.532 -2.232 2
stop_
save_