data_10251_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 10251
_Entry.PDB_ID 1X1G
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 1 A 7 7 GLY HA2 H 7 3.978 4.008 -0.030 1
1 2 . 1 1 1 A 7 7 GLY HA3 H 7 3.978 4.010 -0.032 1
1 3 . 1 1 1 A 7 7 GLY C C 7 174.274 174.262 0.012 1
1 4 . 1 1 1 A 7 7 GLY CA C 7 45.383 45.979 -0.596 1
1 5 . 1 1 1 A 8 8 SER H H 8 8.211 8.152 0.059 1
1 6 . 1 1 1 A 8 8 SER HA H 8 4.425 4.727 -0.302 1
1 9 . 1 1 1 A 8 8 SER C C 8 174.635 174.364 0.271 1
1 10 . 1 1 1 A 8 8 SER CA C 8 58.425 59.170 -0.745 1
1 11 . 1 1 1 A 8 8 SER CB C 8 63.885 64.775 -0.890 1
1 12 . 1 1 1 A 8 8 SER N N 8 115.732 115.547 0.185 1
1 13 . 1 1 1 A 9 9 LEU H H 9 8.316 7.687 0.629 1
1 14 . 1 1 1 A 9 9 LEU HA H 9 4.334 4.278 0.056 1
1 24 . 1 1 1 A 9 9 LEU C C 9 177.447 176.871 0.576 1
1 25 . 1 1 1 A 9 9 LEU CA C 9 55.407 55.137 0.270 1
1 26 . 1 1 1 A 9 9 LEU CB C 9 42.171 42.486 -0.315 1
1 30 . 1 1 1 A 9 9 LEU N N 9 123.943 122.421 1.522 1
1 31 . 1 1 1 A 10 10 SER H H 10 8.304 8.489 -0.185 1
1 32 . 1 1 1 A 10 10 SER HA H 10 4.424 5.053 -0.629 1
1 35 . 1 1 1 A 10 10 SER C C 10 175.025 174.490 0.535 1
1 36 . 1 1 1 A 10 10 SER CA C 10 58.425 56.205 2.220 1
1 37 . 1 1 1 A 10 10 SER CB C 10 63.638 65.043 -1.405 1
1 38 . 1 1 1 A 10 10 SER N N 10 116.718 113.634 3.084 1
1 39 . 1 1 1 A 11 11 THR H H 11 8.003 8.588 -0.585 1
1 40 . 1 1 1 A 11 11 THR HA H 11 4.196 4.236 -0.040 1
1 45 . 1 1 1 A 11 11 THR C C 11 176.296 174.206 2.090 1
1 46 . 1 1 1 A 11 11 THR CA C 11 62.483 63.660 -1.177 1
1 47 . 1 1 1 A 11 11 THR CB C 11 69.266 69.431 -0.165 1
1 49 . 1 1 1 A 11 11 THR N N 11 114.902 118.329 -3.427 1
1 50 . 1 1 1 A 12 12 VAL H H 12 8.095 8.414 -0.319 1
1 51 . 1 1 1 A 12 12 VAL HA H 12 3.826 4.258 -0.432 1
1 59 . 1 1 1 A 12 12 VAL C C 12 178.501 176.993 1.508 1
1 60 . 1 1 1 A 12 12 VAL CA C 12 64.760 63.453 1.307 1
1 61 . 1 1 1 A 12 12 VAL CB C 12 32.013 32.650 -0.637 1
1 64 . 1 1 1 A 12 12 VAL N N 12 122.111 121.636 0.475 1
1 65 . 1 1 1 A 13 13 GLU H H 13 8.151 9.100 -0.949 1
1 66 . 1 1 1 A 13 13 GLU HA H 13 3.244 4.400 -1.156 1
1 71 . 1 1 1 A 13 13 GLU C C 13 175.702 178.595 -2.893 1
1 72 . 1 1 1 A 13 13 GLU CA C 13 58.354 59.721 -1.367 1
1 73 . 1 1 1 A 13 13 GLU CB C 13 28.843 29.036 -0.193 1
1 75 . 1 1 1 A 13 13 GLU N N 13 120.316 122.996 -2.680 1
1 76 . 1 1 1 A 14 14 LEU H H 14 7.067 7.726 -0.659 1
1 77 . 1 1 1 A 14 14 LEU HA H 14 4.157 4.306 -0.149 1
1 87 . 1 1 1 A 14 14 LEU C C 14 176.863 176.830 0.033 1
1 88 . 1 1 1 A 14 14 LEU CA C 14 53.324 54.452 -1.128 1
1 89 . 1 1 1 A 14 14 LEU CB C 14 41.636 41.126 0.510 1
1 93 . 1 1 1 A 14 14 LEU N N 14 117.035 119.157 -2.122 1
1 94 . 1 1 1 A 15 15 SER H H 15 7.645 8.672 -1.027 1
1 95 . 1 1 1 A 15 15 SER HA H 15 4.305 4.671 -0.366 1
1 98 . 1 1 1 A 15 15 SER C C 15 175.340 173.226 2.114 1
1 99 . 1 1 1 A 15 15 SER CA C 15 59.783 57.332 2.451 1
1 100 . 1 1 1 A 15 15 SER CB C 15 64.625 62.564 2.061 1
1 101 . 1 1 1 A 15 15 SER N N 15 114.216 115.483 -1.267 1
1 102 . 1 1 1 A 16 16 GLY H H 16 8.506 8.095 0.411 1
1 103 . 1 1 1 A 16 16 GLY HA2 H 16 4.237 4.250 -0.013 1
1 104 . 1 1 1 A 16 16 GLY HA3 H 16 3.927 4.266 -0.339 1
1 105 . 1 1 1 A 16 16 GLY C C 16 173.661 172.340 1.321 1
1 106 . 1 1 1 A 16 16 GLY CA C 16 44.995 43.571 1.424 1
1 107 . 1 1 1 A 16 16 GLY N N 16 111.838 111.749 0.089 1
1 108 . 1 1 1 A 17 17 THR H H 17 8.482 8.878 -0.396 1
1 109 . 1 1 1 A 17 17 THR HA H 17 4.319 4.339 -0.020 1
1 114 . 1 1 1 A 17 17 THR C C 17 174.758 174.510 0.248 1
1 115 . 1 1 1 A 17 17 THR CA C 17 62.272 63.594 -1.322 1
1 116 . 1 1 1 A 17 17 THR CB C 17 70.706 68.859 1.847 1
1 118 . 1 1 1 A 17 17 THR N N 17 116.679 115.314 1.365 1
1 119 . 1 1 1 A 18 18 VAL H H 18 8.948 8.799 0.149 1
1 120 . 1 1 1 A 18 18 VAL HA H 18 3.950 4.362 -0.412 1
1 128 . 1 1 1 A 18 18 VAL C C 18 176.669 176.991 -0.322 1
1 129 . 1 1 1 A 18 18 VAL CA C 18 64.813 63.618 1.195 1
1 130 . 1 1 1 A 18 18 VAL CB C 18 31.807 31.862 -0.055 1
1 133 . 1 1 1 A 18 18 VAL N N 18 127.156 127.734 -0.578 1
1 134 . 1 1 1 A 19 19 VAL H H 19 9.359 9.145 0.214 1
1 135 . 1 1 1 A 19 19 VAL HA H 19 4.234 4.388 -0.154 1
1 143 . 1 1 1 A 19 19 VAL C C 19 175.738 175.778 -0.040 1
1 144 . 1 1 1 A 19 19 VAL CA C 19 62.060 62.041 0.019 1
1 145 . 1 1 1 A 19 19 VAL CB C 19 33.822 33.435 0.387 1
1 148 . 1 1 1 A 19 19 VAL N N 19 125.162 121.703 3.459 1
1 149 . 1 1 1 A 20 20 LYS H H 20 7.584 7.179 0.405 1
1 150 . 1 1 1 A 20 20 LYS HA H 20 4.346 4.483 -0.137 1
1 159 . 1 1 1 A 20 20 LYS C C 20 172.818 173.994 -1.176 1
1 160 . 1 1 1 A 20 20 LYS CA C 20 56.801 55.591 1.210 1
1 161 . 1 1 1 A 20 20 LYS CB C 20 36.624 35.596 1.028 1
1 165 . 1 1 1 A 20 20 LYS N N 20 121.024 121.024 0.000 1
1 166 . 1 1 1 A 21 21 GLN H H 21 8.625 8.518 0.107 1
1 167 . 1 1 1 A 21 21 GLN HA H 21 6.003 5.366 0.637 1
1 174 . 1 1 1 A 21 21 GLN C C 21 174.914 174.933 -0.019 1
1 175 . 1 1 1 A 21 21 GLN CA C 21 54.207 54.651 -0.444 1
1 176 . 1 1 1 A 21 21 GLN CB C 21 33.452 33.517 -0.065 1
1 178 . 1 1 1 A 21 21 GLN N N 21 122.108 124.294 -2.186 1
1 180 . 1 1 1 A 22 22 GLY H H 22 8.964 8.358 0.606 1
1 181 . 1 1 1 A 22 22 GLY HA2 H 22 4.665 4.395 0.270 1
1 182 . 1 1 1 A 22 22 GLY HA3 H 22 4.295 4.597 -0.302 1
1 183 . 1 1 1 A 22 22 GLY C C 22 170.879 171.685 -0.806 1
1 184 . 1 1 1 A 22 22 GLY CA C 22 45.683 45.914 -0.231 1
1 185 . 1 1 1 A 22 22 GLY N N 22 108.508 109.139 -0.631 1
1 186 . 1 1 1 A 23 23 TYR H H 23 9.145 8.765 0.380 1
1 187 . 1 1 1 A 23 23 TYR HA H 23 5.595 5.482 0.113 1
1 194 . 1 1 1 A 23 23 TYR C C 23 175.824 175.262 0.562 1
1 195 . 1 1 1 A 23 23 TYR CA C 23 58.019 56.353 1.666 1
1 196 . 1 1 1 A 23 23 TYR CB C 23 39.251 41.004 -1.753 1
1 201 . 1 1 1 A 23 23 TYR N N 23 120.809 120.040 0.769 1
1 202 . 1 1 1 A 24 24 LEU H H 24 8.935 9.886 -0.951 1
1 203 . 1 1 1 A 24 24 LEU HA H 24 4.716 5.021 -0.305 1
1 213 . 1 1 1 A 24 24 LEU C C 24 174.648 175.719 -1.071 1
1 214 . 1 1 1 A 24 24 LEU CA C 24 53.907 53.269 0.638 1
1 215 . 1 1 1 A 24 24 LEU CB C 24 46.078 45.517 0.561 1
1 219 . 1 1 1 A 24 24 LEU N N 24 122.887 124.364 -1.477 1
1 220 . 1 1 1 A 25 25 ALA H H 25 8.145 8.492 -0.347 1
1 221 . 1 1 1 A 25 25 ALA HA H 25 5.477 5.511 -0.034 1
1 225 . 1 1 1 A 25 25 ALA C C 25 175.751 175.587 0.164 1
1 226 . 1 1 1 A 25 25 ALA CA C 25 50.719 50.474 0.245 1
1 227 . 1 1 1 A 25 25 ALA CB C 25 21.074 20.777 0.297 1
1 228 . 1 1 1 A 25 25 ALA N N 25 122.280 123.458 -1.178 1
1 229 . 1 1 1 A 26 26 LYS H H 26 9.167 8.520 0.647 1
1 230 . 1 1 1 A 26 26 LYS HA H 26 5.221 4.311 0.910 1
1 239 . 1 1 1 A 26 26 LYS C C 26 175.421 175.759 -0.338 1
1 240 . 1 1 1 A 26 26 LYS CA C 26 54.383 55.319 -0.936 1
1 241 . 1 1 1 A 26 26 LYS CB C 26 36.125 33.691 2.434 1
1 245 . 1 1 1 A 26 26 LYS N N 26 120.638 125.321 -4.683 1
1 246 . 1 1 1 A 27 27 GLN H H 27 7.866 7.686 0.180 1
1 247 . 1 1 1 A 27 27 GLN HA H 27 3.525 4.077 -0.552 1
1 254 . 1 1 1 A 27 27 GLN C C 27 177.022 175.118 1.904 1
1 255 . 1 1 1 A 27 27 GLN CA C 27 55.778 54.300 1.478 1
1 256 . 1 1 1 A 27 27 GLN CB C 27 29.864 28.826 1.038 1
1 258 . 1 1 1 A 27 27 GLN N N 27 130.194 125.964 4.230 1
1 260 . 1 1 1 A 28 28 GLY H H 28 8.565 8.444 0.121 1
1 261 . 1 1 1 A 28 28 GLY HA2 H 28 4.125 4.091 0.034 1
1 262 . 1 1 1 A 28 28 GLY HA3 H 28 4.034 4.150 -0.116 1
1 263 . 1 1 1 A 28 28 GLY C C 28 174.030 172.918 1.112 1
1 264 . 1 1 1 A 28 28 GLY CA C 28 45.665 44.858 0.807 1
1 265 . 1 1 1 A 28 28 GLY N N 28 115.528 111.960 3.568 1
1 266 . 1 1 1 A 29 29 HIS HA H 29 4.355 4.426 -0.071 1
1 271 . 1 1 1 A 29 29 HIS CA C 29 58.795 56.051 2.744 1
1 272 . 1 1 1 A 29 29 HIS CB C 29 31.283 30.989 0.294 1
1 275 . 1 1 1 A 30 30 LYS HA H 30 4.096 4.214 -0.118 1
1 284 . 1 1 1 A 30 30 LYS CA C 30 57.290 56.752 0.538 1
1 285 . 1 1 1 A 30 30 LYS CB C 30 31.951 32.156 -0.205 1
1 289 . 1 1 1 A 31 31 ARG HA H 31 3.975 4.157 -0.182 1
1 296 . 1 1 1 A 31 31 ARG CA C 31 55.973 58.482 -2.509 1
1 297 . 1 1 1 A 31 31 ARG CB C 31 29.902 29.258 0.644 1
1 300 . 1 1 1 A 32 32 LYS HA H 32 4.160 4.129 0.031 1
1 309 . 1 1 1 A 32 32 LYS C C 32 175.678 177.902 -2.224 1
1 310 . 1 1 1 A 32 32 LYS CA C 32 56.254 56.940 -0.686 1
1 311 . 1 1 1 A 32 32 LYS CB C 32 31.602 33.789 -2.187 1
1 315 . 1 1 1 A 33 33 ASN H H 33 7.925 8.835 -0.910 1
1 316 . 1 1 1 A 33 33 ASN HA H 33 4.799 4.429 0.370 1
1 321 . 1 1 1 A 33 33 ASN C C 33 174.005 175.777 -1.772 1
1 322 . 1 1 1 A 33 33 ASN CA C 33 52.407 56.778 -4.371 1
1 323 . 1 1 1 A 33 33 ASN CB C 33 39.879 38.709 1.170 1
1 324 . 1 1 1 A 33 33 ASN N N 33 116.990 120.973 -3.983 1
1 326 . 1 1 1 A 34 34 TRP H H 34 8.798 8.043 0.755 1
1 327 . 1 1 1 A 34 34 TRP HA H 34 4.755 5.316 -0.561 1
1 336 . 1 1 1 A 34 34 TRP C C 34 176.090 175.787 0.303 1
1 337 . 1 1 1 A 34 34 TRP CA C 34 57.119 55.986 1.133 1
1 338 . 1 1 1 A 34 34 TRP CB C 34 30.596 32.564 -1.968 1
1 344 . 1 1 1 A 34 34 TRP N N 34 121.917 117.176 4.741 1
1 346 . 1 1 1 A 35 35 LYS H H 35 8.404 8.678 -0.274 1
1 347 . 1 1 1 A 35 35 LYS HA H 35 4.846 4.963 -0.117 1
1 354 . 1 1 1 A 35 35 LYS C C 35 176.088 176.038 0.050 1
1 355 . 1 1 1 A 35 35 LYS CA C 35 54.418 54.816 -0.398 1
1 356 . 1 1 1 A 35 35 LYS CB C 35 36.125 36.191 -0.066 1
1 360 . 1 1 1 A 35 35 LYS N N 35 120.864 123.585 -2.721 1
1 361 . 1 1 1 A 36 36 VAL H H 36 8.977 8.677 0.300 1
1 362 . 1 1 1 A 36 36 VAL HA H 36 4.274 4.656 -0.382 1
1 370 . 1 1 1 A 36 36 VAL C C 36 176.733 176.017 0.716 1
1 371 . 1 1 1 A 36 36 VAL CA C 36 64.319 62.530 1.789 1
1 372 . 1 1 1 A 36 36 VAL CB C 36 31.602 31.659 -0.057 1
1 375 . 1 1 1 A 36 36 VAL N N 36 124.314 124.804 -0.490 1
1 376 . 1 1 1 A 37 37 ARG H H 37 9.498 10.497 -0.999 1
1 377 . 1 1 1 A 37 37 ARG HA H 37 5.053 5.126 -0.073 1
1 384 . 1 1 1 A 37 37 ARG C C 37 174.442 174.808 -0.366 1
1 385 . 1 1 1 A 37 37 ARG CA C 37 53.272 54.151 -0.879 1
1 386 . 1 1 1 A 37 37 ARG CB C 37 34.563 34.385 0.178 1
1 389 . 1 1 1 A 37 37 ARG N N 37 128.121 127.231 0.890 1
1 390 . 1 1 1 A 38 38 ARG H H 38 8.755 8.698 0.057 1
1 391 . 1 1 1 A 38 38 ARG HA H 38 4.626 4.468 0.158 1
1 398 . 1 1 1 A 38 38 ARG C C 38 175.514 175.240 0.274 1
1 399 . 1 1 1 A 38 38 ARG CA C 38 55.601 55.840 -0.239 1
1 400 . 1 1 1 A 38 38 ARG CB C 38 32.219 30.613 1.606 1
1 403 . 1 1 1 A 38 38 ARG N N 38 121.442 123.359 -1.917 1
1 404 . 1 1 1 A 39 39 PHE H H 39 9.865 8.959 0.906 1
1 405 . 1 1 1 A 39 39 PHE HA H 39 5.424 5.073 0.351 1
1 413 . 1 1 1 A 39 39 PHE C C 39 175.423 174.819 0.604 1
1 414 . 1 1 1 A 39 39 PHE CA C 39 57.419 56.887 0.532 1
1 415 . 1 1 1 A 39 39 PHE CB C 39 42.623 41.377 1.246 1
1 421 . 1 1 1 A 39 39 PHE N N 39 130.027 126.542 3.485 1
1 422 . 1 1 1 A 40 40 VAL H H 40 9.300 9.989 -0.689 1
1 423 . 1 1 1 A 40 40 VAL HA H 40 4.846 5.317 -0.471 1
1 431 . 1 1 1 A 40 40 VAL C C 40 174.477 173.217 1.260 1
1 432 . 1 1 1 A 40 40 VAL CA C 40 62.343 59.913 2.430 1
1 433 . 1 1 1 A 40 40 VAL CB C 40 35.755 35.185 0.570 1
1 436 . 1 1 1 A 40 40 VAL N N 40 119.369 121.467 -2.098 1
1 437 . 1 1 1 A 41 41 LEU H H 41 9.557 9.986 -0.429 1
1 438 . 1 1 1 A 41 41 LEU HA H 41 5.292 5.557 -0.265 1
1 448 . 1 1 1 A 41 41 LEU C C 41 174.632 175.310 -0.678 1
1 449 . 1 1 1 A 41 41 LEU CA C 41 53.571 53.660 -0.089 1
1 450 . 1 1 1 A 41 41 LEU CB C 41 45.337 44.815 0.522 1
1 454 . 1 1 1 A 41 41 LEU N N 41 132.121 129.365 2.756 1
1 455 . 1 1 1 A 42 42 ARG H H 42 9.396 9.057 0.339 1
1 456 . 1 1 1 A 42 42 ARG HA H 42 5.366 5.282 0.084 1
1 464 . 1 1 1 A 42 42 ARG C C 42 173.997 174.651 -0.654 1
1 465 . 1 1 1 A 42 42 ARG CA C 42 54.631 54.166 0.465 1
1 466 . 1 1 1 A 42 42 ARG CB C 42 35.550 34.635 0.915 1
1 469 . 1 1 1 A 42 42 ARG N N 42 128.120 123.826 4.294 1
1 471 . 1 1 1 A 43 43 LYS H H 43 8.597 8.587 0.010 1
1 472 . 1 1 1 A 43 43 LYS HA H 43 4.558 4.872 -0.314 1
1 481 . 1 1 1 A 43 43 LYS C C 43 174.648 175.209 -0.561 1
1 482 . 1 1 1 A 43 43 LYS CA C 43 53.378 55.014 -1.636 1
1 483 . 1 1 1 A 43 43 LYS CB C 43 37.303 35.704 1.599 1
1 487 . 1 1 1 A 43 43 LYS N N 43 114.484 117.691 -3.207 1
1 488 . 1 1 1 A 44 44 ASP H H 44 8.388 8.940 -0.552 1
1 489 . 1 1 1 A 44 44 ASP HA H 44 4.349 4.176 0.173 1
1 492 . 1 1 1 A 44 44 ASP C C 44 173.376 174.119 -0.743 1
1 493 . 1 1 1 A 44 44 ASP CA C 44 54.842 54.879 -0.037 1
1 494 . 1 1 1 A 44 44 ASP CB C 44 39.991 39.592 0.399 1
1 495 . 1 1 1 A 44 44 ASP N N 44 115.453 119.212 -3.759 1
1 496 . 1 1 1 A 45 45 PRO HA H 45 4.652 4.401 0.251 1
1 503 . 1 1 1 A 45 45 PRO C C 45 176.914 175.146 1.768 1
1 504 . 1 1 1 A 45 45 PRO CA C 45 63.490 62.344 1.146 1
1 505 . 1 1 1 A 45 45 PRO CB C 45 34.892 32.293 2.599 1
1 508 . 1 1 1 A 46 46 ALA H H 46 8.112 7.940 0.172 1
1 509 . 1 1 1 A 46 46 ALA HA H 46 5.455 4.533 0.922 1
1 513 . 1 1 1 A 46 46 ALA C C 46 177.234 176.399 0.835 1
1 514 . 1 1 1 A 46 46 ALA CA C 46 51.560 50.499 1.061 1
1 515 . 1 1 1 A 46 46 ALA CB C 46 20.122 19.584 0.538 1
1 516 . 1 1 1 A 46 46 ALA N N 46 120.155 123.237 -3.082 1
1 517 . 1 1 1 A 47 47 PHE H H 47 8.717 8.885 -0.168 1
1 518 . 1 1 1 A 47 47 PHE HA H 47 4.795 5.056 -0.261 1
1 526 . 1 1 1 A 47 47 PHE C C 47 172.588 174.389 -1.801 1
1 527 . 1 1 1 A 47 47 PHE CA C 47 57.348 56.296 1.052 1
1 528 . 1 1 1 A 47 47 PHE CB C 47 47.123 43.940 3.183 1
1 534 . 1 1 1 A 47 47 PHE N N 47 129.946 120.268 9.678 1
1 535 . 1 1 1 A 48 48 LEU H H 48 7.883 8.567 -0.684 1
1 536 . 1 1 1 A 48 48 LEU HA H 48 5.198 5.260 -0.062 1
1 546 . 1 1 1 A 48 48 LEU C C 48 173.569 174.485 -0.916 1
1 547 . 1 1 1 A 48 48 LEU CA C 48 53.290 54.078 -0.788 1
1 548 . 1 1 1 A 48 48 LEU CB C 48 45.502 45.375 0.127 1
1 552 . 1 1 1 A 48 48 LEU N N 48 121.108 122.038 -0.930 1
1 553 . 1 1 1 A 49 49 HIS H H 49 8.606 8.995 -0.389 1
1 554 . 1 1 1 A 49 49 HIS HA H 49 5.035 4.942 0.093 1
1 559 . 1 1 1 A 49 49 HIS C C 49 173.993 173.500 0.493 1
1 560 . 1 1 1 A 49 49 HIS CA C 49 56.483 54.000 2.483 1
1 561 . 1 1 1 A 49 49 HIS CB C 49 35.919 33.664 2.255 1
1 564 . 1 1 1 A 49 49 HIS N N 49 121.199 125.697 -4.498 1
1 565 . 1 1 1 A 50 50 TYR H H 50 7.777 8.280 -0.503 1
1 566 . 1 1 1 A 50 50 TYR HA H 50 5.695 5.571 0.124 1
1 573 . 1 1 1 A 50 50 TYR C C 50 174.284 172.240 2.044 1
1 574 . 1 1 1 A 50 50 TYR CA C 50 53.430 55.144 -1.714 1
1 575 . 1 1 1 A 50 50 TYR CB C 50 38.552 41.167 -2.615 1
1 580 . 1 1 1 A 50 50 TYR N N 50 114.156 117.346 -3.190 1
1 581 . 1 1 1 A 51 51 TYR H H 51 9.323 9.859 -0.536 1
1 582 . 1 1 1 A 51 51 TYR HA H 51 4.600 5.007 -0.407 1
1 589 . 1 1 1 A 51 51 TYR C C 51 175.352 174.487 0.865 1
1 590 . 1 1 1 A 51 51 TYR CA C 51 57.330 56.176 1.154 1
1 591 . 1 1 1 A 51 51 TYR CB C 51 41.683 41.495 0.188 1
1 596 . 1 1 1 A 51 51 TYR N N 51 119.100 120.309 -1.209 1
1 597 . 1 1 1 A 52 52 ASP H H 52 9.375 8.643 0.732 1
1 598 . 1 1 1 A 52 52 ASP HA H 52 5.064 4.907 0.157 1
1 601 . 1 1 1 A 52 52 ASP C C 52 175.484 176.113 -0.629 1
1 602 . 1 1 1 A 52 52 ASP CA C 52 51.313 51.304 0.009 1
1 603 . 1 1 1 A 52 52 ASP CB C 52 41.883 42.286 -0.403 1
1 604 . 1 1 1 A 52 52 ASP N N 52 124.636 124.194 0.442 1
1 605 . 1 1 1 A 53 53 PRO HA H 53 4.678 4.464 0.214 1
1 612 . 1 1 1 A 53 53 PRO C C 53 176.781 177.864 -1.083 1
1 613 . 1 1 1 A 53 53 PRO CA C 53 64.054 64.939 -0.885 1
1 614 . 1 1 1 A 53 53 PRO CB C 53 32.589 32.224 0.365 1
1 617 . 1 1 1 A 54 54 SER H H 54 8.685 8.301 0.384 1
1 618 . 1 1 1 A 54 54 SER HA H 54 4.483 4.234 0.249 1
1 621 . 1 1 1 A 54 54 SER C C 54 174.006 174.462 -0.456 1
1 622 . 1 1 1 A 54 54 SER CA C 54 59.378 61.151 -1.773 1
1 623 . 1 1 1 A 54 54 SER CB C 54 64.132 63.019 1.113 1
1 624 . 1 1 1 A 54 54 SER N N 54 113.769 112.330 1.439 1
1 625 . 1 1 1 A 55 55 LYS H H 55 7.706 7.884 -0.178 1
1 626 . 1 1 1 A 55 55 LYS HA H 55 4.580 4.790 -0.210 1
1 635 . 1 1 1 A 55 55 LYS C C 55 175.969 175.815 0.154 1
1 636 . 1 1 1 A 55 55 LYS CA C 55 55.160 54.616 0.544 1
1 637 . 1 1 1 A 55 55 LYS CB C 55 34.069 34.167 -0.098 1
1 641 . 1 1 1 A 55 55 LYS N N 55 122.222 120.149 2.073 1
1 642 . 1 1 1 A 56 56 GLU H H 56 8.666 8.705 -0.039 1
1 643 . 1 1 1 A 56 56 GLU HA H 56 4.174 4.810 -0.636 1
1 648 . 1 1 1 A 56 56 GLU C C 56 177.084 174.629 2.455 1
1 649 . 1 1 1 A 56 56 GLU CA C 56 57.099 55.498 1.601 1
1 650 . 1 1 1 A 56 56 GLU CB C 56 29.694 30.412 -0.718 1
1 652 . 1 1 1 A 56 56 GLU N N 56 122.015 119.262 2.753 1
1 653 . 1 1 1 A 57 57 GLU H H 57 8.303 8.080 0.223 1
1 654 . 1 1 1 A 57 57 GLU HA H 57 4.214 4.721 -0.507 1
1 659 . 1 1 1 A 57 57 GLU CA C 57 56.960 55.353 1.607 1
1 660 . 1 1 1 A 57 57 GLU CB C 57 30.264 32.007 -1.743 1
1 662 . 1 1 1 A 57 57 GLU N N 57 119.884 123.603 -3.719 1
1 663 . 1 1 1 A 58 58 ASN HA H 58 4.768 4.414 0.354 1
1 668 . 1 1 1 A 58 58 ASN C C 58 174.902 176.324 -1.422 1
1 669 . 1 1 1 A 58 58 ASN CA C 58 52.740 57.062 -4.322 1
1 670 . 1 1 1 A 58 58 ASN CB C 58 38.116 38.225 -0.109 1
1 672 . 1 1 1 A 59 59 ARG H H 59 7.805 7.813 -0.008 1
1 673 . 1 1 1 A 59 59 ARG HA H 59 4.762 4.559 0.203 1
1 680 . 1 1 1 A 59 59 ARG CA C 59 53.151 54.933 -1.782 1
1 681 . 1 1 1 A 59 59 ARG CB C 59 31.519 29.912 1.607 1
1 684 . 1 1 1 A 59 59 ARG N N 59 121.060 118.150 2.910 1
1 685 . 1 1 1 A 60 60 PRO HA H 60 3.357 3.848 -0.491 1
1 692 . 1 1 1 A 60 60 PRO C C 60 176.817 176.472 0.345 1
1 693 . 1 1 1 A 60 60 PRO CA C 60 63.031 61.859 1.172 1
1 694 . 1 1 1 A 60 60 PRO CB C 60 31.273 31.812 -0.539 1
1 697 . 1 1 1 A 61 61 VAL H H 61 8.627 9.031 -0.404 1
1 698 . 1 1 1 A 61 61 VAL HA H 61 3.966 3.788 0.178 1
1 706 . 1 1 1 A 61 61 VAL C C 61 176.503 176.142 0.361 1
1 707 . 1 1 1 A 61 61 VAL CA C 61 63.154 64.512 -1.358 1
1 708 . 1 1 1 A 61 61 VAL CB C 61 32.048 32.189 -0.141 1
1 711 . 1 1 1 A 61 61 VAL N N 61 119.185 119.612 -0.427 1
1 712 . 1 1 1 A 62 62 GLY H H 62 6.715 6.020 0.695 1
1 713 . 1 1 1 A 62 62 GLY HA2 H 62 3.940 3.744 0.196 1
1 714 . 1 1 1 A 62 62 GLY HA3 H 62 3.538 3.822 -0.284 1
1 715 . 1 1 1 A 62 62 GLY C C 62 169.983 171.588 -1.605 1
1 716 . 1 1 1 A 62 62 GLY CA C 62 44.465 45.313 -0.848 1
1 717 . 1 1 1 A 62 62 GLY N N 62 105.813 105.531 0.282 1
1 718 . 1 1 1 A 63 63 GLY H H 63 8.004 8.390 -0.386 1
1 719 . 1 1 1 A 63 63 GLY HA2 H 63 4.095 3.140 0.955 1
1 720 . 1 1 1 A 63 63 GLY HA3 H 63 3.813 3.578 0.235 1
1 721 . 1 1 1 A 63 63 GLY C C 63 171.870 172.085 -0.215 1
1 722 . 1 1 1 A 63 63 GLY CA C 63 47.148 44.520 2.628 1
1 723 . 1 1 1 A 63 63 GLY N N 63 105.089 107.591 -2.502 1
1 724 . 1 1 1 A 64 64 PHE H H 64 7.967 7.429 0.538 1
1 725 . 1 1 1 A 64 64 PHE HA H 64 4.934 5.551 -0.617 1
1 733 . 1 1 1 A 64 64 PHE C C 64 173.140 174.594 -1.454 1
1 734 . 1 1 1 A 64 64 PHE CA C 64 55.248 55.244 0.004 1
1 735 . 1 1 1 A 64 64 PHE CB C 64 40.238 42.455 -2.217 1
1 741 . 1 1 1 A 64 64 PHE N N 64 113.387 121.688 -8.301 1
1 742 . 1 1 1 A 65 65 SER H H 65 8.518 9.017 -0.499 1
1 743 . 1 1 1 A 65 65 SER HA H 65 3.264 4.875 -1.611 1
1 746 . 1 1 1 A 65 65 SER C C 65 176.417 174.050 2.367 1
1 747 . 1 1 1 A 65 65 SER CA C 65 56.819 59.828 -3.009 1
1 748 . 1 1 1 A 65 65 SER CB C 65 63.391 64.133 -0.742 1
1 749 . 1 1 1 A 65 65 SER N N 65 114.674 117.364 -2.690 1
1 750 . 1 1 1 A 66 66 LEU H H 66 7.404 8.597 -1.193 1
1 751 . 1 1 1 A 66 66 LEU HA H 66 4.470 4.534 -0.064 1
1 761 . 1 1 1 A 66 66 LEU C C 66 177.993 178.658 -0.665 1
1 762 . 1 1 1 A 66 66 LEU CA C 66 54.242 56.322 -2.080 1
1 763 . 1 1 1 A 66 66 LEU CB C 66 42.787 42.345 0.442 1
1 767 . 1 1 1 A 66 66 LEU N N 66 123.988 126.801 -2.813 1
1 768 . 1 1 1 A 67 67 ARG H H 67 7.865 8.199 -0.334 1
1 769 . 1 1 1 A 67 67 ARG HA H 67 4.175 4.002 0.173 1
1 776 . 1 1 1 A 67 67 ARG C C 67 178.562 178.076 0.486 1
1 777 . 1 1 1 A 67 67 ARG CA C 67 58.143 59.358 -1.215 1
1 778 . 1 1 1 A 67 67 ARG CB C 67 29.052 30.249 -1.197 1
1 781 . 1 1 1 A 67 67 ARG N N 67 122.494 117.608 4.886 1
1 782 . 1 1 1 A 68 68 GLY H H 68 9.398 8.276 1.122 1
1 783 . 1 1 1 A 68 68 GLY HA2 H 68 4.066 3.929 0.137 1
1 784 . 1 1 1 A 68 68 GLY HA3 H 68 3.908 3.943 -0.035 1
1 785 . 1 1 1 A 68 68 GLY C C 68 173.982 173.626 0.356 1
1 786 . 1 1 1 A 68 68 GLY CA C 68 46.230 46.636 -0.406 1
1 787 . 1 1 1 A 68 68 GLY N N 68 117.548 108.070 9.478 1
1 788 . 1 1 1 A 69 69 SER H H 69 7.829 7.652 0.177 1
1 789 . 1 1 1 A 69 69 SER HA H 69 4.807 5.352 -0.545 1
1 792 . 1 1 1 A 69 69 SER C C 69 172.854 172.679 0.175 1
1 793 . 1 1 1 A 69 69 SER CA C 69 59.290 57.490 1.800 1
1 794 . 1 1 1 A 69 69 SER CB C 69 65.366 68.038 -2.672 1
1 795 . 1 1 1 A 69 69 SER N N 69 115.188 114.986 0.202 1
1 796 . 1 1 1 A 70 70 LEU H H 70 8.805 8.557 0.248 1
1 797 . 1 1 1 A 70 70 LEU HA H 70 4.846 4.910 -0.064 1
1 807 . 1 1 1 A 70 70 LEU C C 70 175.775 174.279 1.496 1
1 808 . 1 1 1 A 70 70 LEU CA C 70 53.907 53.811 0.096 1
1 809 . 1 1 1 A 70 70 LEU CB C 70 45.337 44.645 0.692 1
1 813 . 1 1 1 A 70 70 LEU N N 70 121.265 123.271 -2.006 1
1 814 . 1 1 1 A 71 71 VAL H H 71 8.644 8.649 -0.005 1
1 815 . 1 1 1 A 71 71 VAL HA H 71 5.555 5.169 0.386 1
1 823 . 1 1 1 A 71 71 VAL C C 71 173.636 173.332 0.304 1
1 824 . 1 1 1 A 71 71 VAL CA C 71 58.760 60.199 -1.439 1
1 825 . 1 1 1 A 71 71 VAL CB C 71 34.891 35.462 -0.571 1
1 828 . 1 1 1 A 71 71 VAL N N 71 122.315 122.192 0.123 1
1 829 . 1 1 1 A 72 72 SER H H 72 8.750 9.145 -0.395 1
1 830 . 1 1 1 A 72 72 SER HA H 72 4.742 4.963 -0.221 1
1 833 . 1 1 1 A 72 72 SER C C 72 173.058 172.913 0.145 1
1 834 . 1 1 1 A 72 72 SER CA C 72 57.190 57.815 -0.625 1
1 835 . 1 1 1 A 72 72 SER CB C 72 65.612 67.592 -1.980 1
1 836 . 1 1 1 A 72 72 SER N N 72 118.611 122.040 -3.429 1
1 837 . 1 1 1 A 73 73 ALA H H 73 9.009 8.751 0.258 1
1 838 . 1 1 1 A 73 73 ALA HA H 73 4.406 5.092 -0.686 1
1 842 . 1 1 1 A 73 73 ALA C C 73 176.708 176.812 -0.104 1
1 843 . 1 1 1 A 73 73 ALA CA C 73 52.672 50.323 2.349 1
1 844 . 1 1 1 A 73 73 ALA CB C 73 18.812 21.916 -3.104 1
1 845 . 1 1 1 A 73 73 ALA N N 73 125.694 125.221 0.473 1
1 846 . 1 1 1 A 74 74 LEU H H 74 7.800 8.728 -0.928 1
1 847 . 1 1 1 A 74 74 LEU HA H 74 4.716 4.520 0.196 1
1 857 . 1 1 1 A 74 74 LEU C C 74 176.551 176.535 0.016 1
1 858 . 1 1 1 A 74 74 LEU CA C 74 53.784 54.019 -0.235 1
1 859 . 1 1 1 A 74 74 LEU CB C 74 43.446 41.480 1.966 1
1 863 . 1 1 1 A 74 74 LEU N N 74 122.271 121.663 0.608 1
1 864 . 1 1 1 A 75 75 GLU H H 75 8.855 8.685 0.170 1
1 865 . 1 1 1 A 75 75 GLU HA H 75 4.336 4.026 0.310 1
1 870 . 1 1 1 A 75 75 GLU C C 75 176.465 177.367 -0.902 1
1 871 . 1 1 1 A 75 75 GLU CA C 75 56.507 59.823 -3.316 1
1 872 . 1 1 1 A 75 75 GLU CB C 75 30.245 29.426 0.819 1
1 874 . 1 1 1 A 75 75 GLU N N 75 122.678 125.425 -2.747 1
1 875 . 1 1 1 A 76 76 ASP H H 76 8.542 7.916 0.626 1
1 876 . 1 1 1 A 76 76 ASP HA H 76 4.665 4.527 0.138 1
1 879 . 1 1 1 A 76 76 ASP C C 76 176.087 176.339 -0.252 1
1 880 . 1 1 1 A 76 76 ASP CA C 76 55.107 54.798 0.309 1
1 881 . 1 1 1 A 76 76 ASP CB C 76 41.431 40.863 0.568 1
1 882 . 1 1 1 A 76 76 ASP N N 76 121.488 119.750 1.738 1
1 883 . 1 1 1 A 77 77 ASN H H 77 8.322 8.767 -0.445 1
1 884 . 1 1 1 A 77 77 ASN HA H 77 4.729 4.446 0.283 1
1 889 . 1 1 1 A 77 77 ASN C C 77 175.566 176.186 -0.620 1
1 890 . 1 1 1 A 77 77 ASN CA C 77 53.131 54.600 -1.469 1
1 891 . 1 1 1 A 77 77 ASN CB C 77 38.617 39.258 -0.641 1
1 892 . 1 1 1 A 77 77 ASN N N 77 118.676 123.348 -4.672 1
1 894 . 1 1 1 A 78 78 GLY H H 78 8.311 8.902 -0.591 1
1 895 . 1 1 1 A 78 78 GLY HA2 H 78 3.897 3.802 0.095 1
1 896 . 1 1 1 A 78 78 GLY HA3 H 78 3.897 3.818 0.079 1
1 897 . 1 1 1 A 78 78 GLY C C 78 173.376 174.039 -0.663 1
1 898 . 1 1 1 A 78 78 GLY CA C 78 45.224 47.394 -2.170 1
1 899 . 1 1 1 A 78 78 GLY N N 78 108.939 113.120 -4.181 1
1 900 . 1 1 1 A 79 79 VAL H H 79 7.882 8.192 -0.310 1
1 901 . 1 1 1 A 79 79 VAL HA H 79 4.345 4.424 -0.079 1
1 909 . 1 1 1 A 79 79 VAL CA C 79 59.995 60.426 -0.431 1
1 910 . 1 1 1 A 79 79 VAL CB C 79 32.589 32.101 0.488 1
1 913 . 1 1 1 A 79 79 VAL N N 79 121.135 122.436 -1.301 1
1 914 . 1 1 1 A 80 80 PRO HA H 80 4.461 4.443 0.018 1
1 921 . 1 1 1 A 80 80 PRO C C 80 176.979 178.011 -1.032 1
1 922 . 1 1 1 A 80 80 PRO CA C 80 63.101 66.365 -3.264 1
1 923 . 1 1 1 A 80 80 PRO CB C 80 32.177 31.625 0.552 1
1 926 . 1 1 1 A 81 81 THR H H 81 8.281 8.005 0.276 1
1 927 . 1 1 1 A 81 81 THR HA H 81 4.095 4.524 -0.429 1
1 932 . 1 1 1 A 81 81 THR C C 81 175.270 175.792 -0.522 1
1 933 . 1 1 1 A 81 81 THR CA C 81 62.872 63.490 -0.618 1
1 934 . 1 1 1 A 81 81 THR CB C 81 69.642 70.636 -0.994 1
1 936 . 1 1 1 A 81 81 THR N N 81 114.684 110.620 4.064 1
1 937 . 1 1 1 A 82 82 GLY H H 82 8.338 7.771 0.567 1
1 938 . 1 1 1 A 82 82 GLY HA2 H 82 4.095 4.063 0.032 1
1 939 . 1 1 1 A 82 82 GLY HA3 H 82 3.668 4.074 -0.406 1
1 940 . 1 1 1 A 82 82 GLY C C 82 174.139 173.125 1.014 1
1 941 . 1 1 1 A 82 82 GLY CA C 82 45.083 45.903 -0.820 1
1 942 . 1 1 1 A 82 82 GLY N N 82 111.289 106.336 4.953 1
1 943 . 1 1 1 A 83 83 VAL H H 83 7.668 7.780 -0.112 1
1 944 . 1 1 1 A 83 83 VAL HA H 83 3.985 4.222 -0.237 1
1 952 . 1 1 1 A 83 83 VAL C C 83 176.054 176.045 0.009 1
1 953 . 1 1 1 A 83 83 VAL CA C 83 62.431 61.545 0.886 1
1 954 . 1 1 1 A 83 83 VAL CB C 83 32.260 33.483 -1.223 1
1 957 . 1 1 1 A 83 83 VAL N N 83 120.003 120.948 -0.945 1
1 958 . 1 1 1 A 84 84 LYS H H 84 8.645 8.623 0.022 1
1 959 . 1 1 1 A 84 84 LYS HA H 84 4.276 3.819 0.457 1
1 968 . 1 1 1 A 84 84 LYS C C 84 176.832 177.541 -0.709 1
1 969 . 1 1 1 A 84 84 LYS CA C 84 56.272 58.774 -2.502 1
1 970 . 1 1 1 A 84 84 LYS CB C 84 32.876 32.222 0.654 1
1 974 . 1 1 1 A 84 84 LYS N N 84 126.447 124.680 1.767 1
1 975 . 1 1 1 A 85 85 GLY H H 85 8.410 8.877 -0.467 1
1 976 . 1 1 1 A 85 85 GLY HA2 H 85 4.066 3.890 0.176 1
1 977 . 1 1 1 A 85 85 GLY HA3 H 85 3.781 3.901 -0.120 1
1 978 . 1 1 1 A 85 85 GLY C C 85 173.969 174.193 -0.224 1
1 979 . 1 1 1 A 85 85 GLY CA C 85 45.146 47.266 -2.120 1
1 980 . 1 1 1 A 85 85 GLY N N 85 109.957 111.430 -1.473 1
1 981 . 1 1 1 A 86 86 ASN H H 86 8.298 8.254 0.044 1
1 982 . 1 1 1 A 86 86 ASN HA H 86 4.665 5.451 -0.786 1
1 987 . 1 1 1 A 86 86 ASN C C 86 174.987 173.359 1.628 1
1 988 . 1 1 1 A 86 86 ASN CA C 86 52.989 51.124 1.865 1
1 989 . 1 1 1 A 86 86 ASN CB C 86 38.376 41.829 -3.453 1
1 990 . 1 1 1 A 86 86 ASN N N 86 118.457 118.682 -0.225 1
1 992 . 1 1 1 A 87 87 VAL H H 87 7.660 8.664 -1.004 1
1 993 . 1 1 1 A 87 87 VAL HA H 87 3.946 4.257 -0.311 1
1 1001 . 1 1 1 A 87 87 VAL C C 87 174.902 175.392 -0.490 1
1 1002 . 1 1 1 A 87 87 VAL CA C 87 62.307 59.877 2.430 1
1 1003 . 1 1 1 A 87 87 VAL CB C 87 32.548 35.526 -2.978 1
1 1006 . 1 1 1 A 87 87 VAL N N 87 120.557 118.173 2.384 1
1 1007 . 1 1 1 A 88 88 GLN H H 88 8.115 8.003 0.112 1
1 1008 . 1 1 1 A 88 88 GLN HA H 88 4.302 4.227 0.075 1
1 1015 . 1 1 1 A 88 88 GLN C C 88 175.637 175.328 0.309 1
1 1016 . 1 1 1 A 88 88 GLN CA C 88 55.336 55.652 -0.316 1
1 1017 . 1 1 1 A 88 88 GLN CB C 88 30.574 29.890 0.684 1
1 1019 . 1 1 1 A 88 88 GLN N N 88 122.280 123.601 -1.321 1
1 1021 . 1 1 1 A 89 89 GLY H H 89 8.544 8.523 0.021 1
1 1022 . 1 1 1 A 89 89 GLY HA2 H 89 3.885 4.289 -0.404 1
1 1023 . 1 1 1 A 89 89 GLY HA3 H 89 3.885 4.297 -0.412 1
1 1024 . 1 1 1 A 89 89 GLY C C 89 172.861 174.124 -1.263 1
1 1025 . 1 1 1 A 89 89 GLY CA C 89 44.889 44.136 0.753 1
1 1026 . 1 1 1 A 89 89 GLY N N 89 110.135 107.235 2.900 1
1 1027 . 1 1 1 A 90 90 ASN H H 90 8.451 8.756 -0.305 1
1 1028 . 1 1 1 A 90 90 ASN HA H 90 4.222 4.299 -0.077 1
1 1033 . 1 1 1 A 90 90 ASN C C 90 174.926 174.238 0.688 1
1 1034 . 1 1 1 A 90 90 ASN CA C 90 54.613 54.455 0.158 1
1 1035 . 1 1 1 A 90 90 ASN CB C 90 37.852 36.711 1.141 1
1 1036 . 1 1 1 A 90 90 ASN N N 90 114.322 117.487 -3.165 1
1 1038 . 1 1 1 A 91 91 LEU H H 91 8.933 7.571 1.362 1
1 1039 . 1 1 1 A 91 91 LEU HA H 91 5.367 5.016 0.351 1
1 1049 . 1 1 1 A 91 91 LEU C C 91 178.732 175.499 3.233 1
1 1050 . 1 1 1 A 91 91 LEU CA C 91 55.160 53.349 1.811 1
1 1051 . 1 1 1 A 91 91 LEU CB C 91 45.461 44.103 1.358 1
1 1055 . 1 1 1 A 91 91 LEU N N 91 120.057 118.886 1.171 1
1 1056 . 1 1 1 A 92 92 PHE H H 92 9.901 8.142 1.759 1
1 1057 . 1 1 1 A 92 92 PHE HA H 92 5.105 5.052 0.053 1
1 1065 . 1 1 1 A 92 92 PHE C C 92 170.140 172.661 -2.521 1
1 1066 . 1 1 1 A 92 92 PHE CA C 92 56.236 55.918 0.318 1
1 1067 . 1 1 1 A 92 92 PHE CB C 92 42.664 41.569 1.095 1
1 1073 . 1 1 1 A 92 92 PHE N N 92 119.740 116.874 2.866 1
1 1074 . 1 1 1 A 93 93 LYS H H 93 9.154 9.076 0.078 1
1 1075 . 1 1 1 A 93 93 LYS HA H 93 5.584 5.334 0.250 1
1 1083 . 1 1 1 A 93 93 LYS C C 93 174.830 175.322 -0.492 1
1 1084 . 1 1 1 A 93 93 LYS CA C 93 53.148 54.136 -0.988 1
1 1085 . 1 1 1 A 93 93 LYS CB C 93 36.660 35.914 0.746 1
1 1089 . 1 1 1 A 93 93 LYS N N 93 117.710 118.566 -0.856 1
1 1090 . 1 1 1 A 94 94 VAL H H 94 8.507 8.801 -0.294 1
1 1091 . 1 1 1 A 94 94 VAL HA H 94 4.872 5.068 -0.196 1
1 1099 . 1 1 1 A 94 94 VAL C C 94 174.408 174.844 -0.436 1
1 1100 . 1 1 1 A 94 94 VAL CA C 94 60.525 61.540 -1.015 1
1 1101 . 1 1 1 A 94 94 VAL CB C 94 34.862 34.235 0.627 1
1 1104 . 1 1 1 A 94 94 VAL N N 94 121.741 120.589 1.152 1
1 1105 . 1 1 1 A 95 95 ILE H H 95 8.959 8.945 0.014 1
1 1106 . 1 1 1 A 95 95 ILE HA H 95 4.794 4.696 0.098 1
1 1116 . 1 1 1 A 95 95 ILE C C 95 177.642 176.214 1.428 1
1 1117 . 1 1 1 A 95 95 ILE CA C 95 59.713 60.475 -0.762 1
1 1118 . 1 1 1 A 95 95 ILE CB C 95 40.032 37.995 2.037 1
1 1122 . 1 1 1 A 95 95 ILE N N 95 126.794 128.333 -1.539 1
1 1123 . 1 1 1 A 96 96 THR H H 96 8.765 8.891 -0.126 1
1 1124 . 1 1 1 A 96 96 THR HA H 96 4.584 4.875 -0.291 1
1 1129 . 1 1 1 A 96 96 THR C C 96 177.023 176.269 0.754 1
1 1130 . 1 1 1 A 96 96 THR CA C 96 61.372 60.717 0.655 1
1 1131 . 1 1 1 A 96 96 THR CB C 96 70.794 71.831 -1.037 1
1 1133 . 1 1 1 A 96 96 THR N N 96 117.225 120.424 -3.199 1
1 1134 . 1 1 1 A 97 97 LYS H H 97 8.736 8.584 0.152 1
1 1135 . 1 1 1 A 97 97 LYS HA H 97 4.101 4.106 -0.005 1
1 1144 . 1 1 1 A 97 97 LYS C C 97 176.490 177.093 -0.603 1
1 1145 . 1 1 1 A 97 97 LYS CA C 97 58.583 58.807 -0.224 1
1 1146 . 1 1 1 A 97 97 LYS CB C 97 31.848 32.157 -0.309 1
1 1150 . 1 1 1 A 97 97 LYS N N 97 120.457 119.667 0.790 1
1 1151 . 1 1 1 A 98 98 ASP H H 98 7.762 7.961 -0.199 1
1 1152 . 1 1 1 A 98 98 ASP HA H 98 4.633 4.779 -0.146 1
1 1155 . 1 1 1 A 98 98 ASP C C 98 175.270 174.453 0.817 1
1 1156 . 1 1 1 A 98 98 ASP CA C 98 53.272 53.994 -0.722 1
1 1157 . 1 1 1 A 98 98 ASP CB C 98 39.909 40.846 -0.937 1
1 1158 . 1 1 1 A 98 98 ASP N N 98 116.281 118.556 -2.275 1
1 1159 . 1 1 1 A 99 99 ASP H H 99 8.340 8.184 0.156 1
1 1160 . 1 1 1 A 99 99 ASP HA H 99 4.245 4.554 -0.309 1
1 1163 . 1 1 1 A 99 99 ASP C C 99 175.315 175.626 -0.311 1
1 1164 . 1 1 1 A 99 99 ASP CA C 99 55.989 55.566 0.423 1
1 1165 . 1 1 1 A 99 99 ASP CB C 99 39.827 39.075 0.752 1
1 1166 . 1 1 1 A 99 99 ASP N N 99 116.687 115.934 0.753 1
1 1167 . 1 1 1 A 100 100 THR H H 100 7.511 7.902 -0.391 1
1 1168 . 1 1 1 A 100 100 THR HA H 100 4.185 3.811 0.374 1
1 1173 . 1 1 1 A 100 100 THR C C 100 173.376 174.330 -0.954 1
1 1174 . 1 1 1 A 100 100 THR CA C 100 63.489 65.661 -2.172 1
1 1175 . 1 1 1 A 100 100 THR CB C 100 67.909 69.118 -1.209 1
1 1177 . 1 1 1 A 100 100 THR N N 100 116.525 111.423 5.102 1
1 1178 . 1 1 1 A 101 101 HIS H H 101 8.753 8.123 0.630 1
1 1179 . 1 1 1 A 101 101 HIS HA H 101 4.898 4.560 0.338 1
1 1184 . 1 1 1 A 101 101 HIS C C 101 174.345 173.775 0.570 1
1 1185 . 1 1 1 A 101 101 HIS CA C 101 55.072 56.207 -1.135 1
1 1186 . 1 1 1 A 101 101 HIS CB C 101 32.835 27.860 4.975 1
1 1189 . 1 1 1 A 101 101 HIS N N 101 125.953 116.901 9.052 1
1 1190 . 1 1 1 A 102 102 TYR H H 102 9.023 8.946 0.077 1
1 1191 . 1 1 1 A 102 102 TYR HA H 102 4.545 4.997 -0.452 1
1 1198 . 1 1 1 A 102 102 TYR C C 102 174.126 175.061 -0.935 1
1 1199 . 1 1 1 A 102 102 TYR CA C 102 57.260 56.381 0.879 1
1 1200 . 1 1 1 A 102 102 TYR CB C 102 40.381 39.114 1.267 1
1 1205 . 1 1 1 A 102 102 TYR N N 102 121.975 121.341 0.634 1
1 1206 . 1 1 1 A 103 103 TYR H H 103 8.899 9.050 -0.151 1
1 1207 . 1 1 1 A 103 103 TYR HA H 103 4.729 4.921 -0.192 1
1 1214 . 1 1 1 A 103 103 TYR C C 103 174.139 175.593 -1.454 1
1 1215 . 1 1 1 A 103 103 TYR CA C 103 58.036 57.719 0.317 1
1 1216 . 1 1 1 A 103 103 TYR CB C 103 40.485 39.699 0.786 1
1 1221 . 1 1 1 A 103 103 TYR N N 103 122.012 123.656 -1.644 1
1 1222 . 1 1 1 A 104 104 ILE H H 104 8.605 8.543 0.062 1
1 1223 . 1 1 1 A 104 104 ILE HA H 104 4.859 4.624 0.235 1
1 1233 . 1 1 1 A 104 104 ILE C C 104 172.769 174.077 -1.308 1
1 1234 . 1 1 1 A 104 104 ILE CA C 104 59.554 59.532 0.022 1
1 1235 . 1 1 1 A 104 104 ILE CB C 104 40.631 42.233 -1.602 1
1 1239 . 1 1 1 A 104 104 ILE N N 104 123.443 123.565 -0.122 1
1 1240 . 1 1 1 A 105 105 GLN H H 105 9.369 8.488 0.881 1
1 1241 . 1 1 1 A 105 105 GLN HA H 105 4.895 4.954 -0.059 1
1 1248 . 1 1 1 A 105 105 GLN C C 105 175.642 174.659 0.983 1
1 1249 . 1 1 1 A 105 105 GLN CA C 105 54.965 53.826 1.139 1
1 1250 . 1 1 1 A 105 105 GLN CB C 105 32.856 32.403 0.453 1
1 1252 . 1 1 1 A 105 105 GLN N N 105 125.079 124.421 0.658 1
1 1254 . 1 1 1 A 106 106 ALA H H 106 8.513 8.477 0.036 1
1 1255 . 1 1 1 A 106 106 ALA HA H 106 4.962 4.798 0.164 1
1 1259 . 1 1 1 A 106 106 ALA C C 106 175.854 177.942 -2.088 1
1 1260 . 1 1 1 A 106 106 ALA CA C 106 50.272 50.181 0.091 1
1 1261 . 1 1 1 A 106 106 ALA CB C 106 21.197 21.956 -0.759 1
1 1262 . 1 1 1 A 106 106 ALA N N 106 129.303 128.043 1.260 1
1 1263 . 1 1 1 A 107 107 SER H H 107 9.468 8.666 0.802 1
1 1264 . 1 1 1 A 107 107 SER HA H 107 4.447 4.298 0.149 1
1 1267 . 1 1 1 A 107 107 SER C C 107 173.785 174.578 -0.793 1
1 1268 . 1 1 1 A 107 107 SER CA C 107 60.048 61.922 -1.874 1
1 1269 . 1 1 1 A 107 107 SER CB C 107 64.643 63.088 1.555 1
1 1270 . 1 1 1 A 107 107 SER N N 107 112.962 116.198 -3.236 1
1 1271 . 1 1 1 A 108 108 SER H H 108 7.555 7.768 -0.213 1
1 1272 . 1 1 1 A 108 108 SER HA H 108 4.665 4.957 -0.292 1
1 1275 . 1 1 1 A 108 108 SER C C 108 174.381 175.020 -0.639 1
1 1276 . 1 1 1 A 108 108 SER CA C 108 56.907 56.506 0.401 1
1 1277 . 1 1 1 A 108 108 SER CB C 108 66.370 66.579 -0.209 1
1 1278 . 1 1 1 A 108 108 SER N N 108 112.243 113.402 -1.159 1
1 1279 . 1 1 1 A 109 109 LYS H H 109 8.978 8.745 0.233 1
1 1280 . 1 1 1 A 109 109 LYS HA H 109 4.777 3.994 0.783 1
1 1287 . 1 1 1 A 109 109 LYS C C 109 179.992 177.717 2.275 1
1 1288 . 1 1 1 A 109 109 LYS CA C 109 59.766 60.474 -0.708 1
1 1289 . 1 1 1 A 109 109 LYS CB C 109 32.342 32.072 0.270 1
1 1293 . 1 1 1 A 109 109 LYS N N 109 123.170 124.940 -1.770 1
1 1294 . 1 1 1 A 110 110 ALA H H 110 8.608 8.151 0.457 1
1 1295 . 1 1 1 A 110 110 ALA HA H 110 4.178 4.007 0.171 1
1 1299 . 1 1 1 A 110 110 ALA C C 110 179.895 179.250 0.645 1
1 1300 . 1 1 1 A 110 110 ALA CA C 110 54.871 55.475 -0.604 1
1 1301 . 1 1 1 A 110 110 ALA CB C 110 18.065 18.445 -0.380 1
1 1302 . 1 1 1 A 110 110 ALA N N 110 123.750 121.011 2.739 1
1 1303 . 1 1 1 A 111 111 GLU H H 111 8.185 8.275 -0.090 1
1 1304 . 1 1 1 A 111 111 GLU HA H 111 4.180 4.060 0.120 1
1 1309 . 1 1 1 A 111 111 GLU C C 111 178.587 178.938 -0.351 1
1 1310 . 1 1 1 A 111 111 GLU CA C 111 59.466 59.780 -0.314 1
1 1311 . 1 1 1 A 111 111 GLU CB C 111 31.067 29.508 1.559 1
1 1313 . 1 1 1 A 111 111 GLU N N 111 119.757 118.696 1.061 1
1 1314 . 1 1 1 A 112 112 ARG H H 112 8.008 7.955 0.053 1
1 1315 . 1 1 1 A 112 112 ARG HA H 112 3.642 4.219 -0.577 1
1 1322 . 1 1 1 A 112 112 ARG C C 112 176.481 178.267 -1.786 1
1 1323 . 1 1 1 A 112 112 ARG CA C 112 60.419 59.657 0.762 1
1 1324 . 1 1 1 A 112 112 ARG CB C 112 29.957 30.236 -0.279 1
1 1327 . 1 1 1 A 112 112 ARG N N 112 118.430 120.113 -1.683 1
1 1328 . 1 1 1 A 113 113 ALA H H 113 7.985 7.778 0.207 1
1 1329 . 1 1 1 A 113 113 ALA HA H 113 3.925 4.081 -0.156 1
1 1333 . 1 1 1 A 113 113 ALA C C 113 180.117 179.887 0.230 1
1 1334 . 1 1 1 A 113 113 ALA CA C 113 55.372 55.221 0.151 1
1 1335 . 1 1 1 A 113 113 ALA CB C 113 17.825 18.505 -0.680 1
1 1336 . 1 1 1 A 113 113 ALA N N 113 119.980 120.618 -0.638 1
1 1337 . 1 1 1 A 114 114 GLU H H 114 8.093 8.112 -0.019 1
1 1338 . 1 1 1 A 114 114 GLU HA H 114 3.936 3.955 -0.019 1
1 1343 . 1 1 1 A 114 114 GLU C C 114 180.586 179.144 1.442 1
1 1344 . 1 1 1 A 114 114 GLU CA C 114 59.148 59.166 -0.018 1
1 1345 . 1 1 1 A 114 114 GLU CB C 114 30.080 29.565 0.515 1
1 1347 . 1 1 1 A 114 114 GLU N N 114 117.168 118.106 -0.938 1
1 1348 . 1 1 1 A 115 115 TRP H H 115 7.980 8.776 -0.796 1
1 1349 . 1 1 1 A 115 115 TRP HA H 115 3.775 4.357 -0.582 1
1 1358 . 1 1 1 A 115 115 TRP C C 115 177.714 178.646 -0.932 1
1 1359 . 1 1 1 A 115 115 TRP CA C 115 62.696 59.827 2.869 1
1 1360 . 1 1 1 A 115 115 TRP CB C 115 29.052 28.930 0.122 1
1 1366 . 1 1 1 A 115 115 TRP N N 115 120.974 120.713 0.261 1
1 1368 . 1 1 1 A 116 116 ILE H H 116 8.297 8.755 -0.458 1
1 1369 . 1 1 1 A 116 116 ILE HA H 116 3.270 3.450 -0.180 1
1 1379 . 1 1 1 A 116 116 ILE C C 116 177.568 177.712 -0.144 1
1 1380 . 1 1 1 A 116 116 ILE CA C 116 66.643 64.640 2.003 1
1 1381 . 1 1 1 A 116 116 ILE CB C 116 37.606 37.532 0.074 1
1 1385 . 1 1 1 A 116 116 ILE N N 116 118.408 120.535 -2.127 1
1 1386 . 1 1 1 A 117 117 GLU H H 117 8.026 8.563 -0.537 1
1 1387 . 1 1 1 A 117 117 GLU HA H 117 3.880 3.961 -0.081 1
1 1392 . 1 1 1 A 117 117 GLU C C 117 178.476 179.079 -0.603 1
1 1393 . 1 1 1 A 117 117 GLU CA C 117 59.219 59.699 -0.480 1
1 1394 . 1 1 1 A 117 117 GLU CB C 117 29.381 29.325 0.056 1
1 1396 . 1 1 1 A 117 117 GLU N N 117 117.096 120.353 -3.257 1
1 1397 . 1 1 1 A 118 118 ALA H H 118 7.555 7.863 -0.308 1
1 1398 . 1 1 1 A 118 118 ALA HA H 118 3.952 4.044 -0.092 1
1 1402 . 1 1 1 A 118 118 ALA C C 118 179.862 179.948 -0.086 1
1 1403 . 1 1 1 A 118 118 ALA CA C 118 54.772 55.035 -0.263 1
1 1404 . 1 1 1 A 118 118 ALA CB C 118 18.277 18.431 -0.154 1
1 1405 . 1 1 1 A 118 118 ALA N N 118 119.817 121.856 -2.039 1
1 1406 . 1 1 1 A 119 119 ILE H H 119 8.167 7.973 0.194 1
1 1407 . 1 1 1 A 119 119 ILE HA H 119 3.558 3.745 -0.187 1
1 1417 . 1 1 1 A 119 119 ILE C C 119 178.564 177.905 0.659 1
1 1418 . 1 1 1 A 119 119 ILE CA C 119 65.766 65.224 0.542 1
1 1419 . 1 1 1 A 119 119 ILE CB C 119 38.840 37.926 0.914 1
1 1423 . 1 1 1 A 119 119 ILE N N 119 116.280 118.091 -1.811 1
1 1424 . 1 1 1 A 120 120 LYS H H 120 8.790 8.142 0.648 1
1 1425 . 1 1 1 A 120 120 LYS HA H 120 3.965 4.291 -0.326 1
1 1434 . 1 1 1 A 120 120 LYS C C 120 179.673 179.189 0.484 1
1 1435 . 1 1 1 A 120 120 LYS CA C 120 60.031 60.178 -0.147 1
1 1436 . 1 1 1 A 120 120 LYS CB C 120 32.547 32.214 0.333 1
1 1440 . 1 1 1 A 120 120 LYS N N 120 119.650 118.814 0.836 1
1 1441 . 1 1 1 A 121 121 LYS H H 121 7.594 8.252 -0.658 1
1 1442 . 1 1 1 A 121 121 LYS HA H 121 4.095 3.936 0.159 1
1 1451 . 1 1 1 A 121 121 LYS C C 121 177.962 179.130 -1.168 1
1 1452 . 1 1 1 A 121 121 LYS CA C 121 58.848 59.603 -0.755 1
1 1453 . 1 1 1 A 121 121 LYS CB C 121 32.547 32.304 0.243 1
1 1457 . 1 1 1 A 121 121 LYS N N 121 117.197 119.551 -2.354 1
1 1458 . 1 1 1 A 122 122 LEU H H 122 7.586 7.824 -0.238 1
1 1459 . 1 1 1 A 122 122 LEU HA H 122 4.535 3.949 0.586 1
1 1469 . 1 1 1 A 122 122 LEU C C 122 177.902 177.312 0.590 1
1 1470 . 1 1 1 A 122 122 LEU CA C 122 55.071 57.941 -2.870 1
1 1471 . 1 1 1 A 122 122 LEU CB C 122 42.888 41.835 1.053 1
1 1475 . 1 1 1 A 122 122 LEU N N 122 116.861 120.024 -3.163 1
1 1476 . 1 1 1 A 123 123 THR H H 123 7.636 7.743 -0.107 1
1 1477 . 1 1 1 A 123 123 THR HA H 123 4.445 4.383 0.062 1
1 1482 . 1 1 1 A 123 123 THR C C 123 175.714 174.173 1.541 1
1 1483 . 1 1 1 A 123 123 THR CA C 123 62.643 61.344 1.299 1
1 1484 . 1 1 1 A 123 123 THR CB C 123 70.259 71.221 -0.962 1
1 1486 . 1 1 1 A 123 123 THR N N 123 108.963 111.662 -2.699 1
1 1487 . 1 1 1 A 124 124 SER H H 124 7.912 8.469 -0.557 1
1 1488 . 1 1 1 A 124 124 SER HA H 124 4.626 5.218 -0.592 1
1 1491 . 1 1 1 A 124 124 SER C C 124 174.405 174.325 0.080 1
1 1492 . 1 1 1 A 124 124 SER CA C 124 58.390 56.884 1.506 1
1 1493 . 1 1 1 A 124 124 SER CB C 124 64.255 64.601 -0.346 1
1 1494 . 1 1 1 A 124 124 SER N N 124 116.876 115.014 1.862 1
1 1495 . 1 1 1 A 125 125 GLY H H 125 8.307 8.355 -0.048 1
1 1496 . 1 1 1 A 125 125 GLY HA2 H 125 4.166 4.220 -0.054 1
1 1497 . 1 1 1 A 125 125 GLY HA3 H 125 4.166 4.221 -0.055 1
1 1498 . 1 1 1 A 125 125 GLY C C 125 171.921 171.230 0.691 1
1 1499 . 1 1 1 A 125 125 GLY CA C 125 44.748 45.508 -0.760 1
1 1500 . 1 1 1 A 125 125 GLY N N 125 110.006 110.173 -0.167 1
1 1501 . 1 1 1 A 126 126 PRO HA H 126 4.510 4.844 -0.334 1
1 1508 . 1 1 1 A 126 126 PRO C C 126 177.471 175.837 1.634 1
1 1509 . 1 1 1 A 126 126 PRO CA C 126 63.419 62.552 0.867 1
1 1510 . 1 1 1 A 126 126 PRO CB C 126 32.106 32.010 0.096 1
1 1513 . 1 1 1 A 127 127 SER H H 127 8.607 8.886 -0.279 1
1 1514 . 1 1 1 A 127 127 SER C C 127 174.628 174.001 0.627 1
1 1515 . 1 1 1 A 127 127 SER CA C 127 58.513 59.418 -0.905 1
1 1516 . 1 1 1 A 127 127 SER CB C 127 63.679 65.059 -1.380 1
1 1517 . 1 1 1 A 127 127 SER N N 127 116.390 116.868 -0.478 1
1 1518 . 1 1 1 A 128 128 SER H H 128 8.272 7.501 0.771 1
1 1519 . 1 1 1 A 128 128 SER HA H 128 4.496 4.396 0.100 1
1 1520 . 1 1 1 A 128 128 SER C C 128 173.921 175.077 -1.156 1
1 1521 . 1 1 1 A 128 128 SER CA C 128 58.442 59.345 -0.903 1
1 1522 . 1 1 1 A 128 128 SER CB C 128 64.173 63.340 0.833 1
1 1523 . 1 1 1 A 128 128 SER N N 128 117.506 114.137 3.369 1
1 1 . 2 1 1 A 7 7 GLY HA2 H 7 3.978 4.169 -0.191 1
1 2 . 2 1 1 A 7 7 GLY HA3 H 7 3.978 4.169 -0.191 1
1 3 . 2 1 1 A 7 7 GLY C C 7 174.274 173.145 1.129 1
1 4 . 2 1 1 A 7 7 GLY CA C 7 45.383 45.814 -0.431 1
1 5 . 2 1 1 A 8 8 SER H H 8 8.211 8.733 -0.522 1
1 6 . 2 1 1 A 8 8 SER HA H 8 4.425 4.551 -0.126 1
1 9 . 2 1 1 A 8 8 SER C C 8 174.635 172.299 2.336 1
1 10 . 2 1 1 A 8 8 SER CA C 8 58.425 58.975 -0.550 1
1 11 . 2 1 1 A 8 8 SER CB C 8 63.885 62.170 1.715 1
1 12 . 2 1 1 A 8 8 SER N N 8 115.732 116.963 -1.231 1
1 13 . 2 1 1 A 9 9 LEU H H 9 8.316 8.802 -0.486 1
1 14 . 2 1 1 A 9 9 LEU HA H 9 4.334 5.158 -0.824 1
1 24 . 2 1 1 A 9 9 LEU C C 9 177.447 175.090 2.357 1
1 25 . 2 1 1 A 9 9 LEU CA C 9 55.407 53.651 1.756 1
1 26 . 2 1 1 A 9 9 LEU CB C 9 42.171 44.010 -1.839 1
1 30 . 2 1 1 A 9 9 LEU N N 9 123.943 127.287 -3.344 1
1 31 . 2 1 1 A 10 10 SER H H 10 8.304 8.782 -0.478 1
1 32 . 2 1 1 A 10 10 SER HA H 10 4.424 4.925 -0.501 1
1 35 . 2 1 1 A 10 10 SER C C 10 175.025 173.096 1.929 1
1 36 . 2 1 1 A 10 10 SER CA C 10 58.425 57.891 0.534 1
1 37 . 2 1 1 A 10 10 SER CB C 10 63.638 66.860 -3.222 1
1 38 . 2 1 1 A 10 10 SER N N 10 116.718 118.567 -1.849 1
1 39 . 2 1 1 A 11 11 THR H H 11 8.003 8.744 -0.741 1
1 40 . 2 1 1 A 11 11 THR HA H 11 4.196 4.453 -0.257 1
1 45 . 2 1 1 A 11 11 THR C C 11 176.296 174.306 1.990 1
1 46 . 2 1 1 A 11 11 THR CA C 11 62.483 62.851 -0.368 1
1 47 . 2 1 1 A 11 11 THR CB C 11 69.266 69.651 -0.385 1
1 49 . 2 1 1 A 11 11 THR N N 11 114.902 120.982 -6.080 1
1 50 . 2 1 1 A 12 12 VAL H H 12 8.095 8.442 -0.347 1
1 51 . 2 1 1 A 12 12 VAL HA H 12 3.826 4.183 -0.357 1
1 59 . 2 1 1 A 12 12 VAL C C 12 178.501 176.915 1.586 1
1 60 . 2 1 1 A 12 12 VAL CA C 12 64.760 63.650 1.110 1
1 61 . 2 1 1 A 12 12 VAL CB C 12 32.013 33.273 -1.260 1
1 64 . 2 1 1 A 12 12 VAL N N 12 122.111 122.198 -0.087 1
1 65 . 2 1 1 A 13 13 GLU H H 13 8.151 8.739 -0.588 1
1 66 . 2 1 1 A 13 13 GLU HA H 13 3.244 3.413 -0.169 1
1 71 . 2 1 1 A 13 13 GLU C C 13 175.702 178.373 -2.671 1
1 72 . 2 1 1 A 13 13 GLU CA C 13 58.354 59.028 -0.674 1
1 73 . 2 1 1 A 13 13 GLU CB C 13 28.843 28.344 0.499 1
1 75 . 2 1 1 A 13 13 GLU N N 13 120.316 122.542 -2.226 1
1 76 . 2 1 1 A 14 14 LEU H H 14 7.067 7.604 -0.537 1
1 77 . 2 1 1 A 14 14 LEU HA H 14 4.157 4.157 0.000 1
1 87 . 2 1 1 A 14 14 LEU C C 14 176.863 176.869 -0.006 1
1 88 . 2 1 1 A 14 14 LEU CA C 14 53.324 55.094 -1.770 1
1 89 . 2 1 1 A 14 14 LEU CB C 14 41.636 41.421 0.215 1
1 93 . 2 1 1 A 14 14 LEU N N 14 117.035 119.474 -2.439 1
1 94 . 2 1 1 A 15 15 SER H H 15 7.645 8.016 -0.371 1
1 95 . 2 1 1 A 15 15 SER HA H 15 4.305 4.642 -0.337 1
1 98 . 2 1 1 A 15 15 SER C C 15 175.340 173.545 1.795 1
1 99 . 2 1 1 A 15 15 SER CA C 15 59.783 57.807 1.976 1
1 100 . 2 1 1 A 15 15 SER CB C 15 64.625 61.565 3.060 1
1 101 . 2 1 1 A 15 15 SER N N 15 114.216 114.932 -0.716 1
1 102 . 2 1 1 A 16 16 GLY H H 16 8.506 7.994 0.512 1
1 103 . 2 1 1 A 16 16 GLY HA2 H 16 4.237 4.304 -0.067 1
1 104 . 2 1 1 A 16 16 GLY HA3 H 16 3.927 4.325 -0.398 1
1 105 . 2 1 1 A 16 16 GLY C C 16 173.661 172.177 1.484 1
1 106 . 2 1 1 A 16 16 GLY CA C 16 44.995 43.905 1.090 1
1 107 . 2 1 1 A 16 16 GLY N N 16 111.838 110.305 1.533 1
1 108 . 2 1 1 A 17 17 THR H H 17 8.482 9.159 -0.677 1
1 109 . 2 1 1 A 17 17 THR HA H 17 4.319 4.460 -0.141 1
1 114 . 2 1 1 A 17 17 THR C C 17 174.758 174.418 0.340 1
1 115 . 2 1 1 A 17 17 THR CA C 17 62.272 63.596 -1.324 1
1 116 . 2 1 1 A 17 17 THR CB C 17 70.706 69.020 1.686 1
1 118 . 2 1 1 A 17 17 THR N N 17 116.679 115.364 1.315 1
1 119 . 2 1 1 A 18 18 VAL H H 18 8.948 8.804 0.144 1
1 120 . 2 1 1 A 18 18 VAL HA H 18 3.950 4.410 -0.460 1
1 128 . 2 1 1 A 18 18 VAL C C 18 176.669 176.999 -0.330 1
1 129 . 2 1 1 A 18 18 VAL CA C 18 64.813 63.622 1.191 1
1 130 . 2 1 1 A 18 18 VAL CB C 18 31.807 31.774 0.033 1
1 133 . 2 1 1 A 18 18 VAL N N 18 127.156 127.530 -0.374 1
1 134 . 2 1 1 A 19 19 VAL H H 19 9.359 9.271 0.088 1
1 135 . 2 1 1 A 19 19 VAL HA H 19 4.234 4.387 -0.153 1
1 143 . 2 1 1 A 19 19 VAL C C 19 175.738 175.805 -0.067 1
1 144 . 2 1 1 A 19 19 VAL CA C 19 62.060 62.116 -0.056 1
1 145 . 2 1 1 A 19 19 VAL CB C 19 33.822 33.431 0.391 1
1 148 . 2 1 1 A 19 19 VAL N N 19 125.162 121.389 3.773 1
1 149 . 2 1 1 A 20 20 LYS H H 20 7.584 7.269 0.315 1
1 150 . 2 1 1 A 20 20 LYS HA H 20 4.346 4.545 -0.199 1
1 159 . 2 1 1 A 20 20 LYS C C 20 172.818 174.000 -1.182 1
1 160 . 2 1 1 A 20 20 LYS CA C 20 56.801 55.470 1.331 1
1 161 . 2 1 1 A 20 20 LYS CB C 20 36.624 35.577 1.047 1
1 165 . 2 1 1 A 20 20 LYS N N 20 121.024 120.984 0.040 1
1 166 . 2 1 1 A 21 21 GLN H H 21 8.625 8.506 0.119 1
1 167 . 2 1 1 A 21 21 GLN HA H 21 6.003 5.381 0.622 1
1 174 . 2 1 1 A 21 21 GLN C C 21 174.914 174.941 -0.027 1
1 175 . 2 1 1 A 21 21 GLN CA C 21 54.207 54.636 -0.429 1
1 176 . 2 1 1 A 21 21 GLN CB C 21 33.452 33.420 0.032 1
1 178 . 2 1 1 A 21 21 GLN N N 21 122.108 124.270 -2.162 1
1 180 . 2 1 1 A 22 22 GLY H H 22 8.964 8.363 0.601 1
1 181 . 2 1 1 A 22 22 GLY HA2 H 22 4.665 4.341 0.324 1
1 182 . 2 1 1 A 22 22 GLY HA3 H 22 4.295 4.562 -0.267 1
1 183 . 2 1 1 A 22 22 GLY C C 22 170.879 171.468 -0.589 1
1 184 . 2 1 1 A 22 22 GLY CA C 22 45.683 45.911 -0.228 1
1 185 . 2 1 1 A 22 22 GLY N N 22 108.508 109.017 -0.509 1
1 186 . 2 1 1 A 23 23 TYR H H 23 9.145 8.694 0.451 1
1 187 . 2 1 1 A 23 23 TYR HA H 23 5.595 5.512 0.083 1
1 194 . 2 1 1 A 23 23 TYR C C 23 175.824 175.487 0.337 1
1 195 . 2 1 1 A 23 23 TYR CA C 23 58.019 56.928 1.091 1
1 196 . 2 1 1 A 23 23 TYR CB C 23 39.251 40.382 -1.131 1
1 201 . 2 1 1 A 23 23 TYR N N 23 120.809 119.758 1.051 1
1 202 . 2 1 1 A 24 24 LEU H H 24 8.935 9.671 -0.736 1
1 203 . 2 1 1 A 24 24 LEU HA H 24 4.716 5.019 -0.303 1
1 213 . 2 1 1 A 24 24 LEU C C 24 174.648 175.975 -1.327 1
1 214 . 2 1 1 A 24 24 LEU CA C 24 53.907 53.157 0.750 1
1 215 . 2 1 1 A 24 24 LEU CB C 24 46.078 44.656 1.422 1
1 219 . 2 1 1 A 24 24 LEU N N 24 122.887 124.903 -2.016 1
1 220 . 2 1 1 A 25 25 ALA H H 25 8.145 8.526 -0.381 1
1 221 . 2 1 1 A 25 25 ALA HA H 25 5.477 5.655 -0.178 1
1 225 . 2 1 1 A 25 25 ALA C C 25 175.751 175.811 -0.060 1
1 226 . 2 1 1 A 25 25 ALA CA C 25 50.719 50.427 0.292 1
1 227 . 2 1 1 A 25 25 ALA CB C 25 21.074 21.279 -0.205 1
1 228 . 2 1 1 A 25 25 ALA N N 25 122.280 123.101 -0.821 1
1 229 . 2 1 1 A 26 26 LYS H H 26 9.167 8.283 0.884 1
1 230 . 2 1 1 A 26 26 LYS HA H 26 5.221 4.189 1.032 1
1 239 . 2 1 1 A 26 26 LYS C C 26 175.421 176.731 -1.310 1
1 240 . 2 1 1 A 26 26 LYS CA C 26 54.383 55.600 -1.217 1
1 241 . 2 1 1 A 26 26 LYS CB C 26 36.125 34.130 1.995 1
1 245 . 2 1 1 A 26 26 LYS N N 26 120.638 125.113 -4.475 1
1 246 . 2 1 1 A 27 27 GLN H H 27 7.866 7.993 -0.127 1
1 247 . 2 1 1 A 27 27 GLN HA H 27 3.525 1.359 2.166 1
1 254 . 2 1 1 A 27 27 GLN C C 27 177.022 175.239 1.783 1
1 255 . 2 1 1 A 27 27 GLN CA C 27 55.778 57.187 -1.409 1
1 256 . 2 1 1 A 27 27 GLN CB C 27 29.864 28.521 1.343 1
1 258 . 2 1 1 A 27 27 GLN N N 27 130.194 124.597 5.597 1
1 260 . 2 1 1 A 28 28 GLY H H 28 8.565 7.223 1.342 1
1 261 . 2 1 1 A 28 28 GLY HA2 H 28 4.125 3.412 0.713 1
1 262 . 2 1 1 A 28 28 GLY HA3 H 28 4.034 3.677 0.357 1
1 263 . 2 1 1 A 28 28 GLY C C 28 174.030 172.577 1.453 1
1 264 . 2 1 1 A 28 28 GLY CA C 28 45.665 43.407 2.258 1
1 265 . 2 1 1 A 28 28 GLY N N 28 115.528 106.071 9.457 1
1 266 . 2 1 1 A 29 29 HIS HA H 29 4.355 4.662 -0.307 1
1 271 . 2 1 1 A 29 29 HIS CA C 29 58.795 56.590 2.205 1
1 272 . 2 1 1 A 29 29 HIS CB C 29 31.283 31.398 -0.115 1
1 275 . 2 1 1 A 30 30 LYS HA H 30 4.096 4.578 -0.482 1
1 284 . 2 1 1 A 30 30 LYS CA C 30 57.290 54.694 2.596 1
1 285 . 2 1 1 A 30 30 LYS CB C 30 31.951 34.658 -2.707 1
1 289 . 2 1 1 A 31 31 ARG HA H 31 3.975 4.063 -0.088 1
1 296 . 2 1 1 A 31 31 ARG CA C 31 55.973 57.047 -1.074 1
1 297 . 2 1 1 A 31 31 ARG CB C 31 29.902 29.906 -0.004 1
1 300 . 2 1 1 A 32 32 LYS HA H 32 4.160 4.121 0.039 1
1 309 . 2 1 1 A 32 32 LYS C C 32 175.678 176.679 -1.001 1
1 310 . 2 1 1 A 32 32 LYS CA C 32 56.254 57.023 -0.769 1
1 311 . 2 1 1 A 32 32 LYS CB C 32 31.602 31.378 0.224 1
1 315 . 2 1 1 A 33 33 ASN H H 33 7.925 8.616 -0.691 1
1 316 . 2 1 1 A 33 33 ASN HA H 33 4.799 4.481 0.318 1
1 321 . 2 1 1 A 33 33 ASN C C 33 174.005 175.600 -1.595 1
1 322 . 2 1 1 A 33 33 ASN CA C 33 52.407 56.141 -3.734 1
1 323 . 2 1 1 A 33 33 ASN CB C 33 39.879 39.041 0.838 1
1 324 . 2 1 1 A 33 33 ASN N N 33 116.990 123.230 -6.240 1
1 326 . 2 1 1 A 34 34 TRP H H 34 8.798 7.581 1.217 1
1 327 . 2 1 1 A 34 34 TRP HA H 34 4.755 5.344 -0.589 1
1 336 . 2 1 1 A 34 34 TRP C C 34 176.090 175.009 1.081 1
1 337 . 2 1 1 A 34 34 TRP CA C 34 57.119 56.089 1.030 1
1 338 . 2 1 1 A 34 34 TRP CB C 34 30.596 32.238 -1.642 1
1 344 . 2 1 1 A 34 34 TRP N N 34 121.917 115.641 6.276 1
1 346 . 2 1 1 A 35 35 LYS H H 35 8.404 8.876 -0.472 1
1 347 . 2 1 1 A 35 35 LYS HA H 35 4.846 4.925 -0.079 1
1 354 . 2 1 1 A 35 35 LYS C C 35 176.088 176.112 -0.024 1
1 355 . 2 1 1 A 35 35 LYS CA C 35 54.418 54.754 -0.336 1
1 356 . 2 1 1 A 35 35 LYS CB C 35 36.125 34.062 2.063 1
1 360 . 2 1 1 A 35 35 LYS N N 35 120.864 125.406 -4.542 1
1 361 . 2 1 1 A 36 36 VAL H H 36 8.977 8.576 0.401 1
1 362 . 2 1 1 A 36 36 VAL HA H 36 4.274 4.644 -0.370 1
1 370 . 2 1 1 A 36 36 VAL C C 36 176.733 175.774 0.959 1
1 371 . 2 1 1 A 36 36 VAL CA C 36 64.319 61.611 2.708 1
1 372 . 2 1 1 A 36 36 VAL CB C 36 31.602 32.406 -0.804 1
1 375 . 2 1 1 A 36 36 VAL N N 36 124.314 125.401 -1.087 1
1 376 . 2 1 1 A 37 37 ARG H H 37 9.498 10.540 -1.042 1
1 377 . 2 1 1 A 37 37 ARG HA H 37 5.053 5.114 -0.061 1
1 384 . 2 1 1 A 37 37 ARG C C 37 174.442 174.759 -0.317 1
1 385 . 2 1 1 A 37 37 ARG CA C 37 53.272 54.100 -0.828 1
1 386 . 2 1 1 A 37 37 ARG CB C 37 34.563 34.172 0.391 1
1 389 . 2 1 1 A 37 37 ARG N N 37 128.121 126.574 1.547 1
1 390 . 2 1 1 A 38 38 ARG H H 38 8.755 8.860 -0.105 1
1 391 . 2 1 1 A 38 38 ARG HA H 38 4.626 4.519 0.107 1
1 398 . 2 1 1 A 38 38 ARG C C 38 175.514 175.094 0.420 1
1 399 . 2 1 1 A 38 38 ARG CA C 38 55.601 55.928 -0.327 1
1 400 . 2 1 1 A 38 38 ARG CB C 38 32.219 30.734 1.485 1
1 403 . 2 1 1 A 38 38 ARG N N 38 121.442 123.686 -2.244 1
1 404 . 2 1 1 A 39 39 PHE H H 39 9.865 9.055 0.810 1
1 405 . 2 1 1 A 39 39 PHE HA H 39 5.424 5.058 0.366 1
1 413 . 2 1 1 A 39 39 PHE C C 39 175.423 174.771 0.652 1
1 414 . 2 1 1 A 39 39 PHE CA C 39 57.419 56.935 0.484 1
1 415 . 2 1 1 A 39 39 PHE CB C 39 42.623 40.713 1.910 1
1 421 . 2 1 1 A 39 39 PHE N N 39 130.027 126.518 3.509 1
1 422 . 2 1 1 A 40 40 VAL H H 40 9.300 10.116 -0.816 1
1 423 . 2 1 1 A 40 40 VAL HA H 40 4.846 5.326 -0.480 1
1 431 . 2 1 1 A 40 40 VAL C C 40 174.477 173.436 1.041 1
1 432 . 2 1 1 A 40 40 VAL CA C 40 62.343 59.737 2.606 1
1 433 . 2 1 1 A 40 40 VAL CB C 40 35.755 34.902 0.853 1
1 436 . 2 1 1 A 40 40 VAL N N 40 119.369 122.402 -3.033 1
1 437 . 2 1 1 A 41 41 LEU H H 41 9.557 9.794 -0.237 1
1 438 . 2 1 1 A 41 41 LEU HA H 41 5.292 5.510 -0.218 1
1 448 . 2 1 1 A 41 41 LEU C C 41 174.632 175.232 -0.600 1
1 449 . 2 1 1 A 41 41 LEU CA C 41 53.571 53.583 -0.012 1
1 450 . 2 1 1 A 41 41 LEU CB C 41 45.337 44.933 0.404 1
1 454 . 2 1 1 A 41 41 LEU N N 41 132.121 129.199 2.922 1
1 455 . 2 1 1 A 42 42 ARG H H 42 9.396 9.001 0.395 1
1 456 . 2 1 1 A 42 42 ARG HA H 42 5.366 5.267 0.099 1
1 464 . 2 1 1 A 42 42 ARG C C 42 173.997 174.775 -0.778 1
1 465 . 2 1 1 A 42 42 ARG CA C 42 54.631 54.149 0.482 1
1 466 . 2 1 1 A 42 42 ARG CB C 42 35.550 34.553 0.997 1
1 469 . 2 1 1 A 42 42 ARG N N 42 128.120 123.851 4.269 1
1 471 . 2 1 1 A 43 43 LYS H H 43 8.597 8.581 0.016 1
1 472 . 2 1 1 A 43 43 LYS HA H 43 4.558 5.013 -0.455 1
1 481 . 2 1 1 A 43 43 LYS C C 43 174.648 175.186 -0.538 1
1 482 . 2 1 1 A 43 43 LYS CA C 43 53.378 54.895 -1.517 1
1 483 . 2 1 1 A 43 43 LYS CB C 43 37.303 36.151 1.152 1
1 487 . 2 1 1 A 43 43 LYS N N 43 114.484 117.734 -3.250 1
1 488 . 2 1 1 A 44 44 ASP H H 44 8.388 9.040 -0.652 1
1 489 . 2 1 1 A 44 44 ASP HA H 44 4.349 4.291 0.058 1
1 492 . 2 1 1 A 44 44 ASP C C 44 173.376 174.321 -0.945 1
1 493 . 2 1 1 A 44 44 ASP CA C 44 54.842 54.967 -0.125 1
1 494 . 2 1 1 A 44 44 ASP CB C 44 39.991 39.600 0.391 1
1 495 . 2 1 1 A 44 44 ASP N N 44 115.453 119.335 -3.882 1
1 496 . 2 1 1 A 45 45 PRO HA H 45 4.652 4.637 0.015 1
1 503 . 2 1 1 A 45 45 PRO C C 45 176.914 175.560 1.354 1
1 504 . 2 1 1 A 45 45 PRO CA C 45 63.490 62.636 0.854 1
1 505 . 2 1 1 A 45 45 PRO CB C 45 34.892 32.663 2.229 1
1 508 . 2 1 1 A 46 46 ALA H H 46 8.112 8.465 -0.353 1
1 509 . 2 1 1 A 46 46 ALA HA H 46 5.455 4.671 0.784 1
1 513 . 2 1 1 A 46 46 ALA C C 46 177.234 176.674 0.560 1
1 514 . 2 1 1 A 46 46 ALA CA C 46 51.560 50.823 0.737 1
1 515 . 2 1 1 A 46 46 ALA CB C 46 20.122 19.559 0.563 1
1 516 . 2 1 1 A 46 46 ALA N N 46 120.155 123.404 -3.249 1
1 517 . 2 1 1 A 47 47 PHE H H 47 8.717 9.034 -0.317 1
1 518 . 2 1 1 A 47 47 PHE HA H 47 4.795 5.144 -0.349 1
1 526 . 2 1 1 A 47 47 PHE C C 47 172.588 174.368 -1.780 1
1 527 . 2 1 1 A 47 47 PHE CA C 47 57.348 56.215 1.133 1
1 528 . 2 1 1 A 47 47 PHE CB C 47 47.123 44.274 2.849 1
1 534 . 2 1 1 A 47 47 PHE N N 47 129.946 120.200 9.746 1
1 535 . 2 1 1 A 48 48 LEU H H 48 7.883 7.953 -0.070 1
1 536 . 2 1 1 A 48 48 LEU HA H 48 5.198 5.047 0.151 1
1 546 . 2 1 1 A 48 48 LEU C C 48 173.569 174.409 -0.840 1
1 547 . 2 1 1 A 48 48 LEU CA C 48 53.290 54.323 -1.033 1
1 548 . 2 1 1 A 48 48 LEU CB C 48 45.502 45.618 -0.116 1
1 552 . 2 1 1 A 48 48 LEU N N 48 121.108 121.451 -0.343 1
1 553 . 2 1 1 A 49 49 HIS H H 49 8.606 8.947 -0.341 1
1 554 . 2 1 1 A 49 49 HIS HA H 49 5.035 5.148 -0.113 1
1 559 . 2 1 1 A 49 49 HIS C C 49 173.993 173.908 0.085 1
1 560 . 2 1 1 A 49 49 HIS CA C 49 56.483 54.045 2.438 1
1 561 . 2 1 1 A 49 49 HIS CB C 49 35.919 33.712 2.207 1
1 564 . 2 1 1 A 49 49 HIS N N 49 121.199 125.701 -4.502 1
1 565 . 2 1 1 A 50 50 TYR H H 50 7.777 8.236 -0.459 1
1 566 . 2 1 1 A 50 50 TYR HA H 50 5.695 5.504 0.191 1
1 573 . 2 1 1 A 50 50 TYR C C 50 174.284 172.064 2.220 1
1 574 . 2 1 1 A 50 50 TYR CA C 50 53.430 55.625 -2.195 1
1 575 . 2 1 1 A 50 50 TYR CB C 50 38.552 40.756 -2.204 1
1 580 . 2 1 1 A 50 50 TYR N N 50 114.156 117.392 -3.236 1
1 581 . 2 1 1 A 51 51 TYR H H 51 9.323 9.828 -0.505 1
1 582 . 2 1 1 A 51 51 TYR HA H 51 4.600 5.078 -0.478 1
1 589 . 2 1 1 A 51 51 TYR C C 51 175.352 174.508 0.844 1
1 590 . 2 1 1 A 51 51 TYR CA C 51 57.330 56.226 1.104 1
1 591 . 2 1 1 A 51 51 TYR CB C 51 41.683 42.065 -0.382 1
1 596 . 2 1 1 A 51 51 TYR N N 51 119.100 120.092 -0.992 1
1 597 . 2 1 1 A 52 52 ASP H H 52 9.375 8.725 0.650 1
1 598 . 2 1 1 A 52 52 ASP HA H 52 5.064 5.036 0.028 1
1 601 . 2 1 1 A 52 52 ASP C C 52 175.484 175.585 -0.101 1
1 602 . 2 1 1 A 52 52 ASP CA C 52 51.313 51.143 0.170 1
1 603 . 2 1 1 A 52 52 ASP CB C 52 41.883 42.358 -0.475 1
1 604 . 2 1 1 A 52 52 ASP N N 52 124.636 122.971 1.665 1
1 605 . 2 1 1 A 53 53 PRO HA H 53 4.678 4.610 0.068 1
1 612 . 2 1 1 A 53 53 PRO C C 53 176.781 178.002 -1.221 1
1 613 . 2 1 1 A 53 53 PRO CA C 53 64.054 64.017 0.037 1
1 614 . 2 1 1 A 53 53 PRO CB C 53 32.589 32.091 0.498 1
1 617 . 2 1 1 A 54 54 SER H H 54 8.685 9.083 -0.398 1
1 618 . 2 1 1 A 54 54 SER HA H 54 4.483 4.599 -0.116 1
1 621 . 2 1 1 A 54 54 SER C C 54 174.006 174.792 -0.786 1
1 622 . 2 1 1 A 54 54 SER CA C 54 59.378 60.326 -0.948 1
1 623 . 2 1 1 A 54 54 SER CB C 54 64.132 64.449 -0.317 1
1 624 . 2 1 1 A 54 54 SER N N 54 113.769 112.248 1.521 1
1 625 . 2 1 1 A 55 55 LYS H H 55 7.706 7.893 -0.187 1
1 626 . 2 1 1 A 55 55 LYS HA H 55 4.580 4.450 0.130 1
1 635 . 2 1 1 A 55 55 LYS C C 55 175.969 175.496 0.473 1
1 636 . 2 1 1 A 55 55 LYS CA C 55 55.160 56.373 -1.213 1
1 637 . 2 1 1 A 55 55 LYS CB C 55 34.069 33.599 0.470 1
1 641 . 2 1 1 A 55 55 LYS N N 55 122.222 120.433 1.789 1
1 642 . 2 1 1 A 56 56 GLU H H 56 8.666 8.712 -0.046 1
1 643 . 2 1 1 A 56 56 GLU HA H 56 4.174 5.144 -0.970 1
1 648 . 2 1 1 A 56 56 GLU C C 56 177.084 174.761 2.323 1
1 649 . 2 1 1 A 56 56 GLU CA C 56 57.099 55.370 1.729 1
1 650 . 2 1 1 A 56 56 GLU CB C 56 29.694 31.276 -1.582 1
1 652 . 2 1 1 A 56 56 GLU N N 56 122.015 119.284 2.731 1
1 653 . 2 1 1 A 57 57 GLU H H 57 8.303 8.940 -0.637 1
1 654 . 2 1 1 A 57 57 GLU HA H 57 4.214 4.962 -0.748 1
1 659 . 2 1 1 A 57 57 GLU CA C 57 56.960 54.941 2.019 1
1 660 . 2 1 1 A 57 57 GLU CB C 57 30.264 33.857 -3.593 1
1 662 . 2 1 1 A 57 57 GLU N N 57 119.884 122.230 -2.346 1
1 663 . 2 1 1 A 58 58 ASN HA H 58 4.768 4.929 -0.161 1
1 668 . 2 1 1 A 58 58 ASN C C 58 174.902 173.620 1.282 1
1 669 . 2 1 1 A 58 58 ASN CA C 58 52.740 53.036 -0.296 1
1 670 . 2 1 1 A 58 58 ASN CB C 58 38.116 36.439 1.677 1
1 672 . 2 1 1 A 59 59 ARG H H 59 7.805 7.752 0.053 1
1 673 . 2 1 1 A 59 59 ARG HA H 59 4.762 4.704 0.058 1
1 680 . 2 1 1 A 59 59 ARG CA C 59 53.151 54.208 -1.057 1
1 681 . 2 1 1 A 59 59 ARG CB C 59 31.519 34.305 -2.786 1
1 684 . 2 1 1 A 59 59 ARG N N 59 121.060 120.703 0.357 1
1 685 . 2 1 1 A 60 60 PRO HA H 60 3.357 3.983 -0.626 1
1 692 . 2 1 1 A 60 60 PRO C C 60 176.817 176.265 0.552 1
1 693 . 2 1 1 A 60 60 PRO CA C 60 63.031 61.774 1.257 1
1 694 . 2 1 1 A 60 60 PRO CB C 60 31.273 32.067 -0.794 1
1 697 . 2 1 1 A 61 61 VAL H H 61 8.627 8.405 0.222 1
1 698 . 2 1 1 A 61 61 VAL HA H 61 3.966 3.812 0.154 1
1 706 . 2 1 1 A 61 61 VAL C C 61 176.503 176.213 0.290 1
1 707 . 2 1 1 A 61 61 VAL CA C 61 63.154 64.551 -1.397 1
1 708 . 2 1 1 A 61 61 VAL CB C 61 32.048 32.204 -0.156 1
1 711 . 2 1 1 A 61 61 VAL N N 61 119.185 119.984 -0.799 1
1 712 . 2 1 1 A 62 62 GLY H H 62 6.715 6.136 0.579 1
1 713 . 2 1 1 A 62 62 GLY HA2 H 62 3.940 3.776 0.164 1
1 714 . 2 1 1 A 62 62 GLY HA3 H 62 3.538 3.882 -0.344 1
1 715 . 2 1 1 A 62 62 GLY C C 62 169.983 172.176 -2.193 1
1 716 . 2 1 1 A 62 62 GLY CA C 62 44.465 45.365 -0.900 1
1 717 . 2 1 1 A 62 62 GLY N N 62 105.813 105.617 0.196 1
1 718 . 2 1 1 A 63 63 GLY H H 63 8.004 8.556 -0.552 1
1 719 . 2 1 1 A 63 63 GLY HA2 H 63 4.095 3.280 0.815 1
1 720 . 2 1 1 A 63 63 GLY HA3 H 63 3.813 3.817 -0.004 1
1 721 . 2 1 1 A 63 63 GLY C C 63 171.870 172.464 -0.594 1
1 722 . 2 1 1 A 63 63 GLY CA C 63 47.148 44.277 2.871 1
1 723 . 2 1 1 A 63 63 GLY N N 63 105.089 107.743 -2.654 1
1 724 . 2 1 1 A 64 64 PHE H H 64 7.967 7.536 0.431 1
1 725 . 2 1 1 A 64 64 PHE HA H 64 4.934 5.630 -0.696 1
1 733 . 2 1 1 A 64 64 PHE C C 64 173.140 173.878 -0.738 1
1 734 . 2 1 1 A 64 64 PHE CA C 64 55.248 55.144 0.104 1
1 735 . 2 1 1 A 64 64 PHE CB C 64 40.238 42.380 -2.142 1
1 741 . 2 1 1 A 64 64 PHE N N 64 113.387 121.078 -7.691 1
1 742 . 2 1 1 A 65 65 SER H H 65 8.518 8.992 -0.474 1
1 743 . 2 1 1 A 65 65 SER HA H 65 3.264 3.599 -0.335 1
1 746 . 2 1 1 A 65 65 SER C C 65 176.417 174.766 1.651 1
1 747 . 2 1 1 A 65 65 SER CA C 65 56.819 57.525 -0.706 1
1 748 . 2 1 1 A 65 65 SER CB C 65 63.391 62.786 0.605 1
1 749 . 2 1 1 A 65 65 SER N N 65 114.674 115.545 -0.871 1
1 750 . 2 1 1 A 66 66 LEU H H 66 7.404 7.833 -0.429 1
1 751 . 2 1 1 A 66 66 LEU HA H 66 4.470 4.030 0.440 1
1 761 . 2 1 1 A 66 66 LEU C C 66 177.993 177.731 0.262 1
1 762 . 2 1 1 A 66 66 LEU CA C 66 54.242 58.198 -3.956 1
1 763 . 2 1 1 A 66 66 LEU CB C 66 42.787 41.555 1.232 1
1 767 . 2 1 1 A 66 66 LEU N N 66 123.988 126.892 -2.904 1
1 768 . 2 1 1 A 67 67 ARG H H 67 7.865 6.886 0.979 1
1 769 . 2 1 1 A 67 67 ARG HA H 67 4.175 4.045 0.130 1
1 776 . 2 1 1 A 67 67 ARG C C 67 178.562 177.087 1.475 1
1 777 . 2 1 1 A 67 67 ARG CA C 67 58.143 58.185 -0.042 1
1 778 . 2 1 1 A 67 67 ARG CB C 67 29.052 30.186 -1.134 1
1 781 . 2 1 1 A 67 67 ARG N N 67 122.494 119.054 3.440 1
1 782 . 2 1 1 A 68 68 GLY H H 68 9.398 8.731 0.667 1
1 783 . 2 1 1 A 68 68 GLY HA2 H 68 4.066 3.973 0.093 1
1 784 . 2 1 1 A 68 68 GLY HA3 H 68 3.908 3.974 -0.066 1
1 785 . 2 1 1 A 68 68 GLY C C 68 173.982 173.900 0.082 1
1 786 . 2 1 1 A 68 68 GLY CA C 68 46.230 46.514 -0.284 1
1 787 . 2 1 1 A 68 68 GLY N N 68 117.548 113.426 4.122 1
1 788 . 2 1 1 A 69 69 SER H H 69 7.829 7.777 0.052 1
1 789 . 2 1 1 A 69 69 SER HA H 69 4.807 5.085 -0.278 1
1 792 . 2 1 1 A 69 69 SER C C 69 172.854 172.746 0.108 1
1 793 . 2 1 1 A 69 69 SER CA C 69 59.290 57.182 2.108 1
1 794 . 2 1 1 A 69 69 SER CB C 69 65.366 67.600 -2.234 1
1 795 . 2 1 1 A 69 69 SER N N 69 115.188 114.475 0.713 1
1 796 . 2 1 1 A 70 70 LEU H H 70 8.805 8.729 0.076 1
1 797 . 2 1 1 A 70 70 LEU HA H 70 4.846 4.835 0.011 1
1 807 . 2 1 1 A 70 70 LEU C C 70 175.775 174.217 1.558 1
1 808 . 2 1 1 A 70 70 LEU CA C 70 53.907 54.045 -0.138 1
1 809 . 2 1 1 A 70 70 LEU CB C 70 45.337 45.852 -0.515 1
1 813 . 2 1 1 A 70 70 LEU N N 70 121.265 122.811 -1.546 1
1 814 . 2 1 1 A 71 71 VAL H H 71 8.644 8.744 -0.100 1
1 815 . 2 1 1 A 71 71 VAL HA H 71 5.555 5.246 0.309 1
1 823 . 2 1 1 A 71 71 VAL C C 71 173.636 173.231 0.405 1
1 824 . 2 1 1 A 71 71 VAL CA C 71 58.760 59.774 -1.014 1
1 825 . 2 1 1 A 71 71 VAL CB C 71 34.891 35.846 -0.955 1
1 828 . 2 1 1 A 71 71 VAL N N 71 122.315 122.621 -0.306 1
1 829 . 2 1 1 A 72 72 SER H H 72 8.750 8.847 -0.097 1
1 830 . 2 1 1 A 72 72 SER HA H 72 4.742 5.053 -0.311 1
1 833 . 2 1 1 A 72 72 SER C C 72 173.058 172.392 0.666 1
1 834 . 2 1 1 A 72 72 SER CA C 72 57.190 57.764 -0.574 1
1 835 . 2 1 1 A 72 72 SER CB C 72 65.612 67.797 -2.185 1
1 836 . 2 1 1 A 72 72 SER N N 72 118.611 120.938 -2.327 1
1 837 . 2 1 1 A 73 73 ALA H H 73 9.009 8.820 0.189 1
1 838 . 2 1 1 A 73 73 ALA HA H 73 4.406 5.431 -1.025 1
1 842 . 2 1 1 A 73 73 ALA C C 73 176.708 176.927 -0.219 1
1 843 . 2 1 1 A 73 73 ALA CA C 73 52.672 49.830 2.842 1
1 844 . 2 1 1 A 73 73 ALA CB C 73 18.812 22.167 -3.355 1
1 845 . 2 1 1 A 73 73 ALA N N 73 125.694 125.159 0.535 1
1 846 . 2 1 1 A 74 74 LEU H H 74 7.800 8.852 -1.052 1
1 847 . 2 1 1 A 74 74 LEU HA H 74 4.716 4.907 -0.191 1
1 857 . 2 1 1 A 74 74 LEU C C 74 176.551 175.621 0.930 1
1 858 . 2 1 1 A 74 74 LEU CA C 74 53.784 53.389 0.395 1
1 859 . 2 1 1 A 74 74 LEU CB C 74 43.446 42.591 0.855 1
1 863 . 2 1 1 A 74 74 LEU N N 74 122.271 121.109 1.162 1
1 864 . 2 1 1 A 75 75 GLU H H 75 8.855 8.552 0.303 1
1 865 . 2 1 1 A 75 75 GLU HA H 75 4.336 4.912 -0.576 1
1 870 . 2 1 1 A 75 75 GLU C C 75 176.465 176.634 -0.169 1
1 871 . 2 1 1 A 75 75 GLU CA C 75 56.507 54.502 2.005 1
1 872 . 2 1 1 A 75 75 GLU CB C 75 30.245 32.245 -2.000 1
1 874 . 2 1 1 A 75 75 GLU N N 75 122.678 118.868 3.810 1
1 875 . 2 1 1 A 76 76 ASP H H 76 8.542 8.983 -0.441 1
1 876 . 2 1 1 A 76 76 ASP HA H 76 4.665 4.182 0.483 1
1 879 . 2 1 1 A 76 76 ASP C C 76 176.087 175.956 0.131 1
1 880 . 2 1 1 A 76 76 ASP CA C 76 55.107 57.897 -2.790 1
1 881 . 2 1 1 A 76 76 ASP CB C 76 41.431 40.796 0.635 1
1 882 . 2 1 1 A 76 76 ASP N N 76 121.488 124.864 -3.376 1
1 883 . 2 1 1 A 77 77 ASN H H 77 8.322 8.086 0.236 1
1 884 . 2 1 1 A 77 77 ASN HA H 77 4.729 4.650 0.079 1
1 889 . 2 1 1 A 77 77 ASN C C 77 175.566 174.319 1.247 1
1 890 . 2 1 1 A 77 77 ASN CA C 77 53.131 55.332 -2.201 1
1 891 . 2 1 1 A 77 77 ASN CB C 77 38.617 37.403 1.214 1
1 892 . 2 1 1 A 77 77 ASN N N 77 118.676 116.575 2.101 1
1 894 . 2 1 1 A 78 78 GLY H H 78 8.311 8.460 -0.149 1
1 895 . 2 1 1 A 78 78 GLY HA2 H 78 3.897 4.178 -0.281 1
1 896 . 2 1 1 A 78 78 GLY HA3 H 78 3.897 4.182 -0.285 1
1 897 . 2 1 1 A 78 78 GLY C C 78 173.376 174.088 -0.712 1
1 898 . 2 1 1 A 78 78 GLY CA C 78 45.224 45.669 -0.445 1
1 899 . 2 1 1 A 78 78 GLY N N 78 108.939 108.742 0.197 1
1 900 . 2 1 1 A 79 79 VAL H H 79 7.882 8.213 -0.331 1
1 901 . 2 1 1 A 79 79 VAL HA H 79 4.345 4.271 0.074 1
1 909 . 2 1 1 A 79 79 VAL CA C 79 59.995 63.311 -3.316 1
1 910 . 2 1 1 A 79 79 VAL CB C 79 32.589 30.756 1.833 1
1 913 . 2 1 1 A 79 79 VAL N N 79 121.135 120.646 0.489 1
1 914 . 2 1 1 A 80 80 PRO HA H 80 4.461 4.423 0.038 1
1 921 . 2 1 1 A 80 80 PRO C C 80 176.979 176.957 0.022 1
1 922 . 2 1 1 A 80 80 PRO CA C 80 63.101 65.577 -2.476 1
1 923 . 2 1 1 A 80 80 PRO CB C 80 32.177 31.845 0.332 1
1 926 . 2 1 1 A 81 81 THR H H 81 8.281 7.564 0.717 1
1 927 . 2 1 1 A 81 81 THR HA H 81 4.095 4.585 -0.490 1
1 932 . 2 1 1 A 81 81 THR C C 81 175.270 173.873 1.397 1
1 933 . 2 1 1 A 81 81 THR CA C 81 62.872 62.450 0.422 1
1 934 . 2 1 1 A 81 81 THR CB C 81 69.642 70.266 -0.624 1
1 936 . 2 1 1 A 81 81 THR N N 81 114.684 109.518 5.166 1
1 937 . 2 1 1 A 82 82 GLY H H 82 8.338 8.193 0.145 1
1 938 . 2 1 1 A 82 82 GLY HA2 H 82 4.095 3.938 0.157 1
1 939 . 2 1 1 A 82 82 GLY HA3 H 82 3.668 3.956 -0.288 1
1 940 . 2 1 1 A 82 82 GLY C C 82 174.139 173.837 0.302 1
1 941 . 2 1 1 A 82 82 GLY CA C 82 45.083 46.779 -1.696 1
1 942 . 2 1 1 A 82 82 GLY N N 82 111.289 108.623 2.666 1
1 943 . 2 1 1 A 83 83 VAL H H 83 7.668 8.611 -0.943 1
1 944 . 2 1 1 A 83 83 VAL HA H 83 3.985 4.137 -0.152 1
1 952 . 2 1 1 A 83 83 VAL C C 83 176.054 175.684 0.370 1
1 953 . 2 1 1 A 83 83 VAL CA C 83 62.431 63.660 -1.229 1
1 954 . 2 1 1 A 83 83 VAL CB C 83 32.260 33.199 -0.939 1
1 957 . 2 1 1 A 83 83 VAL N N 83 120.003 122.644 -2.641 1
1 958 . 2 1 1 A 84 84 LYS H H 84 8.645 7.517 1.128 1
1 959 . 2 1 1 A 84 84 LYS HA H 84 4.276 4.650 -0.374 1
1 968 . 2 1 1 A 84 84 LYS C C 84 176.832 176.952 -0.120 1
1 969 . 2 1 1 A 84 84 LYS CA C 84 56.272 54.806 1.466 1
1 970 . 2 1 1 A 84 84 LYS CB C 84 32.876 36.668 -3.792 1
1 974 . 2 1 1 A 84 84 LYS N N 84 126.447 118.085 8.362 1
1 975 . 2 1 1 A 85 85 GLY H H 85 8.410 8.712 -0.302 1
1 976 . 2 1 1 A 85 85 GLY HA2 H 85 4.066 3.830 0.236 1
1 977 . 2 1 1 A 85 85 GLY HA3 H 85 3.781 3.833 -0.052 1
1 978 . 2 1 1 A 85 85 GLY C C 85 173.969 174.562 -0.593 1
1 979 . 2 1 1 A 85 85 GLY CA C 85 45.146 47.720 -2.574 1
1 980 . 2 1 1 A 85 85 GLY N N 85 109.957 109.500 0.457 1
1 981 . 2 1 1 A 86 86 ASN H H 86 8.298 7.763 0.535 1
1 982 . 2 1 1 A 86 86 ASN HA H 86 4.665 4.934 -0.269 1
1 987 . 2 1 1 A 86 86 ASN C C 86 174.987 173.485 1.502 1
1 988 . 2 1 1 A 86 86 ASN CA C 86 52.989 52.773 0.216 1
1 989 . 2 1 1 A 86 86 ASN CB C 86 38.376 41.240 -2.864 1
1 990 . 2 1 1 A 86 86 ASN N N 86 118.457 115.759 2.698 1
1 992 . 2 1 1 A 87 87 VAL H H 87 7.660 8.703 -1.043 1
1 993 . 2 1 1 A 87 87 VAL HA H 87 3.946 3.922 0.024 1
1 1001 . 2 1 1 A 87 87 VAL C C 87 174.902 176.376 -1.474 1
1 1002 . 2 1 1 A 87 87 VAL CA C 87 62.307 61.879 0.428 1
1 1003 . 2 1 1 A 87 87 VAL CB C 87 32.548 33.175 -0.627 1
1 1006 . 2 1 1 A 87 87 VAL N N 87 120.557 122.156 -1.599 1
1 1007 . 2 1 1 A 88 88 GLN H H 88 8.115 8.046 0.069 1
1 1008 . 2 1 1 A 88 88 GLN HA H 88 4.302 4.033 0.269 1
1 1015 . 2 1 1 A 88 88 GLN C C 88 175.637 176.512 -0.875 1
1 1016 . 2 1 1 A 88 88 GLN CA C 88 55.336 57.674 -2.338 1
1 1017 . 2 1 1 A 88 88 GLN CB C 88 30.574 28.898 1.676 1
1 1019 . 2 1 1 A 88 88 GLN N N 88 122.280 120.962 1.318 1
1 1021 . 2 1 1 A 89 89 GLY H H 89 8.544 7.297 1.247 1
1 1022 . 2 1 1 A 89 89 GLY HA2 H 89 3.885 4.090 -0.205 1
1 1023 . 2 1 1 A 89 89 GLY HA3 H 89 3.885 4.093 -0.208 1
1 1024 . 2 1 1 A 89 89 GLY C C 89 172.861 174.126 -1.265 1
1 1025 . 2 1 1 A 89 89 GLY CA C 89 44.889 45.768 -0.879 1
1 1026 . 2 1 1 A 89 89 GLY N N 89 110.135 103.354 6.781 1
1 1027 . 2 1 1 A 90 90 ASN H H 90 8.451 9.285 -0.834 1
1 1028 . 2 1 1 A 90 90 ASN HA H 90 4.222 5.107 -0.885 1
1 1033 . 2 1 1 A 90 90 ASN C C 90 174.926 174.473 0.453 1
1 1034 . 2 1 1 A 90 90 ASN CA C 90 54.613 54.979 -0.366 1
1 1035 . 2 1 1 A 90 90 ASN CB C 90 37.852 38.602 -0.750 1
1 1036 . 2 1 1 A 90 90 ASN N N 90 114.322 122.788 -8.466 1
1 1038 . 2 1 1 A 91 91 LEU H H 91 8.933 8.457 0.476 1
1 1039 . 2 1 1 A 91 91 LEU HA H 91 5.367 4.306 1.061 1
1 1049 . 2 1 1 A 91 91 LEU C C 91 178.732 175.802 2.930 1
1 1050 . 2 1 1 A 91 91 LEU CA C 91 55.160 56.971 -1.811 1
1 1051 . 2 1 1 A 91 91 LEU CB C 91 45.461 40.598 4.863 1
1 1055 . 2 1 1 A 91 91 LEU N N 91 120.057 120.568 -0.511 1
1 1056 . 2 1 1 A 92 92 PHE H H 92 9.901 7.841 2.060 1
1 1057 . 2 1 1 A 92 92 PHE HA H 92 5.105 5.330 -0.225 1
1 1065 . 2 1 1 A 92 92 PHE C C 92 170.140 172.642 -2.502 1
1 1066 . 2 1 1 A 92 92 PHE CA C 92 56.236 56.068 0.168 1
1 1067 . 2 1 1 A 92 92 PHE CB C 92 42.664 41.102 1.562 1
1 1073 . 2 1 1 A 92 92 PHE N N 92 119.740 115.579 4.161 1
1 1074 . 2 1 1 A 93 93 LYS H H 93 9.154 8.976 0.178 1
1 1075 . 2 1 1 A 93 93 LYS HA H 93 5.584 4.983 0.601 1
1 1083 . 2 1 1 A 93 93 LYS C C 93 174.830 175.077 -0.247 1
1 1084 . 2 1 1 A 93 93 LYS CA C 93 53.148 53.758 -0.610 1
1 1085 . 2 1 1 A 93 93 LYS CB C 93 36.660 36.044 0.616 1
1 1089 . 2 1 1 A 93 93 LYS N N 93 117.710 118.404 -0.694 1
1 1090 . 2 1 1 A 94 94 VAL H H 94 8.507 8.628 -0.121 1
1 1091 . 2 1 1 A 94 94 VAL HA H 94 4.872 5.025 -0.153 1
1 1099 . 2 1 1 A 94 94 VAL C C 94 174.408 174.952 -0.544 1
1 1100 . 2 1 1 A 94 94 VAL CA C 94 60.525 61.638 -1.113 1
1 1101 . 2 1 1 A 94 94 VAL CB C 94 34.862 34.068 0.794 1
1 1104 . 2 1 1 A 94 94 VAL N N 94 121.741 120.188 1.553 1
1 1105 . 2 1 1 A 95 95 ILE H H 95 8.959 8.859 0.100 1
1 1106 . 2 1 1 A 95 95 ILE HA H 95 4.794 4.594 0.200 1
1 1116 . 2 1 1 A 95 95 ILE C C 95 177.642 176.207 1.435 1
1 1117 . 2 1 1 A 95 95 ILE CA C 95 59.713 60.785 -1.072 1
1 1118 . 2 1 1 A 95 95 ILE CB C 95 40.032 37.237 2.795 1
1 1122 . 2 1 1 A 95 95 ILE N N 95 126.794 128.332 -1.538 1
1 1123 . 2 1 1 A 96 96 THR H H 96 8.765 8.850 -0.085 1
1 1124 . 2 1 1 A 96 96 THR HA H 96 4.584 4.855 -0.271 1
1 1129 . 2 1 1 A 96 96 THR C C 96 177.023 176.193 0.830 1
1 1130 . 2 1 1 A 96 96 THR CA C 96 61.372 60.663 0.709 1
1 1131 . 2 1 1 A 96 96 THR CB C 96 70.794 71.488 -0.694 1
1 1133 . 2 1 1 A 96 96 THR N N 96 117.225 120.568 -3.343 1
1 1134 . 2 1 1 A 97 97 LYS H H 97 8.736 8.962 -0.226 1
1 1135 . 2 1 1 A 97 97 LYS HA H 97 4.101 4.116 -0.015 1
1 1144 . 2 1 1 A 97 97 LYS C C 97 176.490 176.839 -0.349 1
1 1145 . 2 1 1 A 97 97 LYS CA C 97 58.583 58.466 0.117 1
1 1146 . 2 1 1 A 97 97 LYS CB C 97 31.848 31.899 -0.051 1
1 1150 . 2 1 1 A 97 97 LYS N N 97 120.457 119.529 0.928 1
1 1151 . 2 1 1 A 98 98 ASP H H 98 7.762 7.606 0.156 1
1 1152 . 2 1 1 A 98 98 ASP HA H 98 4.633 4.769 -0.136 1
1 1155 . 2 1 1 A 98 98 ASP C C 98 175.270 174.786 0.484 1
1 1156 . 2 1 1 A 98 98 ASP CA C 98 53.272 53.877 -0.605 1
1 1157 . 2 1 1 A 98 98 ASP CB C 98 39.909 40.836 -0.927 1
1 1158 . 2 1 1 A 98 98 ASP N N 98 116.281 118.404 -2.123 1
1 1159 . 2 1 1 A 99 99 ASP H H 99 8.340 8.160 0.180 1
1 1160 . 2 1 1 A 99 99 ASP HA H 99 4.245 4.623 -0.378 1
1 1163 . 2 1 1 A 99 99 ASP C C 99 175.315 175.930 -0.615 1
1 1164 . 2 1 1 A 99 99 ASP CA C 99 55.989 55.236 0.753 1
1 1165 . 2 1 1 A 99 99 ASP CB C 99 39.827 39.785 0.042 1
1 1166 . 2 1 1 A 99 99 ASP N N 99 116.687 117.753 -1.066 1
1 1167 . 2 1 1 A 100 100 THR H H 100 7.511 7.819 -0.308 1
1 1168 . 2 1 1 A 100 100 THR HA H 100 4.185 3.752 0.433 1
1 1173 . 2 1 1 A 100 100 THR C C 100 173.376 174.728 -1.352 1
1 1174 . 2 1 1 A 100 100 THR CA C 100 63.489 66.476 -2.987 1
1 1175 . 2 1 1 A 100 100 THR CB C 100 67.909 68.943 -1.034 1
1 1177 . 2 1 1 A 100 100 THR N N 100 116.525 111.666 4.859 1
1 1178 . 2 1 1 A 101 101 HIS H H 101 8.753 8.151 0.602 1
1 1179 . 2 1 1 A 101 101 HIS HA H 101 4.898 4.596 0.302 1
1 1184 . 2 1 1 A 101 101 HIS C C 101 174.345 173.902 0.443 1
1 1185 . 2 1 1 A 101 101 HIS CA C 101 55.072 56.147 -1.075 1
1 1186 . 2 1 1 A 101 101 HIS CB C 101 32.835 27.954 4.881 1
1 1189 . 2 1 1 A 101 101 HIS N N 101 125.953 116.852 9.101 1
1 1190 . 2 1 1 A 102 102 TYR H H 102 9.023 8.464 0.559 1
1 1191 . 2 1 1 A 102 102 TYR HA H 102 4.545 4.946 -0.401 1
1 1198 . 2 1 1 A 102 102 TYR C C 102 174.126 174.900 -0.774 1
1 1199 . 2 1 1 A 102 102 TYR CA C 102 57.260 56.625 0.635 1
1 1200 . 2 1 1 A 102 102 TYR CB C 102 40.381 38.146 2.235 1
1 1205 . 2 1 1 A 102 102 TYR N N 102 121.975 122.240 -0.265 1
1 1206 . 2 1 1 A 103 103 TYR H H 103 8.899 9.033 -0.134 1
1 1207 . 2 1 1 A 103 103 TYR HA H 103 4.729 4.836 -0.107 1
1 1214 . 2 1 1 A 103 103 TYR C C 103 174.139 175.959 -1.820 1
1 1215 . 2 1 1 A 103 103 TYR CA C 103 58.036 58.452 -0.416 1
1 1216 . 2 1 1 A 103 103 TYR CB C 103 40.485 39.297 1.188 1
1 1221 . 2 1 1 A 103 103 TYR N N 103 122.012 124.674 -2.662 1
1 1222 . 2 1 1 A 104 104 ILE H H 104 8.605 8.429 0.176 1
1 1223 . 2 1 1 A 104 104 ILE HA H 104 4.859 4.812 0.047 1
1 1233 . 2 1 1 A 104 104 ILE C C 104 172.769 174.162 -1.393 1
1 1234 . 2 1 1 A 104 104 ILE CA C 104 59.554 59.583 -0.029 1
1 1235 . 2 1 1 A 104 104 ILE CB C 104 40.631 42.168 -1.537 1
1 1239 . 2 1 1 A 104 104 ILE N N 104 123.443 123.202 0.241 1
1 1240 . 2 1 1 A 105 105 GLN H H 105 9.369 8.388 0.981 1
1 1241 . 2 1 1 A 105 105 GLN HA H 105 4.895 5.087 -0.192 1
1 1248 . 2 1 1 A 105 105 GLN C C 105 175.642 174.897 0.745 1
1 1249 . 2 1 1 A 105 105 GLN CA C 105 54.965 53.899 1.066 1
1 1250 . 2 1 1 A 105 105 GLN CB C 105 32.856 32.231 0.625 1
1 1252 . 2 1 1 A 105 105 GLN N N 105 125.079 123.803 1.276 1
1 1254 . 2 1 1 A 106 106 ALA H H 106 8.513 8.336 0.177 1
1 1255 . 2 1 1 A 106 106 ALA HA H 106 4.962 4.774 0.188 1
1 1259 . 2 1 1 A 106 106 ALA C C 106 175.854 177.597 -1.743 1
1 1260 . 2 1 1 A 106 106 ALA CA C 106 50.272 50.063 0.209 1
1 1261 . 2 1 1 A 106 106 ALA CB C 106 21.197 22.065 -0.868 1
1 1262 . 2 1 1 A 106 106 ALA N N 106 129.303 127.941 1.362 1
1 1263 . 2 1 1 A 107 107 SER H H 107 9.468 8.912 0.556 1
1 1264 . 2 1 1 A 107 107 SER HA H 107 4.447 4.563 -0.116 1
1 1267 . 2 1 1 A 107 107 SER C C 107 173.785 174.536 -0.751 1
1 1268 . 2 1 1 A 107 107 SER CA C 107 60.048 60.362 -0.314 1
1 1269 . 2 1 1 A 107 107 SER CB C 107 64.643 64.312 0.331 1
1 1270 . 2 1 1 A 107 107 SER N N 107 112.962 115.443 -2.481 1
1 1271 . 2 1 1 A 108 108 SER H H 108 7.555 7.958 -0.403 1
1 1272 . 2 1 1 A 108 108 SER HA H 108 4.665 4.833 -0.168 1
1 1275 . 2 1 1 A 108 108 SER C C 108 174.381 174.384 -0.003 1
1 1276 . 2 1 1 A 108 108 SER CA C 108 56.907 56.508 0.399 1
1 1277 . 2 1 1 A 108 108 SER CB C 108 66.370 65.510 0.860 1
1 1278 . 2 1 1 A 108 108 SER N N 108 112.243 113.451 -1.208 1
1 1279 . 2 1 1 A 109 109 LYS H H 109 8.978 8.864 0.114 1
1 1280 . 2 1 1 A 109 109 LYS HA H 109 4.777 3.899 0.878 1
1 1287 . 2 1 1 A 109 109 LYS C C 109 179.992 177.959 2.033 1
1 1288 . 2 1 1 A 109 109 LYS CA C 109 59.766 60.366 -0.600 1
1 1289 . 2 1 1 A 109 109 LYS CB C 109 32.342 32.088 0.254 1
1 1293 . 2 1 1 A 109 109 LYS N N 109 123.170 125.711 -2.541 1
1 1294 . 2 1 1 A 110 110 ALA H H 110 8.608 8.105 0.503 1
1 1295 . 2 1 1 A 110 110 ALA HA H 110 4.178 4.064 0.114 1
1 1299 . 2 1 1 A 110 110 ALA C C 110 179.895 179.134 0.761 1
1 1300 . 2 1 1 A 110 110 ALA CA C 110 54.871 55.385 -0.514 1
1 1301 . 2 1 1 A 110 110 ALA CB C 110 18.065 18.278 -0.213 1
1 1302 . 2 1 1 A 110 110 ALA N N 110 123.750 121.183 2.567 1
1 1303 . 2 1 1 A 111 111 GLU H H 111 8.185 8.387 -0.202 1
1 1304 . 2 1 1 A 111 111 GLU HA H 111 4.180 4.056 0.124 1
1 1309 . 2 1 1 A 111 111 GLU C C 111 178.587 179.243 -0.656 1
1 1310 . 2 1 1 A 111 111 GLU CA C 111 59.466 59.858 -0.392 1
1 1311 . 2 1 1 A 111 111 GLU CB C 111 31.067 29.527 1.540 1
1 1313 . 2 1 1 A 111 111 GLU N N 111 119.757 118.508 1.249 1
1 1314 . 2 1 1 A 112 112 ARG H H 112 8.008 7.838 0.170 1
1 1315 . 2 1 1 A 112 112 ARG HA H 112 3.642 4.062 -0.420 1
1 1322 . 2 1 1 A 112 112 ARG C C 112 176.481 178.154 -1.673 1
1 1323 . 2 1 1 A 112 112 ARG CA C 112 60.419 59.238 1.181 1
1 1324 . 2 1 1 A 112 112 ARG CB C 112 29.957 29.784 0.173 1
1 1327 . 2 1 1 A 112 112 ARG N N 112 118.430 119.203 -0.773 1
1 1328 . 2 1 1 A 113 113 ALA H H 113 7.985 7.717 0.268 1
1 1329 . 2 1 1 A 113 113 ALA HA H 113 3.925 4.042 -0.117 1
1 1333 . 2 1 1 A 113 113 ALA C C 113 180.117 180.098 0.019 1
1 1334 . 2 1 1 A 113 113 ALA CA C 113 55.372 55.523 -0.151 1
1 1335 . 2 1 1 A 113 113 ALA CB C 113 17.825 18.587 -0.762 1
1 1336 . 2 1 1 A 113 113 ALA N N 113 119.980 121.032 -1.052 1
1 1337 . 2 1 1 A 114 114 GLU H H 114 8.093 8.236 -0.143 1
1 1338 . 2 1 1 A 114 114 GLU HA H 114 3.936 3.905 0.031 1
1 1343 . 2 1 1 A 114 114 GLU C C 114 180.586 179.456 1.130 1
1 1344 . 2 1 1 A 114 114 GLU CA C 114 59.148 59.343 -0.195 1
1 1345 . 2 1 1 A 114 114 GLU CB C 114 30.080 29.238 0.842 1
1 1347 . 2 1 1 A 114 114 GLU N N 114 117.168 117.659 -0.491 1
1 1348 . 2 1 1 A 115 115 TRP H H 115 7.980 8.309 -0.329 1
1 1349 . 2 1 1 A 115 115 TRP HA H 115 3.775 4.366 -0.591 1
1 1358 . 2 1 1 A 115 115 TRP C C 115 177.714 178.606 -0.892 1
1 1359 . 2 1 1 A 115 115 TRP CA C 115 62.696 59.485 3.211 1
1 1360 . 2 1 1 A 115 115 TRP CB C 115 29.052 29.272 -0.220 1
1 1366 . 2 1 1 A 115 115 TRP N N 115 120.974 120.823 0.151 1
1 1368 . 2 1 1 A 116 116 ILE H H 116 8.297 10.022 -1.725 1
1 1369 . 2 1 1 A 116 116 ILE HA H 116 3.270 3.417 -0.147 1
1 1379 . 2 1 1 A 116 116 ILE C C 116 177.568 177.734 -0.166 1
1 1380 . 2 1 1 A 116 116 ILE CA C 116 66.643 64.872 1.771 1
1 1381 . 2 1 1 A 116 116 ILE CB C 116 37.606 37.455 0.151 1
1 1385 . 2 1 1 A 116 116 ILE N N 116 118.408 119.836 -1.428 1
1 1386 . 2 1 1 A 117 117 GLU H H 117 8.026 8.967 -0.941 1
1 1387 . 2 1 1 A 117 117 GLU HA H 117 3.880 3.993 -0.113 1
1 1392 . 2 1 1 A 117 117 GLU C C 117 178.476 178.686 -0.210 1
1 1393 . 2 1 1 A 117 117 GLU CA C 117 59.219 59.752 -0.533 1
1 1394 . 2 1 1 A 117 117 GLU CB C 117 29.381 29.573 -0.192 1
1 1396 . 2 1 1 A 117 117 GLU N N 117 117.096 120.354 -3.258 1
1 1397 . 2 1 1 A 118 118 ALA H H 118 7.555 7.943 -0.388 1
1 1398 . 2 1 1 A 118 118 ALA HA H 118 3.952 4.031 -0.079 1
1 1402 . 2 1 1 A 118 118 ALA C C 118 179.862 180.002 -0.140 1
1 1403 . 2 1 1 A 118 118 ALA CA C 118 54.772 55.044 -0.272 1
1 1404 . 2 1 1 A 118 118 ALA CB C 118 18.277 18.404 -0.127 1
1 1405 . 2 1 1 A 118 118 ALA N N 118 119.817 121.447 -1.630 1
1 1406 . 2 1 1 A 119 119 ILE H H 119 8.167 8.130 0.037 1
1 1407 . 2 1 1 A 119 119 ILE HA H 119 3.558 3.714 -0.156 1
1 1417 . 2 1 1 A 119 119 ILE C C 119 178.564 177.906 0.658 1
1 1418 . 2 1 1 A 119 119 ILE CA C 119 65.766 65.371 0.395 1
1 1419 . 2 1 1 A 119 119 ILE CB C 119 38.840 38.308 0.532 1
1 1423 . 2 1 1 A 119 119 ILE N N 119 116.280 117.884 -1.604 1
1 1424 . 2 1 1 A 120 120 LYS H H 120 8.790 8.146 0.644 1
1 1425 . 2 1 1 A 120 120 LYS HA H 120 3.965 4.225 -0.260 1
1 1434 . 2 1 1 A 120 120 LYS C C 120 179.673 179.200 0.473 1
1 1435 . 2 1 1 A 120 120 LYS CA C 120 60.031 60.384 -0.353 1
1 1436 . 2 1 1 A 120 120 LYS CB C 120 32.547 32.325 0.222 1
1 1440 . 2 1 1 A 120 120 LYS N N 120 119.650 118.739 0.911 1
1 1441 . 2 1 1 A 121 121 LYS H H 121 7.594 8.022 -0.428 1
1 1442 . 2 1 1 A 121 121 LYS HA H 121 4.095 3.971 0.124 1
1 1451 . 2 1 1 A 121 121 LYS C C 121 177.962 179.227 -1.265 1
1 1452 . 2 1 1 A 121 121 LYS CA C 121 58.848 59.225 -0.377 1
1 1453 . 2 1 1 A 121 121 LYS CB C 121 32.547 32.280 0.267 1
1 1457 . 2 1 1 A 121 121 LYS N N 121 117.197 119.986 -2.789 1
1 1458 . 2 1 1 A 122 122 LEU H H 122 7.586 7.942 -0.356 1
1 1459 . 2 1 1 A 122 122 LEU HA H 122 4.535 3.925 0.610 1
1 1469 . 2 1 1 A 122 122 LEU C C 122 177.902 177.416 0.486 1
1 1470 . 2 1 1 A 122 122 LEU CA C 122 55.071 57.981 -2.910 1
1 1471 . 2 1 1 A 122 122 LEU CB C 122 42.888 41.787 1.101 1
1 1475 . 2 1 1 A 122 122 LEU N N 122 116.861 119.649 -2.788 1
1 1476 . 2 1 1 A 123 123 THR H H 123 7.636 7.741 -0.105 1
1 1477 . 2 1 1 A 123 123 THR HA H 123 4.445 4.370 0.075 1
1 1482 . 2 1 1 A 123 123 THR C C 123 175.714 173.955 1.759 1
1 1483 . 2 1 1 A 123 123 THR CA C 123 62.643 61.238 1.405 1
1 1484 . 2 1 1 A 123 123 THR CB C 123 70.259 71.056 -0.797 1
1 1486 . 2 1 1 A 123 123 THR N N 123 108.963 112.259 -3.296 1
1 1487 . 2 1 1 A 124 124 SER H H 124 7.912 8.759 -0.847 1
1 1488 . 2 1 1 A 124 124 SER HA H 124 4.626 4.622 0.004 1
1 1491 . 2 1 1 A 124 124 SER C C 124 174.405 175.068 -0.663 1
1 1492 . 2 1 1 A 124 124 SER CA C 124 58.390 59.050 -0.660 1
1 1493 . 2 1 1 A 124 124 SER CB C 124 64.255 63.420 0.835 1
1 1494 . 2 1 1 A 124 124 SER N N 124 116.876 118.312 -1.436 1
1 1495 . 2 1 1 A 125 125 GLY H H 125 8.307 8.380 -0.073 1
1 1496 . 2 1 1 A 125 125 GLY HA2 H 125 4.166 4.260 -0.094 1
1 1497 . 2 1 1 A 125 125 GLY HA3 H 125 4.166 4.261 -0.095 1
1 1498 . 2 1 1 A 125 125 GLY C C 125 171.921 174.374 -2.453 1
1 1499 . 2 1 1 A 125 125 GLY CA C 125 44.748 44.469 0.279 1
1 1500 . 2 1 1 A 125 125 GLY N N 125 110.006 112.425 -2.419 1
1 1501 . 2 1 1 A 126 126 PRO HA H 126 4.510 4.367 0.143 1
1 1508 . 2 1 1 A 126 126 PRO C C 126 177.471 177.116 0.355 1
1 1509 . 2 1 1 A 126 126 PRO CA C 126 63.419 64.943 -1.524 1
1 1510 . 2 1 1 A 126 126 PRO CB C 126 32.106 31.913 0.193 1
1 1513 . 2 1 1 A 127 127 SER H H 127 8.607 7.889 0.718 1
1 1514 . 2 1 1 A 127 127 SER C C 127 174.628 174.051 0.577 1
1 1515 . 2 1 1 A 127 127 SER CA C 127 58.513 58.799 -0.286 1
1 1516 . 2 1 1 A 127 127 SER CB C 127 63.679 63.467 0.212 1
1 1517 . 2 1 1 A 127 127 SER N N 127 116.390 112.854 3.536 1
1 1518 . 2 1 1 A 128 128 SER H H 128 8.272 8.655 -0.383 1
1 1519 . 2 1 1 A 128 128 SER HA H 128 4.496 4.944 -0.448 1
1 1520 . 2 1 1 A 128 128 SER C C 128 173.921 174.521 -0.600 1
1 1521 . 2 1 1 A 128 128 SER CA C 128 58.442 56.800 1.642 1
1 1522 . 2 1 1 A 128 128 SER CB C 128 64.173 65.240 -1.067 1
1 1523 . 2 1 1 A 128 128 SER N N 128 117.506 120.300 -2.794 1
1 1 . 3 1 1 A 7 7 GLY HA2 H 7 3.978 4.019 -0.041 1
1 2 . 3 1 1 A 7 7 GLY HA3 H 7 3.978 4.022 -0.044 1
1 3 . 3 1 1 A 7 7 GLY C C 7 174.274 172.352 1.922 1
1 4 . 3 1 1 A 7 7 GLY CA C 7 45.383 44.896 0.487 1
1 5 . 3 1 1 A 8 8 SER H H 8 8.211 8.540 -0.329 1
1 6 . 3 1 1 A 8 8 SER HA H 8 4.425 5.103 -0.678 1
1 9 . 3 1 1 A 8 8 SER C C 8 174.635 173.718 0.917 1
1 10 . 3 1 1 A 8 8 SER CA C 8 58.425 56.889 1.536 1
1 11 . 3 1 1 A 8 8 SER CB C 8 63.885 64.203 -0.318 1
1 12 . 3 1 1 A 8 8 SER N N 8 115.732 115.296 0.436 1
1 13 . 3 1 1 A 9 9 LEU H H 9 8.316 9.070 -0.754 1
1 14 . 3 1 1 A 9 9 LEU HA H 9 4.334 5.012 -0.678 1
1 24 . 3 1 1 A 9 9 LEU C C 9 177.447 175.805 1.642 1
1 25 . 3 1 1 A 9 9 LEU CA C 9 55.407 53.577 1.830 1
1 26 . 3 1 1 A 9 9 LEU CB C 9 42.171 45.923 -3.752 1
1 30 . 3 1 1 A 9 9 LEU N N 9 123.943 128.855 -4.912 1
1 31 . 3 1 1 A 10 10 SER H H 10 8.304 8.739 -0.435 1
1 32 . 3 1 1 A 10 10 SER HA H 10 4.424 4.822 -0.398 1
1 35 . 3 1 1 A 10 10 SER C C 10 175.025 173.163 1.862 1
1 36 . 3 1 1 A 10 10 SER CA C 10 58.425 57.949 0.476 1
1 37 . 3 1 1 A 10 10 SER CB C 10 63.638 62.812 0.826 1
1 38 . 3 1 1 A 10 10 SER N N 10 116.718 121.627 -4.909 1
1 39 . 3 1 1 A 11 11 THR H H 11 8.003 8.757 -0.754 1
1 40 . 3 1 1 A 11 11 THR HA H 11 4.196 4.880 -0.684 1
1 45 . 3 1 1 A 11 11 THR C C 11 176.296 174.038 2.258 1
1 46 . 3 1 1 A 11 11 THR CA C 11 62.483 61.421 1.062 1
1 47 . 3 1 1 A 11 11 THR CB C 11 69.266 71.267 -2.001 1
1 49 . 3 1 1 A 11 11 THR N N 11 114.902 121.737 -6.835 1
1 50 . 3 1 1 A 12 12 VAL H H 12 8.095 8.523 -0.428 1
1 51 . 3 1 1 A 12 12 VAL HA H 12 3.826 4.169 -0.343 1
1 59 . 3 1 1 A 12 12 VAL C C 12 178.501 176.930 1.571 1
1 60 . 3 1 1 A 12 12 VAL CA C 12 64.760 63.663 1.097 1
1 61 . 3 1 1 A 12 12 VAL CB C 12 32.013 33.446 -1.433 1
1 64 . 3 1 1 A 12 12 VAL N N 12 122.111 122.625 -0.514 1
1 65 . 3 1 1 A 13 13 GLU H H 13 8.151 8.715 -0.564 1
1 66 . 3 1 1 A 13 13 GLU HA H 13 3.244 3.311 -0.067 1
1 71 . 3 1 1 A 13 13 GLU C C 13 175.702 178.491 -2.789 1
1 72 . 3 1 1 A 13 13 GLU CA C 13 58.354 59.050 -0.696 1
1 73 . 3 1 1 A 13 13 GLU CB C 13 28.843 28.617 0.226 1
1 75 . 3 1 1 A 13 13 GLU N N 13 120.316 121.966 -1.650 1
1 76 . 3 1 1 A 14 14 LEU H H 14 7.067 7.586 -0.519 1
1 77 . 3 1 1 A 14 14 LEU HA H 14 4.157 4.239 -0.082 1
1 87 . 3 1 1 A 14 14 LEU C C 14 176.863 176.906 -0.043 1
1 88 . 3 1 1 A 14 14 LEU CA C 14 53.324 54.492 -1.168 1
1 89 . 3 1 1 A 14 14 LEU CB C 14 41.636 41.231 0.405 1
1 93 . 3 1 1 A 14 14 LEU N N 14 117.035 119.039 -2.004 1
1 94 . 3 1 1 A 15 15 SER H H 15 7.645 8.022 -0.377 1
1 95 . 3 1 1 A 15 15 SER HA H 15 4.305 4.630 -0.325 1
1 98 . 3 1 1 A 15 15 SER C C 15 175.340 172.884 2.456 1
1 99 . 3 1 1 A 15 15 SER CA C 15 59.783 57.372 2.411 1
1 100 . 3 1 1 A 15 15 SER CB C 15 64.625 61.965 2.660 1
1 101 . 3 1 1 A 15 15 SER N N 15 114.216 115.853 -1.637 1
1 102 . 3 1 1 A 16 16 GLY H H 16 8.506 8.233 0.273 1
1 103 . 3 1 1 A 16 16 GLY HA2 H 16 4.237 4.298 -0.061 1
1 104 . 3 1 1 A 16 16 GLY HA3 H 16 3.927 4.319 -0.392 1
1 105 . 3 1 1 A 16 16 GLY C C 16 173.661 172.221 1.440 1
1 106 . 3 1 1 A 16 16 GLY CA C 16 44.995 43.938 1.057 1
1 107 . 3 1 1 A 16 16 GLY N N 16 111.838 111.851 -0.013 1
1 108 . 3 1 1 A 17 17 THR H H 17 8.482 8.896 -0.414 1
1 109 . 3 1 1 A 17 17 THR HA H 17 4.319 4.359 -0.040 1
1 114 . 3 1 1 A 17 17 THR C C 17 174.758 174.545 0.213 1
1 115 . 3 1 1 A 17 17 THR CA C 17 62.272 63.602 -1.330 1
1 116 . 3 1 1 A 17 17 THR CB C 17 70.706 68.829 1.877 1
1 118 . 3 1 1 A 17 17 THR N N 17 116.679 115.439 1.240 1
1 119 . 3 1 1 A 18 18 VAL H H 18 8.948 8.778 0.170 1
1 120 . 3 1 1 A 18 18 VAL HA H 18 3.950 4.331 -0.381 1
1 128 . 3 1 1 A 18 18 VAL C C 18 176.669 177.042 -0.373 1
1 129 . 3 1 1 A 18 18 VAL CA C 18 64.813 63.807 1.006 1
1 130 . 3 1 1 A 18 18 VAL CB C 18 31.807 31.678 0.129 1
1 133 . 3 1 1 A 18 18 VAL N N 18 127.156 127.917 -0.761 1
1 134 . 3 1 1 A 19 19 VAL H H 19 9.359 8.838 0.521 1
1 135 . 3 1 1 A 19 19 VAL HA H 19 4.234 4.399 -0.165 1
1 143 . 3 1 1 A 19 19 VAL C C 19 175.738 175.806 -0.068 1
1 144 . 3 1 1 A 19 19 VAL CA C 19 62.060 62.057 0.003 1
1 145 . 3 1 1 A 19 19 VAL CB C 19 33.822 33.429 0.393 1
1 148 . 3 1 1 A 19 19 VAL N N 19 125.162 122.206 2.956 1
1 149 . 3 1 1 A 20 20 LYS H H 20 7.584 7.148 0.436 1
1 150 . 3 1 1 A 20 20 LYS HA H 20 4.346 4.568 -0.222 1
1 159 . 3 1 1 A 20 20 LYS C C 20 172.818 174.021 -1.203 1
1 160 . 3 1 1 A 20 20 LYS CA C 20 56.801 55.403 1.398 1
1 161 . 3 1 1 A 20 20 LYS CB C 20 36.624 35.635 0.989 1
1 165 . 3 1 1 A 20 20 LYS N N 20 121.024 121.007 0.017 1
1 166 . 3 1 1 A 21 21 GLN H H 21 8.625 8.456 0.169 1
1 167 . 3 1 1 A 21 21 GLN HA H 21 6.003 5.325 0.678 1
1 174 . 3 1 1 A 21 21 GLN C C 21 174.914 174.763 0.151 1
1 175 . 3 1 1 A 21 21 GLN CA C 21 54.207 54.682 -0.475 1
1 176 . 3 1 1 A 21 21 GLN CB C 21 33.452 32.947 0.505 1
1 178 . 3 1 1 A 21 21 GLN N N 21 122.108 124.002 -1.894 1
1 180 . 3 1 1 A 22 22 GLY H H 22 8.964 8.300 0.664 1
1 181 . 3 1 1 A 22 22 GLY HA2 H 22 4.665 4.351 0.314 1
1 182 . 3 1 1 A 22 22 GLY HA3 H 22 4.295 4.543 -0.248 1
1 183 . 3 1 1 A 22 22 GLY C C 22 170.879 171.921 -1.042 1
1 184 . 3 1 1 A 22 22 GLY CA C 22 45.683 45.098 0.585 1
1 185 . 3 1 1 A 22 22 GLY N N 22 108.508 108.785 -0.277 1
1 186 . 3 1 1 A 23 23 TYR H H 23 9.145 8.770 0.375 1
1 187 . 3 1 1 A 23 23 TYR HA H 23 5.595 5.508 0.087 1
1 194 . 3 1 1 A 23 23 TYR C C 23 175.824 175.313 0.511 1
1 195 . 3 1 1 A 23 23 TYR CA C 23 58.019 56.553 1.466 1
1 196 . 3 1 1 A 23 23 TYR CB C 23 39.251 41.030 -1.779 1
1 201 . 3 1 1 A 23 23 TYR N N 23 120.809 120.075 0.734 1
1 202 . 3 1 1 A 24 24 LEU H H 24 8.935 9.969 -1.034 1
1 203 . 3 1 1 A 24 24 LEU HA H 24 4.716 5.218 -0.502 1
1 213 . 3 1 1 A 24 24 LEU C C 24 174.648 175.917 -1.269 1
1 214 . 3 1 1 A 24 24 LEU CA C 24 53.907 53.381 0.526 1
1 215 . 3 1 1 A 24 24 LEU CB C 24 46.078 45.922 0.156 1
1 219 . 3 1 1 A 24 24 LEU N N 24 122.887 124.301 -1.414 1
1 220 . 3 1 1 A 25 25 ALA H H 25 8.145 8.704 -0.559 1
1 221 . 3 1 1 A 25 25 ALA HA H 25 5.477 5.346 0.131 1
1 225 . 3 1 1 A 25 25 ALA C C 25 175.751 175.734 0.017 1
1 226 . 3 1 1 A 25 25 ALA CA C 25 50.719 50.580 0.139 1
1 227 . 3 1 1 A 25 25 ALA CB C 25 21.074 20.371 0.703 1
1 228 . 3 1 1 A 25 25 ALA N N 25 122.280 123.564 -1.284 1
1 229 . 3 1 1 A 26 26 LYS H H 26 9.167 8.444 0.723 1
1 230 . 3 1 1 A 26 26 LYS HA H 26 5.221 4.457 0.764 1
1 239 . 3 1 1 A 26 26 LYS C C 26 175.421 175.029 0.392 1
1 240 . 3 1 1 A 26 26 LYS CA C 26 54.383 55.346 -0.963 1
1 241 . 3 1 1 A 26 26 LYS CB C 26 36.125 33.572 2.553 1
1 245 . 3 1 1 A 26 26 LYS N N 26 120.638 125.941 -5.303 1
1 246 . 3 1 1 A 27 27 GLN H H 27 7.866 7.748 0.118 1
1 247 . 3 1 1 A 27 27 GLN HA H 27 3.525 4.748 -1.223 1
1 254 . 3 1 1 A 27 27 GLN C C 27 177.022 174.746 2.276 1
1 255 . 3 1 1 A 27 27 GLN CA C 27 55.778 53.577 2.201 1
1 256 . 3 1 1 A 27 27 GLN CB C 27 29.864 30.911 -1.047 1
1 258 . 3 1 1 A 27 27 GLN N N 27 130.194 125.653 4.541 1
1 260 . 3 1 1 A 28 28 GLY H H 28 8.565 8.261 0.304 1
1 261 . 3 1 1 A 28 28 GLY HA2 H 28 4.125 4.159 -0.034 1
1 262 . 3 1 1 A 28 28 GLY HA3 H 28 4.034 4.215 -0.181 1
1 263 . 3 1 1 A 28 28 GLY C C 28 174.030 171.261 2.769 1
1 264 . 3 1 1 A 28 28 GLY CA C 28 45.665 46.286 -0.621 1
1 265 . 3 1 1 A 28 28 GLY N N 28 115.528 111.854 3.674 1
1 266 . 3 1 1 A 29 29 HIS HA H 29 4.355 5.116 -0.761 1
1 271 . 3 1 1 A 29 29 HIS CA C 29 58.795 54.902 3.893 1
1 272 . 3 1 1 A 29 29 HIS CB C 29 31.283 33.177 -1.894 1
1 275 . 3 1 1 A 30 30 LYS HA H 30 4.096 4.547 -0.451 1
1 284 . 3 1 1 A 30 30 LYS CA C 30 57.290 57.708 -0.418 1
1 285 . 3 1 1 A 30 30 LYS CB C 30 31.951 35.045 -3.094 1
1 289 . 3 1 1 A 31 31 ARG HA H 31 3.975 4.556 -0.581 1
1 296 . 3 1 1 A 31 31 ARG CA C 31 55.973 57.485 -1.512 1
1 297 . 3 1 1 A 31 31 ARG CB C 31 29.902 32.716 -2.814 1
1 300 . 3 1 1 A 32 32 LYS HA H 32 4.160 4.517 -0.357 1
1 309 . 3 1 1 A 32 32 LYS C C 32 175.678 176.917 -1.239 1
1 310 . 3 1 1 A 32 32 LYS CA C 32 56.254 55.450 0.804 1
1 311 . 3 1 1 A 32 32 LYS CB C 32 31.602 34.078 -2.476 1
1 315 . 3 1 1 A 33 33 ASN H H 33 7.925 8.569 -0.644 1
1 316 . 3 1 1 A 33 33 ASN HA H 33 4.799 4.365 0.434 1
1 321 . 3 1 1 A 33 33 ASN C C 33 174.005 176.107 -2.102 1
1 322 . 3 1 1 A 33 33 ASN CA C 33 52.407 56.933 -4.526 1
1 323 . 3 1 1 A 33 33 ASN CB C 33 39.879 38.664 1.215 1
1 324 . 3 1 1 A 33 33 ASN N N 33 116.990 122.644 -5.654 1
1 326 . 3 1 1 A 34 34 TRP H H 34 8.798 7.789 1.009 1
1 327 . 3 1 1 A 34 34 TRP HA H 34 4.755 5.429 -0.674 1
1 336 . 3 1 1 A 34 34 TRP C C 34 176.090 175.408 0.682 1
1 337 . 3 1 1 A 34 34 TRP CA C 34 57.119 56.080 1.039 1
1 338 . 3 1 1 A 34 34 TRP CB C 34 30.596 33.283 -2.687 1
1 344 . 3 1 1 A 34 34 TRP N N 34 121.917 115.365 6.552 1
1 346 . 3 1 1 A 35 35 LYS H H 35 8.404 8.358 0.046 1
1 347 . 3 1 1 A 35 35 LYS HA H 35 4.846 4.991 -0.145 1
1 354 . 3 1 1 A 35 35 LYS C C 35 176.088 175.688 0.400 1
1 355 . 3 1 1 A 35 35 LYS CA C 35 54.418 55.020 -0.602 1
1 356 . 3 1 1 A 35 35 LYS CB C 35 36.125 35.910 0.215 1
1 360 . 3 1 1 A 35 35 LYS N N 35 120.864 121.912 -1.048 1
1 361 . 3 1 1 A 36 36 VAL H H 36 8.977 8.764 0.213 1
1 362 . 3 1 1 A 36 36 VAL HA H 36 4.274 4.567 -0.293 1
1 370 . 3 1 1 A 36 36 VAL C C 36 176.733 175.821 0.912 1
1 371 . 3 1 1 A 36 36 VAL CA C 36 64.319 63.270 1.049 1
1 372 . 3 1 1 A 36 36 VAL CB C 36 31.602 32.210 -0.608 1
1 375 . 3 1 1 A 36 36 VAL N N 36 124.314 124.092 0.222 1
1 376 . 3 1 1 A 37 37 ARG H H 37 9.498 10.229 -0.731 1
1 377 . 3 1 1 A 37 37 ARG HA H 37 5.053 5.037 0.016 1
1 384 . 3 1 1 A 37 37 ARG C C 37 174.442 174.832 -0.390 1
1 385 . 3 1 1 A 37 37 ARG CA C 37 53.272 54.343 -1.071 1
1 386 . 3 1 1 A 37 37 ARG CB C 37 34.563 34.309 0.254 1
1 389 . 3 1 1 A 37 37 ARG N N 37 128.121 126.381 1.740 1
1 390 . 3 1 1 A 38 38 ARG H H 38 8.755 9.020 -0.265 1
1 391 . 3 1 1 A 38 38 ARG HA H 38 4.626 4.513 0.113 1
1 398 . 3 1 1 A 38 38 ARG C C 38 175.514 175.402 0.112 1
1 399 . 3 1 1 A 38 38 ARG CA C 38 55.601 56.115 -0.514 1
1 400 . 3 1 1 A 38 38 ARG CB C 38 32.219 30.639 1.580 1
1 403 . 3 1 1 A 38 38 ARG N N 38 121.442 123.912 -2.470 1
1 404 . 3 1 1 A 39 39 PHE H H 39 9.865 9.004 0.861 1
1 405 . 3 1 1 A 39 39 PHE HA H 39 5.424 5.112 0.312 1
1 413 . 3 1 1 A 39 39 PHE C C 39 175.423 174.692 0.731 1
1 414 . 3 1 1 A 39 39 PHE CA C 39 57.419 57.247 0.172 1
1 415 . 3 1 1 A 39 39 PHE CB C 39 42.623 41.317 1.306 1
1 421 . 3 1 1 A 39 39 PHE N N 39 130.027 126.421 3.606 1
1 422 . 3 1 1 A 40 40 VAL H H 40 9.300 10.233 -0.933 1
1 423 . 3 1 1 A 40 40 VAL HA H 40 4.846 5.267 -0.421 1
1 431 . 3 1 1 A 40 40 VAL C C 40 174.477 173.180 1.297 1
1 432 . 3 1 1 A 40 40 VAL CA C 40 62.343 60.472 1.871 1
1 433 . 3 1 1 A 40 40 VAL CB C 40 35.755 35.794 -0.039 1
1 436 . 3 1 1 A 40 40 VAL N N 40 119.369 120.158 -0.789 1
1 437 . 3 1 1 A 41 41 LEU H H 41 9.557 10.001 -0.444 1
1 438 . 3 1 1 A 41 41 LEU HA H 41 5.292 5.547 -0.255 1
1 448 . 3 1 1 A 41 41 LEU C C 41 174.632 175.584 -0.952 1
1 449 . 3 1 1 A 41 41 LEU CA C 41 53.571 53.602 -0.031 1
1 450 . 3 1 1 A 41 41 LEU CB C 41 45.337 45.412 -0.075 1
1 454 . 3 1 1 A 41 41 LEU N N 41 132.121 129.388 2.733 1
1 455 . 3 1 1 A 42 42 ARG H H 42 9.396 8.835 0.561 1
1 456 . 3 1 1 A 42 42 ARG HA H 42 5.366 5.163 0.203 1
1 464 . 3 1 1 A 42 42 ARG C C 42 173.997 174.748 -0.751 1
1 465 . 3 1 1 A 42 42 ARG CA C 42 54.631 54.235 0.396 1
1 466 . 3 1 1 A 42 42 ARG CB C 42 35.550 35.033 0.517 1
1 469 . 3 1 1 A 42 42 ARG N N 42 128.120 123.195 4.925 1
1 471 . 3 1 1 A 43 43 LYS H H 43 8.597 8.527 0.070 1
1 472 . 3 1 1 A 43 43 LYS HA H 43 4.558 4.980 -0.422 1
1 481 . 3 1 1 A 43 43 LYS C C 43 174.648 175.333 -0.685 1
1 482 . 3 1 1 A 43 43 LYS CA C 43 53.378 54.654 -1.276 1
1 483 . 3 1 1 A 43 43 LYS CB C 43 37.303 35.835 1.468 1
1 487 . 3 1 1 A 43 43 LYS N N 43 114.484 119.185 -4.701 1
1 488 . 3 1 1 A 44 44 ASP H H 44 8.388 9.010 -0.622 1
1 489 . 3 1 1 A 44 44 ASP HA H 44 4.349 4.292 0.057 1
1 492 . 3 1 1 A 44 44 ASP C C 44 173.376 174.214 -0.838 1
1 493 . 3 1 1 A 44 44 ASP CA C 44 54.842 54.976 -0.134 1
1 494 . 3 1 1 A 44 44 ASP CB C 44 39.991 39.668 0.323 1
1 495 . 3 1 1 A 44 44 ASP N N 44 115.453 119.442 -3.989 1
1 496 . 3 1 1 A 45 45 PRO HA H 45 4.652 4.628 0.024 1
1 503 . 3 1 1 A 45 45 PRO C C 45 176.914 175.624 1.290 1
1 504 . 3 1 1 A 45 45 PRO CA C 45 63.490 62.667 0.823 1
1 505 . 3 1 1 A 45 45 PRO CB C 45 34.892 32.835 2.057 1
1 508 . 3 1 1 A 46 46 ALA H H 46 8.112 8.500 -0.388 1
1 509 . 3 1 1 A 46 46 ALA HA H 46 5.455 4.733 0.722 1
1 513 . 3 1 1 A 46 46 ALA C C 46 177.234 176.477 0.757 1
1 514 . 3 1 1 A 46 46 ALA CA C 46 51.560 50.992 0.568 1
1 515 . 3 1 1 A 46 46 ALA CB C 46 20.122 19.715 0.407 1
1 516 . 3 1 1 A 46 46 ALA N N 46 120.155 123.295 -3.140 1
1 517 . 3 1 1 A 47 47 PHE H H 47 8.717 8.751 -0.034 1
1 518 . 3 1 1 A 47 47 PHE HA H 47 4.795 5.170 -0.375 1
1 526 . 3 1 1 A 47 47 PHE C C 47 172.588 174.358 -1.770 1
1 527 . 3 1 1 A 47 47 PHE CA C 47 57.348 56.169 1.179 1
1 528 . 3 1 1 A 47 47 PHE CB C 47 47.123 44.046 3.077 1
1 534 . 3 1 1 A 47 47 PHE N N 47 129.946 121.260 8.686 1
1 535 . 3 1 1 A 48 48 LEU H H 48 7.883 8.011 -0.128 1
1 536 . 3 1 1 A 48 48 LEU HA H 48 5.198 5.005 0.193 1
1 546 . 3 1 1 A 48 48 LEU C C 48 173.569 174.383 -0.814 1
1 547 . 3 1 1 A 48 48 LEU CA C 48 53.290 54.674 -1.384 1
1 548 . 3 1 1 A 48 48 LEU CB C 48 45.502 45.337 0.165 1
1 552 . 3 1 1 A 48 48 LEU N N 48 121.108 121.164 -0.056 1
1 553 . 3 1 1 A 49 49 HIS H H 49 8.606 9.059 -0.453 1
1 554 . 3 1 1 A 49 49 HIS HA H 49 5.035 5.064 -0.029 1
1 559 . 3 1 1 A 49 49 HIS C C 49 173.993 173.896 0.097 1
1 560 . 3 1 1 A 49 49 HIS CA C 49 56.483 53.928 2.555 1
1 561 . 3 1 1 A 49 49 HIS CB C 49 35.919 33.658 2.261 1
1 564 . 3 1 1 A 49 49 HIS N N 49 121.199 124.996 -3.797 1
1 565 . 3 1 1 A 50 50 TYR H H 50 7.777 8.233 -0.456 1
1 566 . 3 1 1 A 50 50 TYR HA H 50 5.695 5.417 0.278 1
1 573 . 3 1 1 A 50 50 TYR C C 50 174.284 171.980 2.304 1
1 574 . 3 1 1 A 50 50 TYR CA C 50 53.430 55.579 -2.149 1
1 575 . 3 1 1 A 50 50 TYR CB C 50 38.552 40.333 -1.781 1
1 580 . 3 1 1 A 50 50 TYR N N 50 114.156 117.275 -3.119 1
1 581 . 3 1 1 A 51 51 TYR H H 51 9.323 10.261 -0.938 1
1 582 . 3 1 1 A 51 51 TYR HA H 51 4.600 5.070 -0.470 1
1 589 . 3 1 1 A 51 51 TYR C C 51 175.352 174.465 0.887 1
1 590 . 3 1 1 A 51 51 TYR CA C 51 57.330 56.090 1.240 1
1 591 . 3 1 1 A 51 51 TYR CB C 51 41.683 42.210 -0.527 1
1 596 . 3 1 1 A 51 51 TYR N N 51 119.100 119.841 -0.741 1
1 597 . 3 1 1 A 52 52 ASP H H 52 9.375 8.726 0.649 1
1 598 . 3 1 1 A 52 52 ASP HA H 52 5.064 5.075 -0.011 1
1 601 . 3 1 1 A 52 52 ASP C C 52 175.484 175.636 -0.152 1
1 602 . 3 1 1 A 52 52 ASP CA C 52 51.313 51.061 0.252 1
1 603 . 3 1 1 A 52 52 ASP CB C 52 41.883 42.470 -0.587 1
1 604 . 3 1 1 A 52 52 ASP N N 52 124.636 123.596 1.040 1
1 605 . 3 1 1 A 53 53 PRO HA H 53 4.678 4.724 -0.046 1
1 612 . 3 1 1 A 53 53 PRO C C 53 176.781 176.215 0.566 1
1 613 . 3 1 1 A 53 53 PRO CA C 53 64.054 64.045 0.009 1
1 614 . 3 1 1 A 53 53 PRO CB C 53 32.589 31.897 0.692 1
1 617 . 3 1 1 A 54 54 SER H H 54 8.685 8.671 0.014 1
1 618 . 3 1 1 A 54 54 SER HA H 54 4.483 4.726 -0.243 1
1 621 . 3 1 1 A 54 54 SER C C 54 174.006 173.826 0.180 1
1 622 . 3 1 1 A 54 54 SER CA C 54 59.378 57.764 1.614 1
1 623 . 3 1 1 A 54 54 SER CB C 54 64.132 64.062 0.070 1
1 624 . 3 1 1 A 54 54 SER N N 54 113.769 112.683 1.086 1
1 625 . 3 1 1 A 55 55 LYS H H 55 7.706 7.407 0.299 1
1 626 . 3 1 1 A 55 55 LYS HA H 55 4.580 5.011 -0.431 1
1 635 . 3 1 1 A 55 55 LYS C C 55 175.969 174.904 1.065 1
1 636 . 3 1 1 A 55 55 LYS CA C 55 55.160 53.978 1.182 1
1 637 . 3 1 1 A 55 55 LYS CB C 55 34.069 36.388 -2.319 1
1 641 . 3 1 1 A 55 55 LYS N N 55 122.222 117.976 4.246 1
1 642 . 3 1 1 A 56 56 GLU H H 56 8.666 8.733 -0.067 1
1 643 . 3 1 1 A 56 56 GLU HA H 56 4.174 5.033 -0.859 1
1 648 . 3 1 1 A 56 56 GLU C C 56 177.084 174.636 2.448 1
1 649 . 3 1 1 A 56 56 GLU CA C 56 57.099 55.540 1.559 1
1 650 . 3 1 1 A 56 56 GLU CB C 56 29.694 30.875 -1.181 1
1 652 . 3 1 1 A 56 56 GLU N N 56 122.015 118.906 3.109 1
1 653 . 3 1 1 A 57 57 GLU H H 57 8.303 8.572 -0.269 1
1 654 . 3 1 1 A 57 57 GLU HA H 57 4.214 4.703 -0.489 1
1 659 . 3 1 1 A 57 57 GLU CA C 57 56.960 55.593 1.367 1
1 660 . 3 1 1 A 57 57 GLU CB C 57 30.264 34.042 -3.778 1
1 662 . 3 1 1 A 57 57 GLU N N 57 119.884 124.550 -4.666 1
1 663 . 3 1 1 A 58 58 ASN HA H 58 4.768 4.844 -0.076 1
1 668 . 3 1 1 A 58 58 ASN C C 58 174.902 173.857 1.045 1
1 669 . 3 1 1 A 58 58 ASN CA C 58 52.740 53.062 -0.322 1
1 670 . 3 1 1 A 58 58 ASN CB C 58 38.116 36.815 1.301 1
1 672 . 3 1 1 A 59 59 ARG H H 59 7.805 7.710 0.095 1
1 673 . 3 1 1 A 59 59 ARG HA H 59 4.762 4.736 0.026 1
1 680 . 3 1 1 A 59 59 ARG CA C 59 53.151 53.480 -0.329 1
1 681 . 3 1 1 A 59 59 ARG CB C 59 31.519 34.221 -2.702 1
1 684 . 3 1 1 A 59 59 ARG N N 59 121.060 120.683 0.377 1
1 685 . 3 1 1 A 60 60 PRO HA H 60 3.357 4.013 -0.656 1
1 692 . 3 1 1 A 60 60 PRO C C 60 176.817 176.405 0.412 1
1 693 . 3 1 1 A 60 60 PRO CA C 60 63.031 61.880 1.151 1
1 694 . 3 1 1 A 60 60 PRO CB C 60 31.273 32.010 -0.737 1
1 697 . 3 1 1 A 61 61 VAL H H 61 8.627 8.169 0.458 1
1 698 . 3 1 1 A 61 61 VAL HA H 61 3.966 3.807 0.159 1
1 706 . 3 1 1 A 61 61 VAL C C 61 176.503 176.337 0.166 1
1 707 . 3 1 1 A 61 61 VAL CA C 61 63.154 64.546 -1.392 1
1 708 . 3 1 1 A 61 61 VAL CB C 61 32.048 32.187 -0.139 1
1 711 . 3 1 1 A 61 61 VAL N N 61 119.185 120.041 -0.856 1
1 712 . 3 1 1 A 62 62 GLY H H 62 6.715 6.148 0.567 1
1 713 . 3 1 1 A 62 62 GLY HA2 H 62 3.940 3.741 0.199 1
1 714 . 3 1 1 A 62 62 GLY HA3 H 62 3.538 3.856 -0.318 1
1 715 . 3 1 1 A 62 62 GLY C C 62 169.983 172.220 -2.237 1
1 716 . 3 1 1 A 62 62 GLY CA C 62 44.465 45.228 -0.763 1
1 717 . 3 1 1 A 62 62 GLY N N 62 105.813 105.651 0.162 1
1 718 . 3 1 1 A 63 63 GLY H H 63 8.004 8.462 -0.458 1
1 719 . 3 1 1 A 63 63 GLY HA2 H 63 4.095 3.260 0.835 1
1 720 . 3 1 1 A 63 63 GLY HA3 H 63 3.813 3.731 0.082 1
1 721 . 3 1 1 A 63 63 GLY C C 63 171.870 172.440 -0.570 1
1 722 . 3 1 1 A 63 63 GLY CA C 63 47.148 44.185 2.963 1
1 723 . 3 1 1 A 63 63 GLY N N 63 105.089 107.653 -2.564 1
1 724 . 3 1 1 A 64 64 PHE H H 64 7.967 7.447 0.520 1
1 725 . 3 1 1 A 64 64 PHE HA H 64 4.934 5.601 -0.667 1
1 733 . 3 1 1 A 64 64 PHE C C 64 173.140 173.995 -0.855 1
1 734 . 3 1 1 A 64 64 PHE CA C 64 55.248 55.095 0.153 1
1 735 . 3 1 1 A 64 64 PHE CB C 64 40.238 42.410 -2.172 1
1 741 . 3 1 1 A 64 64 PHE N N 64 113.387 121.672 -8.285 1
1 742 . 3 1 1 A 65 65 SER H H 65 8.518 8.918 -0.400 1
1 743 . 3 1 1 A 65 65 SER HA H 65 3.264 3.643 -0.379 1
1 746 . 3 1 1 A 65 65 SER C C 65 176.417 174.943 1.474 1
1 747 . 3 1 1 A 65 65 SER CA C 65 56.819 57.290 -0.471 1
1 748 . 3 1 1 A 65 65 SER CB C 65 63.391 62.928 0.463 1
1 749 . 3 1 1 A 65 65 SER N N 65 114.674 115.567 -0.893 1
1 750 . 3 1 1 A 66 66 LEU H H 66 7.404 8.152 -0.748 1
1 751 . 3 1 1 A 66 66 LEU HA H 66 4.470 4.119 0.351 1
1 761 . 3 1 1 A 66 66 LEU C C 66 177.993 177.585 0.408 1
1 762 . 3 1 1 A 66 66 LEU CA C 66 54.242 57.474 -3.232 1
1 763 . 3 1 1 A 66 66 LEU CB C 66 42.787 41.605 1.182 1
1 767 . 3 1 1 A 66 66 LEU N N 66 123.988 125.677 -1.689 1
1 768 . 3 1 1 A 67 67 ARG H H 67 7.865 7.394 0.471 1
1 769 . 3 1 1 A 67 67 ARG HA H 67 4.175 4.074 0.101 1
1 776 . 3 1 1 A 67 67 ARG C C 67 178.562 177.124 1.438 1
1 777 . 3 1 1 A 67 67 ARG CA C 67 58.143 58.120 0.023 1
1 778 . 3 1 1 A 67 67 ARG CB C 67 29.052 30.054 -1.002 1
1 781 . 3 1 1 A 67 67 ARG N N 67 122.494 119.216 3.278 1
1 782 . 3 1 1 A 68 68 GLY H H 68 9.398 8.805 0.593 1
1 783 . 3 1 1 A 68 68 GLY HA2 H 68 4.066 3.988 0.078 1
1 784 . 3 1 1 A 68 68 GLY HA3 H 68 3.908 3.991 -0.083 1
1 785 . 3 1 1 A 68 68 GLY C C 68 173.982 174.099 -0.117 1
1 786 . 3 1 1 A 68 68 GLY CA C 68 46.230 45.833 0.397 1
1 787 . 3 1 1 A 68 68 GLY N N 68 117.548 113.487 4.061 1
1 788 . 3 1 1 A 69 69 SER H H 69 7.829 7.952 -0.123 1
1 789 . 3 1 1 A 69 69 SER HA H 69 4.807 5.008 -0.201 1
1 792 . 3 1 1 A 69 69 SER C C 69 172.854 172.876 -0.022 1
1 793 . 3 1 1 A 69 69 SER CA C 69 59.290 56.320 2.970 1
1 794 . 3 1 1 A 69 69 SER CB C 69 65.366 66.050 -0.684 1
1 795 . 3 1 1 A 69 69 SER N N 69 115.188 113.136 2.052 1
1 796 . 3 1 1 A 70 70 LEU H H 70 8.805 8.544 0.261 1
1 797 . 3 1 1 A 70 70 LEU HA H 70 4.846 4.868 -0.022 1
1 807 . 3 1 1 A 70 70 LEU C C 70 175.775 174.141 1.634 1
1 808 . 3 1 1 A 70 70 LEU CA C 70 53.907 54.041 -0.134 1
1 809 . 3 1 1 A 70 70 LEU CB C 70 45.337 46.381 -1.044 1
1 813 . 3 1 1 A 70 70 LEU N N 70 121.265 122.691 -1.426 1
1 814 . 3 1 1 A 71 71 VAL H H 71 8.644 8.834 -0.190 1
1 815 . 3 1 1 A 71 71 VAL HA H 71 5.555 5.217 0.338 1
1 823 . 3 1 1 A 71 71 VAL C C 71 173.636 173.301 0.335 1
1 824 . 3 1 1 A 71 71 VAL CA C 71 58.760 59.855 -1.095 1
1 825 . 3 1 1 A 71 71 VAL CB C 71 34.891 35.864 -0.973 1
1 828 . 3 1 1 A 71 71 VAL N N 71 122.315 122.771 -0.456 1
1 829 . 3 1 1 A 72 72 SER H H 72 8.750 9.165 -0.415 1
1 830 . 3 1 1 A 72 72 SER HA H 72 4.742 4.982 -0.240 1
1 833 . 3 1 1 A 72 72 SER C C 72 173.058 172.627 0.431 1
1 834 . 3 1 1 A 72 72 SER CA C 72 57.190 57.600 -0.410 1
1 835 . 3 1 1 A 72 72 SER CB C 72 65.612 67.308 -1.696 1
1 836 . 3 1 1 A 72 72 SER N N 72 118.611 123.327 -4.716 1
1 837 . 3 1 1 A 73 73 ALA H H 73 9.009 8.496 0.513 1
1 838 . 3 1 1 A 73 73 ALA HA H 73 4.406 5.035 -0.629 1
1 842 . 3 1 1 A 73 73 ALA C C 73 176.708 177.333 -0.625 1
1 843 . 3 1 1 A 73 73 ALA CA C 73 52.672 51.002 1.670 1
1 844 . 3 1 1 A 73 73 ALA CB C 73 18.812 20.681 -1.869 1
1 845 . 3 1 1 A 73 73 ALA N N 73 125.694 126.107 -0.413 1
1 846 . 3 1 1 A 74 74 LEU H H 74 7.800 8.367 -0.567 1
1 847 . 3 1 1 A 74 74 LEU HA H 74 4.716 4.627 0.089 1
1 857 . 3 1 1 A 74 74 LEU C C 74 176.551 177.191 -0.640 1
1 858 . 3 1 1 A 74 74 LEU CA C 74 53.784 53.900 -0.116 1
1 859 . 3 1 1 A 74 74 LEU CB C 74 43.446 42.811 0.635 1
1 863 . 3 1 1 A 74 74 LEU N N 74 122.271 121.546 0.725 1
1 864 . 3 1 1 A 75 75 GLU H H 75 8.855 8.777 0.078 1
1 865 . 3 1 1 A 75 75 GLU HA H 75 4.336 4.433 -0.097 1
1 870 . 3 1 1 A 75 75 GLU C C 75 176.465 177.825 -1.360 1
1 871 . 3 1 1 A 75 75 GLU CA C 75 56.507 56.111 0.396 1
1 872 . 3 1 1 A 75 75 GLU CB C 75 30.245 30.792 -0.547 1
1 874 . 3 1 1 A 75 75 GLU N N 75 122.678 120.572 2.106 1
1 875 . 3 1 1 A 76 76 ASP H H 76 8.542 8.760 -0.218 1
1 876 . 3 1 1 A 76 76 ASP HA H 76 4.665 4.506 0.159 1
1 879 . 3 1 1 A 76 76 ASP C C 76 176.087 175.891 0.196 1
1 880 . 3 1 1 A 76 76 ASP CA C 76 55.107 56.593 -1.486 1
1 881 . 3 1 1 A 76 76 ASP CB C 76 41.431 41.876 -0.445 1
1 882 . 3 1 1 A 76 76 ASP N N 76 121.488 121.477 0.011 1
1 883 . 3 1 1 A 77 77 ASN H H 77 8.322 7.988 0.334 1
1 884 . 3 1 1 A 77 77 ASN HA H 77 4.729 4.971 -0.242 1
1 889 . 3 1 1 A 77 77 ASN C C 77 175.566 174.702 0.864 1
1 890 . 3 1 1 A 77 77 ASN CA C 77 53.131 51.968 1.163 1
1 891 . 3 1 1 A 77 77 ASN CB C 77 38.617 41.099 -2.482 1
1 892 . 3 1 1 A 77 77 ASN N N 77 118.676 115.966 2.710 1
1 894 . 3 1 1 A 78 78 GLY H H 78 8.311 8.437 -0.126 1
1 895 . 3 1 1 A 78 78 GLY HA2 H 78 3.897 4.183 -0.286 1
1 896 . 3 1 1 A 78 78 GLY HA3 H 78 3.897 4.187 -0.290 1
1 897 . 3 1 1 A 78 78 GLY C C 78 173.376 173.809 -0.433 1
1 898 . 3 1 1 A 78 78 GLY CA C 78 45.224 44.611 0.613 1
1 899 . 3 1 1 A 78 78 GLY N N 78 108.939 108.355 0.584 1
1 900 . 3 1 1 A 79 79 VAL H H 79 7.882 8.591 -0.709 1
1 901 . 3 1 1 A 79 79 VAL HA H 79 4.345 4.139 0.206 1
1 909 . 3 1 1 A 79 79 VAL CA C 79 59.995 60.991 -0.996 1
1 910 . 3 1 1 A 79 79 VAL CB C 79 32.589 32.458 0.131 1
1 913 . 3 1 1 A 79 79 VAL N N 79 121.135 123.054 -1.919 1
1 914 . 3 1 1 A 80 80 PRO HA H 80 4.461 4.666 -0.205 1
1 921 . 3 1 1 A 80 80 PRO C C 80 176.979 176.253 0.726 1
1 922 . 3 1 1 A 80 80 PRO CA C 80 63.101 62.371 0.730 1
1 923 . 3 1 1 A 80 80 PRO CB C 80 32.177 32.701 -0.524 1
1 926 . 3 1 1 A 81 81 THR H H 81 8.281 8.119 0.162 1
1 927 . 3 1 1 A 81 81 THR HA H 81 4.095 3.900 0.195 1
1 932 . 3 1 1 A 81 81 THR C C 81 175.270 175.588 -0.318 1
1 933 . 3 1 1 A 81 81 THR CA C 81 62.872 64.516 -1.644 1
1 934 . 3 1 1 A 81 81 THR CB C 81 69.642 68.600 1.042 1
1 936 . 3 1 1 A 81 81 THR N N 81 114.684 116.625 -1.941 1
1 937 . 3 1 1 A 82 82 GLY H H 82 8.338 9.005 -0.667 1
1 938 . 3 1 1 A 82 82 GLY HA2 H 82 4.095 3.774 0.321 1
1 939 . 3 1 1 A 82 82 GLY HA3 H 82 3.668 3.807 -0.139 1
1 940 . 3 1 1 A 82 82 GLY C C 82 174.139 173.976 0.163 1
1 941 . 3 1 1 A 82 82 GLY CA C 82 45.083 46.983 -1.900 1
1 942 . 3 1 1 A 82 82 GLY N N 82 111.289 114.505 -3.216 1
1 943 . 3 1 1 A 83 83 VAL H H 83 7.668 7.745 -0.077 1
1 944 . 3 1 1 A 83 83 VAL HA H 83 3.985 4.324 -0.339 1
1 952 . 3 1 1 A 83 83 VAL C C 83 176.054 174.720 1.334 1
1 953 . 3 1 1 A 83 83 VAL CA C 83 62.431 61.307 1.124 1
1 954 . 3 1 1 A 83 83 VAL CB C 83 32.260 34.609 -2.349 1
1 957 . 3 1 1 A 83 83 VAL N N 83 120.003 120.040 -0.037 1
1 958 . 3 1 1 A 84 84 LYS H H 84 8.645 8.667 -0.022 1
1 959 . 3 1 1 A 84 84 LYS HA H 84 4.276 4.492 -0.216 1
1 968 . 3 1 1 A 84 84 LYS C C 84 176.832 176.936 -0.104 1
1 969 . 3 1 1 A 84 84 LYS CA C 84 56.272 56.652 -0.380 1
1 970 . 3 1 1 A 84 84 LYS CB C 84 32.876 31.085 1.791 1
1 974 . 3 1 1 A 84 84 LYS N N 84 126.447 127.738 -1.291 1
1 975 . 3 1 1 A 85 85 GLY H H 85 8.410 8.525 -0.115 1
1 976 . 3 1 1 A 85 85 GLY HA2 H 85 4.066 4.146 -0.080 1
1 977 . 3 1 1 A 85 85 GLY HA3 H 85 3.781 4.156 -0.375 1
1 978 . 3 1 1 A 85 85 GLY C C 85 173.969 174.479 -0.510 1
1 979 . 3 1 1 A 85 85 GLY CA C 85 45.146 45.249 -0.103 1
1 980 . 3 1 1 A 85 85 GLY N N 85 109.957 113.266 -3.309 1
1 981 . 3 1 1 A 86 86 ASN H H 86 8.298 8.242 0.056 1
1 982 . 3 1 1 A 86 86 ASN HA H 86 4.665 4.701 -0.036 1
1 987 . 3 1 1 A 86 86 ASN C C 86 174.987 175.271 -0.284 1
1 988 . 3 1 1 A 86 86 ASN CA C 86 52.989 53.621 -0.632 1
1 989 . 3 1 1 A 86 86 ASN CB C 86 38.376 38.557 -0.181 1
1 990 . 3 1 1 A 86 86 ASN N N 86 118.457 119.805 -1.348 1
1 992 . 3 1 1 A 87 87 VAL H H 87 7.660 8.330 -0.670 1
1 993 . 3 1 1 A 87 87 VAL HA H 87 3.946 4.065 -0.119 1
1 1001 . 3 1 1 A 87 87 VAL C C 87 174.902 175.464 -0.562 1
1 1002 . 3 1 1 A 87 87 VAL CA C 87 62.307 61.643 0.664 1
1 1003 . 3 1 1 A 87 87 VAL CB C 87 32.548 32.601 -0.053 1
1 1006 . 3 1 1 A 87 87 VAL N N 87 120.557 122.040 -1.483 1
1 1007 . 3 1 1 A 88 88 GLN H H 88 8.115 8.404 -0.289 1
1 1008 . 3 1 1 A 88 88 GLN HA H 88 4.302 4.979 -0.677 1
1 1015 . 3 1 1 A 88 88 GLN C C 88 175.637 174.651 0.986 1
1 1016 . 3 1 1 A 88 88 GLN CA C 88 55.336 54.227 1.109 1
1 1017 . 3 1 1 A 88 88 GLN CB C 88 30.574 31.730 -1.156 1
1 1019 . 3 1 1 A 88 88 GLN N N 88 122.280 117.299 4.981 1
1 1021 . 3 1 1 A 89 89 GLY H H 89 8.544 8.672 -0.128 1
1 1022 . 3 1 1 A 89 89 GLY HA2 H 89 3.885 3.968 -0.083 1
1 1023 . 3 1 1 A 89 89 GLY HA3 H 89 3.885 3.988 -0.103 1
1 1024 . 3 1 1 A 89 89 GLY C C 89 172.861 174.738 -1.877 1
1 1025 . 3 1 1 A 89 89 GLY CA C 89 44.889 45.343 -0.454 1
1 1026 . 3 1 1 A 89 89 GLY N N 89 110.135 109.596 0.539 1
1 1027 . 3 1 1 A 90 90 ASN H H 90 8.451 8.508 -0.057 1
1 1028 . 3 1 1 A 90 90 ASN HA H 90 4.222 4.357 -0.135 1
1 1033 . 3 1 1 A 90 90 ASN C C 90 174.926 174.956 -0.030 1
1 1034 . 3 1 1 A 90 90 ASN CA C 90 54.613 54.076 0.537 1
1 1035 . 3 1 1 A 90 90 ASN CB C 90 37.852 37.148 0.704 1
1 1036 . 3 1 1 A 90 90 ASN N N 90 114.322 111.332 2.990 1
1 1038 . 3 1 1 A 91 91 LEU H H 91 8.933 8.099 0.834 1
1 1039 . 3 1 1 A 91 91 LEU HA H 91 5.367 4.677 0.690 1
1 1049 . 3 1 1 A 91 91 LEU C C 91 178.732 175.866 2.866 1
1 1050 . 3 1 1 A 91 91 LEU CA C 91 55.160 54.476 0.684 1
1 1051 . 3 1 1 A 91 91 LEU CB C 91 45.461 42.872 2.589 1
1 1055 . 3 1 1 A 91 91 LEU N N 91 120.057 119.439 0.618 1
1 1056 . 3 1 1 A 92 92 PHE H H 92 9.901 8.342 1.559 1
1 1057 . 3 1 1 A 92 92 PHE HA H 92 5.105 5.201 -0.096 1
1 1065 . 3 1 1 A 92 92 PHE C C 92 170.140 172.834 -2.694 1
1 1066 . 3 1 1 A 92 92 PHE CA C 92 56.236 56.058 0.178 1
1 1067 . 3 1 1 A 92 92 PHE CB C 92 42.664 41.406 1.258 1
1 1073 . 3 1 1 A 92 92 PHE N N 92 119.740 116.588 3.152 1
1 1074 . 3 1 1 A 93 93 LYS H H 93 9.154 9.436 -0.282 1
1 1075 . 3 1 1 A 93 93 LYS HA H 93 5.584 5.030 0.554 1
1 1083 . 3 1 1 A 93 93 LYS C C 93 174.830 174.271 0.559 1
1 1084 . 3 1 1 A 93 93 LYS CA C 93 53.148 54.039 -0.891 1
1 1085 . 3 1 1 A 93 93 LYS CB C 93 36.660 36.174 0.486 1
1 1089 . 3 1 1 A 93 93 LYS N N 93 117.710 117.856 -0.146 1
1 1090 . 3 1 1 A 94 94 VAL H H 94 8.507 8.788 -0.281 1
1 1091 . 3 1 1 A 94 94 VAL HA H 94 4.872 5.060 -0.188 1
1 1099 . 3 1 1 A 94 94 VAL C C 94 174.408 174.768 -0.360 1
1 1100 . 3 1 1 A 94 94 VAL CA C 94 60.525 61.319 -0.794 1
1 1101 . 3 1 1 A 94 94 VAL CB C 94 34.862 33.815 1.047 1
1 1104 . 3 1 1 A 94 94 VAL N N 94 121.741 120.860 0.881 1
1 1105 . 3 1 1 A 95 95 ILE H H 95 8.959 9.158 -0.199 1
1 1106 . 3 1 1 A 95 95 ILE HA H 95 4.794 4.725 0.069 1
1 1116 . 3 1 1 A 95 95 ILE C C 95 177.642 176.205 1.437 1
1 1117 . 3 1 1 A 95 95 ILE CA C 95 59.713 60.479 -0.766 1
1 1118 . 3 1 1 A 95 95 ILE CB C 95 40.032 38.086 1.946 1
1 1122 . 3 1 1 A 95 95 ILE N N 95 126.794 128.651 -1.857 1
1 1123 . 3 1 1 A 96 96 THR H H 96 8.765 8.929 -0.164 1
1 1124 . 3 1 1 A 96 96 THR HA H 96 4.584 4.815 -0.231 1
1 1129 . 3 1 1 A 96 96 THR C C 96 177.023 176.355 0.668 1
1 1130 . 3 1 1 A 96 96 THR CA C 96 61.372 60.707 0.665 1
1 1131 . 3 1 1 A 96 96 THR CB C 96 70.794 71.820 -1.026 1
1 1133 . 3 1 1 A 96 96 THR N N 96 117.225 120.526 -3.301 1
1 1134 . 3 1 1 A 97 97 LYS H H 97 8.736 8.974 -0.238 1
1 1135 . 3 1 1 A 97 97 LYS HA H 97 4.101 4.079 0.022 1
1 1144 . 3 1 1 A 97 97 LYS C C 97 176.490 176.799 -0.309 1
1 1145 . 3 1 1 A 97 97 LYS CA C 97 58.583 58.571 0.012 1
1 1146 . 3 1 1 A 97 97 LYS CB C 97 31.848 32.133 -0.285 1
1 1150 . 3 1 1 A 97 97 LYS N N 97 120.457 119.648 0.809 1
1 1151 . 3 1 1 A 98 98 ASP H H 98 7.762 7.927 -0.165 1
1 1152 . 3 1 1 A 98 98 ASP HA H 98 4.633 4.749 -0.116 1
1 1155 . 3 1 1 A 98 98 ASP C C 98 175.270 174.515 0.755 1
1 1156 . 3 1 1 A 98 98 ASP CA C 98 53.272 53.902 -0.630 1
1 1157 . 3 1 1 A 98 98 ASP CB C 98 39.909 40.906 -0.997 1
1 1158 . 3 1 1 A 98 98 ASP N N 98 116.281 118.366 -2.085 1
1 1159 . 3 1 1 A 99 99 ASP H H 99 8.340 8.446 -0.106 1
1 1160 . 3 1 1 A 99 99 ASP HA H 99 4.245 4.543 -0.298 1
1 1163 . 3 1 1 A 99 99 ASP C C 99 175.315 175.590 -0.275 1
1 1164 . 3 1 1 A 99 99 ASP CA C 99 55.989 55.494 0.495 1
1 1165 . 3 1 1 A 99 99 ASP CB C 99 39.827 38.795 1.032 1
1 1166 . 3 1 1 A 99 99 ASP N N 99 116.687 116.282 0.405 1
1 1167 . 3 1 1 A 100 100 THR H H 100 7.511 7.882 -0.371 1
1 1168 . 3 1 1 A 100 100 THR HA H 100 4.185 3.853 0.332 1
1 1173 . 3 1 1 A 100 100 THR C C 100 173.376 174.330 -0.954 1
1 1174 . 3 1 1 A 100 100 THR CA C 100 63.489 65.694 -2.205 1
1 1175 . 3 1 1 A 100 100 THR CB C 100 67.909 69.187 -1.278 1
1 1177 . 3 1 1 A 100 100 THR N N 100 116.525 111.454 5.071 1
1 1178 . 3 1 1 A 101 101 HIS H H 101 8.753 8.145 0.608 1
1 1179 . 3 1 1 A 101 101 HIS HA H 101 4.898 4.405 0.493 1
1 1184 . 3 1 1 A 101 101 HIS C C 101 174.345 173.826 0.519 1
1 1185 . 3 1 1 A 101 101 HIS CA C 101 55.072 56.392 -1.320 1
1 1186 . 3 1 1 A 101 101 HIS CB C 101 32.835 27.664 5.171 1
1 1189 . 3 1 1 A 101 101 HIS N N 101 125.953 116.655 9.298 1
1 1190 . 3 1 1 A 102 102 TYR H H 102 9.023 8.882 0.141 1
1 1191 . 3 1 1 A 102 102 TYR HA H 102 4.545 4.765 -0.220 1
1 1198 . 3 1 1 A 102 102 TYR C C 102 174.126 174.952 -0.826 1
1 1199 . 3 1 1 A 102 102 TYR CA C 102 57.260 56.720 0.540 1
1 1200 . 3 1 1 A 102 102 TYR CB C 102 40.381 38.436 1.945 1
1 1205 . 3 1 1 A 102 102 TYR N N 102 121.975 119.733 2.242 1
1 1206 . 3 1 1 A 103 103 TYR H H 103 8.899 8.983 -0.084 1
1 1207 . 3 1 1 A 103 103 TYR HA H 103 4.729 4.813 -0.084 1
1 1214 . 3 1 1 A 103 103 TYR C C 103 174.139 175.943 -1.804 1
1 1215 . 3 1 1 A 103 103 TYR CA C 103 58.036 58.549 -0.513 1
1 1216 . 3 1 1 A 103 103 TYR CB C 103 40.485 39.621 0.864 1
1 1221 . 3 1 1 A 103 103 TYR N N 103 122.012 124.138 -2.126 1
1 1222 . 3 1 1 A 104 104 ILE H H 104 8.605 8.639 -0.034 1
1 1223 . 3 1 1 A 104 104 ILE HA H 104 4.859 4.658 0.201 1
1 1233 . 3 1 1 A 104 104 ILE C C 104 172.769 174.582 -1.813 1
1 1234 . 3 1 1 A 104 104 ILE CA C 104 59.554 59.554 0.000 1
1 1235 . 3 1 1 A 104 104 ILE CB C 104 40.631 42.069 -1.438 1
1 1239 . 3 1 1 A 104 104 ILE N N 104 123.443 122.855 0.588 1
1 1240 . 3 1 1 A 105 105 GLN H H 105 9.369 8.607 0.762 1
1 1241 . 3 1 1 A 105 105 GLN HA H 105 4.895 5.295 -0.400 1
1 1248 . 3 1 1 A 105 105 GLN C C 105 175.642 174.830 0.812 1
1 1249 . 3 1 1 A 105 105 GLN CA C 105 54.965 54.300 0.665 1
1 1250 . 3 1 1 A 105 105 GLN CB C 105 32.856 32.494 0.362 1
1 1252 . 3 1 1 A 105 105 GLN N N 105 125.079 124.801 0.278 1
1 1254 . 3 1 1 A 106 106 ALA H H 106 8.513 8.490 0.023 1
1 1255 . 3 1 1 A 106 106 ALA HA H 106 4.962 4.902 0.060 1
1 1259 . 3 1 1 A 106 106 ALA C C 106 175.854 177.805 -1.951 1
1 1260 . 3 1 1 A 106 106 ALA CA C 106 50.272 50.557 -0.285 1
1 1261 . 3 1 1 A 106 106 ALA CB C 106 21.197 21.805 -0.608 1
1 1262 . 3 1 1 A 106 106 ALA N N 106 129.303 128.465 0.838 1
1 1263 . 3 1 1 A 107 107 SER H H 107 9.468 8.934 0.534 1
1 1264 . 3 1 1 A 107 107 SER HA H 107 4.447 4.592 -0.145 1
1 1267 . 3 1 1 A 107 107 SER C C 107 173.785 174.607 -0.822 1
1 1268 . 3 1 1 A 107 107 SER CA C 107 60.048 60.553 -0.505 1
1 1269 . 3 1 1 A 107 107 SER CB C 107 64.643 64.199 0.444 1
1 1270 . 3 1 1 A 107 107 SER N N 107 112.962 115.565 -2.603 1
1 1271 . 3 1 1 A 108 108 SER H H 108 7.555 8.213 -0.658 1
1 1272 . 3 1 1 A 108 108 SER HA H 108 4.665 4.930 -0.265 1
1 1275 . 3 1 1 A 108 108 SER C C 108 174.381 174.775 -0.394 1
1 1276 . 3 1 1 A 108 108 SER CA C 108 56.907 57.510 -0.603 1
1 1277 . 3 1 1 A 108 108 SER CB C 108 66.370 65.233 1.137 1
1 1278 . 3 1 1 A 108 108 SER N N 108 112.243 116.239 -3.996 1
1 1279 . 3 1 1 A 109 109 LYS H H 109 8.978 8.942 0.036 1
1 1280 . 3 1 1 A 109 109 LYS HA H 109 4.777 3.868 0.909 1
1 1287 . 3 1 1 A 109 109 LYS C C 109 179.992 178.229 1.763 1
1 1288 . 3 1 1 A 109 109 LYS CA C 109 59.766 60.468 -0.702 1
1 1289 . 3 1 1 A 109 109 LYS CB C 109 32.342 32.221 0.121 1
1 1293 . 3 1 1 A 109 109 LYS N N 109 123.170 125.154 -1.984 1
1 1294 . 3 1 1 A 110 110 ALA H H 110 8.608 8.013 0.595 1
1 1295 . 3 1 1 A 110 110 ALA HA H 110 4.178 4.085 0.093 1
1 1299 . 3 1 1 A 110 110 ALA C C 110 179.895 179.094 0.801 1
1 1300 . 3 1 1 A 110 110 ALA CA C 110 54.871 55.394 -0.523 1
1 1301 . 3 1 1 A 110 110 ALA CB C 110 18.065 18.279 -0.214 1
1 1302 . 3 1 1 A 110 110 ALA N N 110 123.750 120.717 3.033 1
1 1303 . 3 1 1 A 111 111 GLU H H 111 8.185 8.276 -0.091 1
1 1304 . 3 1 1 A 111 111 GLU HA H 111 4.180 4.013 0.167 1
1 1309 . 3 1 1 A 111 111 GLU C C 111 178.587 178.978 -0.391 1
1 1310 . 3 1 1 A 111 111 GLU CA C 111 59.466 59.794 -0.328 1
1 1311 . 3 1 1 A 111 111 GLU CB C 111 31.067 29.336 1.731 1
1 1313 . 3 1 1 A 111 111 GLU N N 111 119.757 118.562 1.195 1
1 1314 . 3 1 1 A 112 112 ARG H H 112 8.008 8.208 -0.200 1
1 1315 . 3 1 1 A 112 112 ARG HA H 112 3.642 4.032 -0.390 1
1 1322 . 3 1 1 A 112 112 ARG C C 112 176.481 178.194 -1.713 1
1 1323 . 3 1 1 A 112 112 ARG CA C 112 60.419 59.607 0.812 1
1 1324 . 3 1 1 A 112 112 ARG CB C 112 29.957 30.035 -0.078 1
1 1327 . 3 1 1 A 112 112 ARG N N 112 118.430 120.079 -1.649 1
1 1328 . 3 1 1 A 113 113 ALA H H 113 7.985 7.764 0.221 1
1 1329 . 3 1 1 A 113 113 ALA HA H 113 3.925 4.001 -0.076 1
1 1333 . 3 1 1 A 113 113 ALA C C 113 180.117 179.867 0.250 1
1 1334 . 3 1 1 A 113 113 ALA CA C 113 55.372 55.122 0.250 1
1 1335 . 3 1 1 A 113 113 ALA CB C 113 17.825 18.433 -0.608 1
1 1336 . 3 1 1 A 113 113 ALA N N 113 119.980 120.842 -0.862 1
1 1337 . 3 1 1 A 114 114 GLU H H 114 8.093 8.624 -0.531 1
1 1338 . 3 1 1 A 114 114 GLU HA H 114 3.936 3.910 0.026 1
1 1343 . 3 1 1 A 114 114 GLU C C 114 180.586 179.144 1.442 1
1 1344 . 3 1 1 A 114 114 GLU CA C 114 59.148 59.397 -0.249 1
1 1345 . 3 1 1 A 114 114 GLU CB C 114 30.080 29.295 0.785 1
1 1347 . 3 1 1 A 114 114 GLU N N 114 117.168 117.532 -0.364 1
1 1348 . 3 1 1 A 115 115 TRP H H 115 7.980 8.180 -0.200 1
1 1349 . 3 1 1 A 115 115 TRP HA H 115 3.775 4.336 -0.561 1
1 1358 . 3 1 1 A 115 115 TRP C C 115 177.714 178.658 -0.944 1
1 1359 . 3 1 1 A 115 115 TRP CA C 115 62.696 59.863 2.833 1
1 1360 . 3 1 1 A 115 115 TRP CB C 115 29.052 29.209 -0.157 1
1 1366 . 3 1 1 A 115 115 TRP N N 115 120.974 120.851 0.123 1
1 1368 . 3 1 1 A 116 116 ILE H H 116 8.297 8.351 -0.054 1
1 1369 . 3 1 1 A 116 116 ILE HA H 116 3.270 3.555 -0.285 1
1 1379 . 3 1 1 A 116 116 ILE C C 116 177.568 177.699 -0.131 1
1 1380 . 3 1 1 A 116 116 ILE CA C 116 66.643 64.964 1.679 1
1 1381 . 3 1 1 A 116 116 ILE CB C 116 37.606 37.563 0.043 1
1 1385 . 3 1 1 A 116 116 ILE N N 116 118.408 120.144 -1.736 1
1 1386 . 3 1 1 A 117 117 GLU H H 117 8.026 8.731 -0.705 1
1 1387 . 3 1 1 A 117 117 GLU HA H 117 3.880 3.973 -0.093 1
1 1392 . 3 1 1 A 117 117 GLU C C 117 178.476 179.023 -0.547 1
1 1393 . 3 1 1 A 117 117 GLU CA C 117 59.219 59.665 -0.446 1
1 1394 . 3 1 1 A 117 117 GLU CB C 117 29.381 29.270 0.111 1
1 1396 . 3 1 1 A 117 117 GLU N N 117 117.096 120.484 -3.388 1
1 1397 . 3 1 1 A 118 118 ALA H H 118 7.555 8.374 -0.819 1
1 1398 . 3 1 1 A 118 118 ALA HA H 118 3.952 4.048 -0.096 1
1 1402 . 3 1 1 A 118 118 ALA C C 118 179.862 179.986 -0.124 1
1 1403 . 3 1 1 A 118 118 ALA CA C 118 54.772 55.059 -0.287 1
1 1404 . 3 1 1 A 118 118 ALA CB C 118 18.277 18.452 -0.175 1
1 1405 . 3 1 1 A 118 118 ALA N N 118 119.817 121.852 -2.035 1
1 1406 . 3 1 1 A 119 119 ILE H H 119 8.167 8.819 -0.652 1
1 1407 . 3 1 1 A 119 119 ILE HA H 119 3.558 3.768 -0.210 1
1 1417 . 3 1 1 A 119 119 ILE C C 119 178.564 177.938 0.626 1
1 1418 . 3 1 1 A 119 119 ILE CA C 119 65.766 65.275 0.491 1
1 1419 . 3 1 1 A 119 119 ILE CB C 119 38.840 37.985 0.855 1
1 1423 . 3 1 1 A 119 119 ILE N N 119 116.280 118.143 -1.863 1
1 1424 . 3 1 1 A 120 120 LYS H H 120 8.790 8.275 0.515 1
1 1425 . 3 1 1 A 120 120 LYS HA H 120 3.965 4.309 -0.344 1
1 1434 . 3 1 1 A 120 120 LYS C C 120 179.673 179.226 0.447 1
1 1435 . 3 1 1 A 120 120 LYS CA C 120 60.031 60.131 -0.100 1
1 1436 . 3 1 1 A 120 120 LYS CB C 120 32.547 32.253 0.294 1
1 1440 . 3 1 1 A 120 120 LYS N N 120 119.650 118.824 0.826 1
1 1441 . 3 1 1 A 121 121 LYS H H 121 7.594 8.235 -0.641 1
1 1442 . 3 1 1 A 121 121 LYS HA H 121 4.095 3.953 0.142 1
1 1451 . 3 1 1 A 121 121 LYS C C 121 177.962 178.979 -1.017 1
1 1452 . 3 1 1 A 121 121 LYS CA C 121 58.848 59.623 -0.775 1
1 1453 . 3 1 1 A 121 121 LYS CB C 121 32.547 32.324 0.223 1
1 1457 . 3 1 1 A 121 121 LYS N N 121 117.197 119.758 -2.561 1
1 1458 . 3 1 1 A 122 122 LEU H H 122 7.586 7.729 -0.143 1
1 1459 . 3 1 1 A 122 122 LEU HA H 122 4.535 4.004 0.531 1
1 1469 . 3 1 1 A 122 122 LEU C C 122 177.902 178.239 -0.337 1
1 1470 . 3 1 1 A 122 122 LEU CA C 122 55.071 57.992 -2.921 1
1 1471 . 3 1 1 A 122 122 LEU CB C 122 42.888 41.882 1.006 1
1 1475 . 3 1 1 A 122 122 LEU N N 122 116.861 120.365 -3.504 1
1 1476 . 3 1 1 A 123 123 THR H H 123 7.636 7.782 -0.146 1
1 1477 . 3 1 1 A 123 123 THR HA H 123 4.445 4.377 0.068 1
1 1482 . 3 1 1 A 123 123 THR C C 123 175.714 174.082 1.632 1
1 1483 . 3 1 1 A 123 123 THR CA C 123 62.643 61.542 1.101 1
1 1484 . 3 1 1 A 123 123 THR CB C 123 70.259 68.262 1.997 1
1 1486 . 3 1 1 A 123 123 THR N N 123 108.963 108.076 0.887 1
1 1487 . 3 1 1 A 124 124 SER H H 124 7.912 8.665 -0.753 1
1 1488 . 3 1 1 A 124 124 SER HA H 124 4.626 4.059 0.567 1
1 1491 . 3 1 1 A 124 124 SER C C 124 174.405 173.452 0.953 1
1 1492 . 3 1 1 A 124 124 SER CA C 124 58.390 59.124 -0.734 1
1 1493 . 3 1 1 A 124 124 SER CB C 124 64.255 61.879 2.376 1
1 1494 . 3 1 1 A 124 124 SER N N 124 116.876 113.140 3.736 1
1 1495 . 3 1 1 A 125 125 GLY H H 125 8.307 7.916 0.391 1
1 1496 . 3 1 1 A 125 125 GLY HA2 H 125 4.166 4.326 -0.160 1
1 1497 . 3 1 1 A 125 125 GLY HA3 H 125 4.166 4.326 -0.160 1
1 1498 . 3 1 1 A 125 125 GLY C C 125 171.921 172.689 -0.768 1
1 1499 . 3 1 1 A 125 125 GLY CA C 125 44.748 44.672 0.076 1
1 1500 . 3 1 1 A 125 125 GLY N N 125 110.006 110.401 -0.395 1
1 1501 . 3 1 1 A 126 126 PRO HA H 126 4.510 4.605 -0.095 1
1 1508 . 3 1 1 A 126 126 PRO C C 126 177.471 176.143 1.328 1
1 1509 . 3 1 1 A 126 126 PRO CA C 126 63.419 62.577 0.842 1
1 1510 . 3 1 1 A 126 126 PRO CB C 126 32.106 32.625 -0.519 1
1 1513 . 3 1 1 A 127 127 SER H H 127 8.607 8.478 0.129 1
1 1514 . 3 1 1 A 127 127 SER C C 127 174.628 174.490 0.138 1
1 1515 . 3 1 1 A 127 127 SER CA C 127 58.513 58.634 -0.121 1
1 1516 . 3 1 1 A 127 127 SER CB C 127 63.679 64.183 -0.504 1
1 1517 . 3 1 1 A 127 127 SER N N 127 116.390 118.444 -2.054 1
1 1518 . 3 1 1 A 128 128 SER H H 128 8.272 8.777 -0.505 1
1 1519 . 3 1 1 A 128 128 SER HA H 128 4.496 4.499 -0.003 1
1 1520 . 3 1 1 A 128 128 SER C C 128 173.921 175.428 -1.507 1
1 1521 . 3 1 1 A 128 128 SER CA C 128 58.442 58.743 -0.301 1
1 1522 . 3 1 1 A 128 128 SER CB C 128 64.173 63.995 0.178 1
1 1523 . 3 1 1 A 128 128 SER N N 128 117.506 121.250 -3.744 1
1 1 . 4 1 1 A 7 7 GLY HA2 H 7 3.978 4.090 -0.112 1
1 2 . 4 1 1 A 7 7 GLY HA3 H 7 3.978 4.093 -0.115 1
1 3 . 4 1 1 A 7 7 GLY C C 7 174.274 172.993 1.281 1
1 4 . 4 1 1 A 7 7 GLY CA C 7 45.383 44.222 1.161 1
1 5 . 4 1 1 A 8 8 SER H H 8 8.211 8.672 -0.461 1
1 6 . 4 1 1 A 8 8 SER HA H 8 4.425 4.997 -0.572 1
1 9 . 4 1 1 A 8 8 SER C C 8 174.635 172.840 1.795 1
1 10 . 4 1 1 A 8 8 SER CA C 8 58.425 58.012 0.413 1
1 11 . 4 1 1 A 8 8 SER CB C 8 63.885 63.644 0.241 1
1 12 . 4 1 1 A 8 8 SER N N 8 115.732 116.463 -0.731 1
1 13 . 4 1 1 A 9 9 LEU H H 9 8.316 8.777 -0.461 1
1 14 . 4 1 1 A 9 9 LEU HA H 9 4.334 4.630 -0.296 1
1 24 . 4 1 1 A 9 9 LEU C C 9 177.447 176.038 1.409 1
1 25 . 4 1 1 A 9 9 LEU CA C 9 55.407 53.459 1.948 1
1 26 . 4 1 1 A 9 9 LEU CB C 9 42.171 42.809 -0.638 1
1 30 . 4 1 1 A 9 9 LEU N N 9 123.943 128.281 -4.338 1
1 31 . 4 1 1 A 10 10 SER H H 10 8.304 9.219 -0.915 1
1 32 . 4 1 1 A 10 10 SER HA H 10 4.424 4.058 0.366 1
1 35 . 4 1 1 A 10 10 SER C C 10 175.025 173.626 1.399 1
1 36 . 4 1 1 A 10 10 SER CA C 10 58.425 59.637 -1.212 1
1 37 . 4 1 1 A 10 10 SER CB C 10 63.638 62.168 1.470 1
1 38 . 4 1 1 A 10 10 SER N N 10 116.718 121.414 -4.696 1
1 39 . 4 1 1 A 11 11 THR H H 11 8.003 8.258 -0.255 1
1 40 . 4 1 1 A 11 11 THR HA H 11 4.196 4.341 -0.145 1
1 45 . 4 1 1 A 11 11 THR C C 11 176.296 173.285 3.011 1
1 46 . 4 1 1 A 11 11 THR CA C 11 62.483 63.067 -0.584 1
1 47 . 4 1 1 A 11 11 THR CB C 11 69.266 67.729 1.537 1
1 49 . 4 1 1 A 11 11 THR N N 11 114.902 114.696 0.206 1
1 50 . 4 1 1 A 12 12 VAL H H 12 8.095 8.187 -0.092 1
1 51 . 4 1 1 A 12 12 VAL HA H 12 3.826 4.276 -0.450 1
1 59 . 4 1 1 A 12 12 VAL C C 12 178.501 176.980 1.521 1
1 60 . 4 1 1 A 12 12 VAL CA C 12 64.760 63.498 1.262 1
1 61 . 4 1 1 A 12 12 VAL CB C 12 32.013 33.290 -1.277 1
1 64 . 4 1 1 A 12 12 VAL N N 12 122.111 124.684 -2.573 1
1 65 . 4 1 1 A 13 13 GLU H H 13 8.151 8.685 -0.534 1
1 66 . 4 1 1 A 13 13 GLU HA H 13 3.244 3.801 -0.557 1
1 71 . 4 1 1 A 13 13 GLU C C 13 175.702 178.151 -2.449 1
1 72 . 4 1 1 A 13 13 GLU CA C 13 58.354 58.931 -0.577 1
1 73 . 4 1 1 A 13 13 GLU CB C 13 28.843 28.433 0.410 1
1 75 . 4 1 1 A 13 13 GLU N N 13 120.316 122.371 -2.055 1
1 76 . 4 1 1 A 14 14 LEU H H 14 7.067 7.565 -0.498 1
1 77 . 4 1 1 A 14 14 LEU HA H 14 4.157 4.162 -0.005 1
1 87 . 4 1 1 A 14 14 LEU C C 14 176.863 177.136 -0.273 1
1 88 . 4 1 1 A 14 14 LEU CA C 14 53.324 55.703 -2.379 1
1 89 . 4 1 1 A 14 14 LEU CB C 14 41.636 41.601 0.035 1
1 93 . 4 1 1 A 14 14 LEU N N 14 117.035 119.761 -2.726 1
1 94 . 4 1 1 A 15 15 SER H H 15 7.645 7.790 -0.145 1
1 95 . 4 1 1 A 15 15 SER HA H 15 4.305 4.612 -0.307 1
1 98 . 4 1 1 A 15 15 SER C C 15 175.340 173.395 1.945 1
1 99 . 4 1 1 A 15 15 SER CA C 15 59.783 57.875 1.908 1
1 100 . 4 1 1 A 15 15 SER CB C 15 64.625 61.271 3.354 1
1 101 . 4 1 1 A 15 15 SER N N 15 114.216 113.654 0.562 1
1 102 . 4 1 1 A 16 16 GLY H H 16 8.506 8.128 0.378 1
1 103 . 4 1 1 A 16 16 GLY HA2 H 16 4.237 4.336 -0.099 1
1 104 . 4 1 1 A 16 16 GLY HA3 H 16 3.927 4.360 -0.433 1
1 105 . 4 1 1 A 16 16 GLY C C 16 173.661 172.105 1.556 1
1 106 . 4 1 1 A 16 16 GLY CA C 16 44.995 43.997 0.998 1
1 107 . 4 1 1 A 16 16 GLY N N 16 111.838 110.572 1.266 1
1 108 . 4 1 1 A 17 17 THR H H 17 8.482 9.105 -0.623 1
1 109 . 4 1 1 A 17 17 THR HA H 17 4.319 4.353 -0.034 1
1 114 . 4 1 1 A 17 17 THR C C 17 174.758 174.356 0.402 1
1 115 . 4 1 1 A 17 17 THR CA C 17 62.272 63.787 -1.515 1
1 116 . 4 1 1 A 17 17 THR CB C 17 70.706 68.848 1.858 1
1 118 . 4 1 1 A 17 17 THR N N 17 116.679 115.415 1.264 1
1 119 . 4 1 1 A 18 18 VAL H H 18 8.948 8.806 0.142 1
1 120 . 4 1 1 A 18 18 VAL HA H 18 3.950 4.270 -0.320 1
1 128 . 4 1 1 A 18 18 VAL C C 18 176.669 176.989 -0.320 1
1 129 . 4 1 1 A 18 18 VAL CA C 18 64.813 63.630 1.183 1
1 130 . 4 1 1 A 18 18 VAL CB C 18 31.807 31.670 0.137 1
1 133 . 4 1 1 A 18 18 VAL N N 18 127.156 127.726 -0.570 1
1 134 . 4 1 1 A 19 19 VAL H H 19 9.359 9.288 0.071 1
1 135 . 4 1 1 A 19 19 VAL HA H 19 4.234 4.385 -0.151 1
1 143 . 4 1 1 A 19 19 VAL C C 19 175.738 175.808 -0.070 1
1 144 . 4 1 1 A 19 19 VAL CA C 19 62.060 62.077 -0.017 1
1 145 . 4 1 1 A 19 19 VAL CB C 19 33.822 33.456 0.366 1
1 148 . 4 1 1 A 19 19 VAL N N 19 125.162 121.384 3.778 1
1 149 . 4 1 1 A 20 20 LYS H H 20 7.584 7.354 0.230 1
1 150 . 4 1 1 A 20 20 LYS HA H 20 4.346 4.598 -0.252 1
1 159 . 4 1 1 A 20 20 LYS C C 20 172.818 173.998 -1.180 1
1 160 . 4 1 1 A 20 20 LYS CA C 20 56.801 55.565 1.236 1
1 161 . 4 1 1 A 20 20 LYS CB C 20 36.624 35.468 1.156 1
1 165 . 4 1 1 A 20 20 LYS N N 20 121.024 120.914 0.110 1
1 166 . 4 1 1 A 21 21 GLN H H 21 8.625 8.462 0.163 1
1 167 . 4 1 1 A 21 21 GLN HA H 21 6.003 5.353 0.650 1
1 174 . 4 1 1 A 21 21 GLN C C 21 174.914 174.860 0.054 1
1 175 . 4 1 1 A 21 21 GLN CA C 21 54.207 54.531 -0.324 1
1 176 . 4 1 1 A 21 21 GLN CB C 21 33.452 33.255 0.197 1
1 178 . 4 1 1 A 21 21 GLN N N 21 122.108 124.106 -1.998 1
1 180 . 4 1 1 A 22 22 GLY H H 22 8.964 8.257 0.707 1
1 181 . 4 1 1 A 22 22 GLY HA2 H 22 4.665 4.366 0.299 1
1 182 . 4 1 1 A 22 22 GLY HA3 H 22 4.295 4.588 -0.293 1
1 183 . 4 1 1 A 22 22 GLY C C 22 170.879 171.726 -0.847 1
1 184 . 4 1 1 A 22 22 GLY CA C 22 45.683 45.817 -0.134 1
1 185 . 4 1 1 A 22 22 GLY N N 22 108.508 108.889 -0.381 1
1 186 . 4 1 1 A 23 23 TYR H H 23 9.145 8.751 0.394 1
1 187 . 4 1 1 A 23 23 TYR HA H 23 5.595 5.634 -0.039 1
1 194 . 4 1 1 A 23 23 TYR C C 23 175.824 175.355 0.469 1
1 195 . 4 1 1 A 23 23 TYR CA C 23 58.019 56.445 1.574 1
1 196 . 4 1 1 A 23 23 TYR CB C 23 39.251 41.028 -1.777 1
1 201 . 4 1 1 A 23 23 TYR N N 23 120.809 120.039 0.770 1
1 202 . 4 1 1 A 24 24 LEU H H 24 8.935 9.631 -0.696 1
1 203 . 4 1 1 A 24 24 LEU HA H 24 4.716 5.076 -0.360 1
1 213 . 4 1 1 A 24 24 LEU C C 24 174.648 175.906 -1.258 1
1 214 . 4 1 1 A 24 24 LEU CA C 24 53.907 53.222 0.685 1
1 215 . 4 1 1 A 24 24 LEU CB C 24 46.078 45.064 1.014 1
1 219 . 4 1 1 A 24 24 LEU N N 24 122.887 124.440 -1.553 1
1 220 . 4 1 1 A 25 25 ALA H H 25 8.145 8.486 -0.341 1
1 221 . 4 1 1 A 25 25 ALA HA H 25 5.477 5.482 -0.005 1
1 225 . 4 1 1 A 25 25 ALA C C 25 175.751 175.548 0.203 1
1 226 . 4 1 1 A 25 25 ALA CA C 25 50.719 50.417 0.302 1
1 227 . 4 1 1 A 25 25 ALA CB C 25 21.074 20.611 0.463 1
1 228 . 4 1 1 A 25 25 ALA N N 25 122.280 123.317 -1.037 1
1 229 . 4 1 1 A 26 26 LYS H H 26 9.167 8.608 0.559 1
1 230 . 4 1 1 A 26 26 LYS HA H 26 5.221 4.702 0.519 1
1 239 . 4 1 1 A 26 26 LYS C C 26 175.421 176.263 -0.842 1
1 240 . 4 1 1 A 26 26 LYS CA C 26 54.383 55.250 -0.867 1
1 241 . 4 1 1 A 26 26 LYS CB C 26 36.125 33.516 2.609 1
1 245 . 4 1 1 A 26 26 LYS N N 26 120.638 125.679 -5.041 1
1 246 . 4 1 1 A 27 27 GLN H H 27 7.866 8.069 -0.203 1
1 247 . 4 1 1 A 27 27 GLN HA H 27 3.525 3.805 -0.280 1
1 254 . 4 1 1 A 27 27 GLN C C 27 177.022 175.128 1.894 1
1 255 . 4 1 1 A 27 27 GLN CA C 27 55.778 56.476 -0.698 1
1 256 . 4 1 1 A 27 27 GLN CB C 27 29.864 28.733 1.131 1
1 258 . 4 1 1 A 27 27 GLN N N 27 130.194 128.063 2.131 1
1 260 . 4 1 1 A 28 28 GLY H H 28 8.565 7.829 0.736 1
1 261 . 4 1 1 A 28 28 GLY HA2 H 28 4.125 3.934 0.191 1
1 262 . 4 1 1 A 28 28 GLY HA3 H 28 4.034 4.012 0.022 1
1 263 . 4 1 1 A 28 28 GLY C C 28 174.030 172.374 1.656 1
1 264 . 4 1 1 A 28 28 GLY CA C 28 45.665 45.605 0.060 1
1 265 . 4 1 1 A 28 28 GLY N N 28 115.528 112.212 3.316 1
1 266 . 4 1 1 A 29 29 HIS HA H 29 4.355 5.161 -0.806 1
1 271 . 4 1 1 A 29 29 HIS CA C 29 58.795 54.437 4.358 1
1 272 . 4 1 1 A 29 29 HIS CB C 29 31.283 32.667 -1.384 1
1 275 . 4 1 1 A 30 30 LYS HA H 30 4.096 4.224 -0.128 1
1 284 . 4 1 1 A 30 30 LYS CA C 30 57.290 57.848 -0.558 1
1 285 . 4 1 1 A 30 30 LYS CB C 30 31.951 32.008 -0.057 1
1 289 . 4 1 1 A 31 31 ARG HA H 31 3.975 4.005 -0.030 1
1 296 . 4 1 1 A 31 31 ARG CA C 31 55.973 57.178 -1.205 1
1 297 . 4 1 1 A 31 31 ARG CB C 31 29.902 28.577 1.325 1
1 300 . 4 1 1 A 32 32 LYS HA H 32 4.160 4.372 -0.212 1
1 309 . 4 1 1 A 32 32 LYS C C 32 175.678 177.217 -1.539 1
1 310 . 4 1 1 A 32 32 LYS CA C 32 56.254 57.913 -1.659 1
1 311 . 4 1 1 A 32 32 LYS CB C 32 31.602 31.536 0.066 1
1 315 . 4 1 1 A 33 33 ASN H H 33 7.925 8.795 -0.870 1
1 316 . 4 1 1 A 33 33 ASN HA H 33 4.799 4.602 0.197 1
1 321 . 4 1 1 A 33 33 ASN C C 33 174.005 175.622 -1.617 1
1 322 . 4 1 1 A 33 33 ASN CA C 33 52.407 55.439 -3.032 1
1 323 . 4 1 1 A 33 33 ASN CB C 33 39.879 39.919 -0.040 1
1 324 . 4 1 1 A 33 33 ASN N N 33 116.990 120.209 -3.219 1
1 326 . 4 1 1 A 34 34 TRP H H 34 8.798 7.937 0.861 1
1 327 . 4 1 1 A 34 34 TRP HA H 34 4.755 5.254 -0.499 1
1 336 . 4 1 1 A 34 34 TRP C C 34 176.090 175.333 0.757 1
1 337 . 4 1 1 A 34 34 TRP CA C 34 57.119 55.629 1.490 1
1 338 . 4 1 1 A 34 34 TRP CB C 34 30.596 31.132 -0.536 1
1 344 . 4 1 1 A 34 34 TRP N N 34 121.917 116.131 5.786 1
1 346 . 4 1 1 A 35 35 LYS H H 35 8.404 9.056 -0.652 1
1 347 . 4 1 1 A 35 35 LYS HA H 35 4.846 4.823 0.023 1
1 354 . 4 1 1 A 35 35 LYS C C 35 176.088 176.406 -0.318 1
1 355 . 4 1 1 A 35 35 LYS CA C 35 54.418 55.365 -0.947 1
1 356 . 4 1 1 A 35 35 LYS CB C 35 36.125 34.027 2.098 1
1 360 . 4 1 1 A 35 35 LYS N N 35 120.864 125.760 -4.896 1
1 361 . 4 1 1 A 36 36 VAL H H 36 8.977 8.588 0.389 1
1 362 . 4 1 1 A 36 36 VAL HA H 36 4.274 4.534 -0.260 1
1 370 . 4 1 1 A 36 36 VAL C C 36 176.733 175.994 0.739 1
1 371 . 4 1 1 A 36 36 VAL CA C 36 64.319 63.138 1.181 1
1 372 . 4 1 1 A 36 36 VAL CB C 36 31.602 32.365 -0.763 1
1 375 . 4 1 1 A 36 36 VAL N N 36 124.314 125.363 -1.049 1
1 376 . 4 1 1 A 37 37 ARG H H 37 9.498 9.964 -0.466 1
1 377 . 4 1 1 A 37 37 ARG HA H 37 5.053 4.954 0.099 1
1 384 . 4 1 1 A 37 37 ARG C C 37 174.442 174.306 0.136 1
1 385 . 4 1 1 A 37 37 ARG CA C 37 53.272 54.844 -1.572 1
1 386 . 4 1 1 A 37 37 ARG CB C 37 34.563 34.443 0.120 1
1 389 . 4 1 1 A 37 37 ARG N N 37 128.121 125.940 2.181 1
1 390 . 4 1 1 A 38 38 ARG H H 38 8.755 8.752 0.003 1
1 391 . 4 1 1 A 38 38 ARG HA H 38 4.626 4.470 0.156 1
1 398 . 4 1 1 A 38 38 ARG C C 38 175.514 174.981 0.533 1
1 399 . 4 1 1 A 38 38 ARG CA C 38 55.601 55.808 -0.207 1
1 400 . 4 1 1 A 38 38 ARG CB C 38 32.219 30.907 1.312 1
1 403 . 4 1 1 A 38 38 ARG N N 38 121.442 125.883 -4.441 1
1 404 . 4 1 1 A 39 39 PHE H H 39 9.865 8.912 0.953 1
1 405 . 4 1 1 A 39 39 PHE HA H 39 5.424 5.041 0.383 1
1 413 . 4 1 1 A 39 39 PHE C C 39 175.423 174.810 0.613 1
1 414 . 4 1 1 A 39 39 PHE CA C 39 57.419 57.056 0.363 1
1 415 . 4 1 1 A 39 39 PHE CB C 39 42.623 41.040 1.583 1
1 421 . 4 1 1 A 39 39 PHE N N 39 130.027 126.467 3.560 1
1 422 . 4 1 1 A 40 40 VAL H H 40 9.300 9.719 -0.419 1
1 423 . 4 1 1 A 40 40 VAL HA H 40 4.846 5.294 -0.448 1
1 431 . 4 1 1 A 40 40 VAL C C 40 174.477 173.311 1.166 1
1 432 . 4 1 1 A 40 40 VAL CA C 40 62.343 59.855 2.488 1
1 433 . 4 1 1 A 40 40 VAL CB C 40 35.755 34.941 0.814 1
1 436 . 4 1 1 A 40 40 VAL N N 40 119.369 122.342 -2.973 1
1 437 . 4 1 1 A 41 41 LEU H H 41 9.557 10.062 -0.505 1
1 438 . 4 1 1 A 41 41 LEU HA H 41 5.292 5.394 -0.102 1
1 448 . 4 1 1 A 41 41 LEU C C 41 174.632 175.354 -0.722 1
1 449 . 4 1 1 A 41 41 LEU CA C 41 53.571 53.782 -0.211 1
1 450 . 4 1 1 A 41 41 LEU CB C 41 45.337 43.932 1.405 1
1 454 . 4 1 1 A 41 41 LEU N N 41 132.121 129.854 2.267 1
1 455 . 4 1 1 A 42 42 ARG H H 42 9.396 8.932 0.464 1
1 456 . 4 1 1 A 42 42 ARG HA H 42 5.366 5.236 0.130 1
1 464 . 4 1 1 A 42 42 ARG C C 42 173.997 175.176 -1.179 1
1 465 . 4 1 1 A 42 42 ARG CA C 42 54.631 54.255 0.376 1
1 466 . 4 1 1 A 42 42 ARG CB C 42 35.550 33.951 1.599 1
1 469 . 4 1 1 A 42 42 ARG N N 42 128.120 124.872 3.248 1
1 471 . 4 1 1 A 43 43 LYS H H 43 8.597 8.821 -0.224 1
1 472 . 4 1 1 A 43 43 LYS HA H 43 4.558 4.925 -0.367 1
1 481 . 4 1 1 A 43 43 LYS C C 43 174.648 174.998 -0.350 1
1 482 . 4 1 1 A 43 43 LYS CA C 43 53.378 54.715 -1.337 1
1 483 . 4 1 1 A 43 43 LYS CB C 43 37.303 35.994 1.309 1
1 487 . 4 1 1 A 43 43 LYS N N 43 114.484 119.044 -4.560 1
1 488 . 4 1 1 A 44 44 ASP H H 44 8.388 8.799 -0.411 1
1 489 . 4 1 1 A 44 44 ASP HA H 44 4.349 4.165 0.184 1
1 492 . 4 1 1 A 44 44 ASP C C 44 173.376 174.040 -0.664 1
1 493 . 4 1 1 A 44 44 ASP CA C 44 54.842 54.852 -0.010 1
1 494 . 4 1 1 A 44 44 ASP CB C 44 39.991 39.589 0.402 1
1 495 . 4 1 1 A 44 44 ASP N N 44 115.453 118.203 -2.750 1
1 496 . 4 1 1 A 45 45 PRO HA H 45 4.652 4.598 0.054 1
1 503 . 4 1 1 A 45 45 PRO C C 45 176.914 175.422 1.492 1
1 504 . 4 1 1 A 45 45 PRO CA C 45 63.490 62.628 0.862 1
1 505 . 4 1 1 A 45 45 PRO CB C 45 34.892 32.694 2.198 1
1 508 . 4 1 1 A 46 46 ALA H H 46 8.112 8.276 -0.164 1
1 509 . 4 1 1 A 46 46 ALA HA H 46 5.455 4.657 0.798 1
1 513 . 4 1 1 A 46 46 ALA C C 46 177.234 176.679 0.555 1
1 514 . 4 1 1 A 46 46 ALA CA C 46 51.560 50.578 0.982 1
1 515 . 4 1 1 A 46 46 ALA CB C 46 20.122 19.813 0.309 1
1 516 . 4 1 1 A 46 46 ALA N N 46 120.155 123.055 -2.900 1
1 517 . 4 1 1 A 47 47 PHE H H 47 8.717 8.623 0.094 1
1 518 . 4 1 1 A 47 47 PHE HA H 47 4.795 4.839 -0.044 1
1 526 . 4 1 1 A 47 47 PHE C C 47 172.588 173.919 -1.331 1
1 527 . 4 1 1 A 47 47 PHE CA C 47 57.348 56.466 0.882 1
1 528 . 4 1 1 A 47 47 PHE CB C 47 47.123 43.615 3.508 1
1 534 . 4 1 1 A 47 47 PHE N N 47 129.946 119.527 10.419 1
1 535 . 4 1 1 A 48 48 LEU H H 48 7.883 8.347 -0.464 1
1 536 . 4 1 1 A 48 48 LEU HA H 48 5.198 5.239 -0.041 1
1 546 . 4 1 1 A 48 48 LEU C C 48 173.569 174.434 -0.865 1
1 547 . 4 1 1 A 48 48 LEU CA C 48 53.290 53.514 -0.224 1
1 548 . 4 1 1 A 48 48 LEU CB C 48 45.502 44.652 0.850 1
1 552 . 4 1 1 A 48 48 LEU N N 48 121.108 123.629 -2.521 1
1 553 . 4 1 1 A 49 49 HIS H H 49 8.606 8.882 -0.276 1
1 554 . 4 1 1 A 49 49 HIS HA H 49 5.035 4.870 0.165 1
1 559 . 4 1 1 A 49 49 HIS C C 49 173.993 173.542 0.451 1
1 560 . 4 1 1 A 49 49 HIS CA C 49 56.483 54.251 2.232 1
1 561 . 4 1 1 A 49 49 HIS CB C 49 35.919 33.343 2.576 1
1 564 . 4 1 1 A 49 49 HIS N N 49 121.199 125.823 -4.624 1
1 565 . 4 1 1 A 50 50 TYR H H 50 7.777 8.177 -0.400 1
1 566 . 4 1 1 A 50 50 TYR HA H 50 5.695 5.678 0.017 1
1 573 . 4 1 1 A 50 50 TYR C C 50 174.284 172.438 1.846 1
1 574 . 4 1 1 A 50 50 TYR CA C 50 53.430 55.113 -1.683 1
1 575 . 4 1 1 A 50 50 TYR CB C 50 38.552 41.476 -2.924 1
1 580 . 4 1 1 A 50 50 TYR N N 50 114.156 118.083 -3.927 1
1 581 . 4 1 1 A 51 51 TYR H H 51 9.323 9.589 -0.266 1
1 582 . 4 1 1 A 51 51 TYR HA H 51 4.600 5.113 -0.513 1
1 589 . 4 1 1 A 51 51 TYR C C 51 175.352 174.473 0.879 1
1 590 . 4 1 1 A 51 51 TYR CA C 51 57.330 56.163 1.167 1
1 591 . 4 1 1 A 51 51 TYR CB C 51 41.683 42.305 -0.622 1
1 596 . 4 1 1 A 51 51 TYR N N 51 119.100 119.617 -0.517 1
1 597 . 4 1 1 A 52 52 ASP H H 52 9.375 8.739 0.636 1
1 598 . 4 1 1 A 52 52 ASP HA H 52 5.064 4.919 0.145 1
1 601 . 4 1 1 A 52 52 ASP C C 52 175.484 175.700 -0.216 1
1 602 . 4 1 1 A 52 52 ASP CA C 52 51.313 51.432 -0.119 1
1 603 . 4 1 1 A 52 52 ASP CB C 52 41.883 42.241 -0.358 1
1 604 . 4 1 1 A 52 52 ASP N N 52 124.636 123.410 1.226 1
1 605 . 4 1 1 A 53 53 PRO HA H 53 4.678 4.644 0.034 1
1 612 . 4 1 1 A 53 53 PRO C C 53 176.781 177.183 -0.402 1
1 613 . 4 1 1 A 53 53 PRO CA C 53 64.054 63.995 0.059 1
1 614 . 4 1 1 A 53 53 PRO CB C 53 32.589 32.114 0.475 1
1 617 . 4 1 1 A 54 54 SER H H 54 8.685 8.261 0.424 1
1 618 . 4 1 1 A 54 54 SER HA H 54 4.483 4.602 -0.119 1
1 621 . 4 1 1 A 54 54 SER C C 54 174.006 174.672 -0.666 1
1 622 . 4 1 1 A 54 54 SER CA C 54 59.378 60.598 -1.220 1
1 623 . 4 1 1 A 54 54 SER CB C 54 64.132 64.542 -0.410 1
1 624 . 4 1 1 A 54 54 SER N N 54 113.769 113.254 0.515 1
1 625 . 4 1 1 A 55 55 LYS H H 55 7.706 8.729 -1.023 1
1 626 . 4 1 1 A 55 55 LYS HA H 55 4.580 4.454 0.126 1
1 635 . 4 1 1 A 55 55 LYS C C 55 175.969 175.399 0.570 1
1 636 . 4 1 1 A 55 55 LYS CA C 55 55.160 56.259 -1.099 1
1 637 . 4 1 1 A 55 55 LYS CB C 55 34.069 33.737 0.332 1
1 641 . 4 1 1 A 55 55 LYS N N 55 122.222 119.375 2.847 1
1 642 . 4 1 1 A 56 56 GLU H H 56 8.666 8.726 -0.060 1
1 643 . 4 1 1 A 56 56 GLU HA H 56 4.174 4.959 -0.785 1
1 648 . 4 1 1 A 56 56 GLU C C 56 177.084 174.613 2.471 1
1 649 . 4 1 1 A 56 56 GLU CA C 56 57.099 55.711 1.388 1
1 650 . 4 1 1 A 56 56 GLU CB C 56 29.694 31.967 -2.273 1
1 652 . 4 1 1 A 56 56 GLU N N 56 122.015 119.084 2.931 1
1 653 . 4 1 1 A 57 57 GLU H H 57 8.303 8.811 -0.508 1
1 654 . 4 1 1 A 57 57 GLU HA H 57 4.214 4.640 -0.426 1
1 659 . 4 1 1 A 57 57 GLU CA C 57 56.960 55.709 1.251 1
1 660 . 4 1 1 A 57 57 GLU CB C 57 30.264 34.039 -3.775 1
1 662 . 4 1 1 A 57 57 GLU N N 57 119.884 124.040 -4.156 1
1 663 . 4 1 1 A 58 58 ASN HA H 58 4.768 4.793 -0.025 1
1 668 . 4 1 1 A 58 58 ASN C C 58 174.902 173.836 1.066 1
1 669 . 4 1 1 A 58 58 ASN CA C 58 52.740 53.002 -0.262 1
1 670 . 4 1 1 A 58 58 ASN CB C 58 38.116 36.470 1.646 1
1 672 . 4 1 1 A 59 59 ARG H H 59 7.805 8.261 -0.456 1
1 673 . 4 1 1 A 59 59 ARG HA H 59 4.762 4.794 -0.032 1
1 680 . 4 1 1 A 59 59 ARG CA C 59 53.151 54.365 -1.214 1
1 681 . 4 1 1 A 59 59 ARG CB C 59 31.519 33.699 -2.180 1
1 684 . 4 1 1 A 59 59 ARG N N 59 121.060 122.373 -1.313 1
1 685 . 4 1 1 A 60 60 PRO HA H 60 3.357 4.109 -0.752 1
1 692 . 4 1 1 A 60 60 PRO C C 60 176.817 176.802 0.015 1
1 693 . 4 1 1 A 60 60 PRO CA C 60 63.031 61.889 1.142 1
1 694 . 4 1 1 A 60 60 PRO CB C 60 31.273 32.074 -0.801 1
1 697 . 4 1 1 A 61 61 VAL H H 61 8.627 8.624 0.003 1
1 698 . 4 1 1 A 61 61 VAL HA H 61 3.966 3.817 0.149 1
1 706 . 4 1 1 A 61 61 VAL C C 61 176.503 176.320 0.183 1
1 707 . 4 1 1 A 61 61 VAL CA C 61 63.154 64.848 -1.694 1
1 708 . 4 1 1 A 61 61 VAL CB C 61 32.048 32.377 -0.329 1
1 711 . 4 1 1 A 61 61 VAL N N 61 119.185 120.517 -1.332 1
1 712 . 4 1 1 A 62 62 GLY H H 62 6.715 6.777 -0.062 1
1 713 . 4 1 1 A 62 62 GLY HA2 H 62 3.940 3.877 0.063 1
1 714 . 4 1 1 A 62 62 GLY HA3 H 62 3.538 3.904 -0.366 1
1 715 . 4 1 1 A 62 62 GLY C C 62 169.983 172.426 -2.443 1
1 716 . 4 1 1 A 62 62 GLY CA C 62 44.465 45.666 -1.201 1
1 717 . 4 1 1 A 62 62 GLY N N 62 105.813 106.226 -0.413 1
1 718 . 4 1 1 A 63 63 GLY H H 63 8.004 8.140 -0.136 1
1 719 . 4 1 1 A 63 63 GLY HA2 H 63 4.095 3.376 0.719 1
1 720 . 4 1 1 A 63 63 GLY HA3 H 63 3.813 3.777 0.036 1
1 721 . 4 1 1 A 63 63 GLY C C 63 171.870 172.720 -0.850 1
1 722 . 4 1 1 A 63 63 GLY CA C 63 47.148 44.108 3.040 1
1 723 . 4 1 1 A 63 63 GLY N N 63 105.089 107.177 -2.088 1
1 724 . 4 1 1 A 64 64 PHE H H 64 7.967 7.757 0.210 1
1 725 . 4 1 1 A 64 64 PHE HA H 64 4.934 5.544 -0.610 1
1 733 . 4 1 1 A 64 64 PHE C C 64 173.140 174.253 -1.113 1
1 734 . 4 1 1 A 64 64 PHE CA C 64 55.248 55.409 -0.161 1
1 735 . 4 1 1 A 64 64 PHE CB C 64 40.238 42.064 -1.826 1
1 741 . 4 1 1 A 64 64 PHE N N 64 113.387 118.867 -5.480 1
1 742 . 4 1 1 A 65 65 SER H H 65 8.518 9.103 -0.585 1
1 743 . 4 1 1 A 65 65 SER HA H 65 3.264 4.458 -1.194 1
1 746 . 4 1 1 A 65 65 SER C C 65 176.417 174.138 2.279 1
1 747 . 4 1 1 A 65 65 SER CA C 65 56.819 58.025 -1.206 1
1 748 . 4 1 1 A 65 65 SER CB C 65 63.391 65.034 -1.643 1
1 749 . 4 1 1 A 65 65 SER N N 65 114.674 115.557 -0.883 1
1 750 . 4 1 1 A 66 66 LEU H H 66 7.404 8.207 -0.803 1
1 751 . 4 1 1 A 66 66 LEU HA H 66 4.470 4.417 0.053 1
1 761 . 4 1 1 A 66 66 LEU C C 66 177.993 178.080 -0.087 1
1 762 . 4 1 1 A 66 66 LEU CA C 66 54.242 55.695 -1.453 1
1 763 . 4 1 1 A 66 66 LEU CB C 66 42.787 43.330 -0.543 1
1 767 . 4 1 1 A 66 66 LEU N N 66 123.988 120.078 3.910 1
1 768 . 4 1 1 A 67 67 ARG H H 67 7.865 7.800 0.065 1
1 769 . 4 1 1 A 67 67 ARG HA H 67 4.175 3.938 0.237 1
1 776 . 4 1 1 A 67 67 ARG C C 67 178.562 177.982 0.580 1
1 777 . 4 1 1 A 67 67 ARG CA C 67 58.143 59.369 -1.226 1
1 778 . 4 1 1 A 67 67 ARG CB C 67 29.052 30.047 -0.995 1
1 781 . 4 1 1 A 67 67 ARG N N 67 122.494 117.998 4.496 1
1 782 . 4 1 1 A 68 68 GLY H H 68 9.398 8.068 1.330 1
1 783 . 4 1 1 A 68 68 GLY HA2 H 68 4.066 3.930 0.136 1
1 784 . 4 1 1 A 68 68 GLY HA3 H 68 3.908 3.936 -0.028 1
1 785 . 4 1 1 A 68 68 GLY C C 68 173.982 173.505 0.477 1
1 786 . 4 1 1 A 68 68 GLY CA C 68 46.230 46.504 -0.274 1
1 787 . 4 1 1 A 68 68 GLY N N 68 117.548 107.665 9.883 1
1 788 . 4 1 1 A 69 69 SER H H 69 7.829 7.534 0.295 1
1 789 . 4 1 1 A 69 69 SER HA H 69 4.807 5.208 -0.401 1
1 792 . 4 1 1 A 69 69 SER C C 69 172.854 172.773 0.081 1
1 793 . 4 1 1 A 69 69 SER CA C 69 59.290 57.486 1.804 1
1 794 . 4 1 1 A 69 69 SER CB C 69 65.366 67.972 -2.606 1
1 795 . 4 1 1 A 69 69 SER N N 69 115.188 114.492 0.696 1
1 796 . 4 1 1 A 70 70 LEU H H 70 8.805 8.606 0.199 1
1 797 . 4 1 1 A 70 70 LEU HA H 70 4.846 4.873 -0.027 1
1 807 . 4 1 1 A 70 70 LEU C C 70 175.775 174.089 1.686 1
1 808 . 4 1 1 A 70 70 LEU CA C 70 53.907 53.875 0.032 1
1 809 . 4 1 1 A 70 70 LEU CB C 70 45.337 45.698 -0.361 1
1 813 . 4 1 1 A 70 70 LEU N N 70 121.265 123.058 -1.793 1
1 814 . 4 1 1 A 71 71 VAL H H 71 8.644 8.813 -0.169 1
1 815 . 4 1 1 A 71 71 VAL HA H 71 5.555 5.167 0.388 1
1 823 . 4 1 1 A 71 71 VAL C C 71 173.636 173.467 0.169 1
1 824 . 4 1 1 A 71 71 VAL CA C 71 58.760 59.583 -0.823 1
1 825 . 4 1 1 A 71 71 VAL CB C 71 34.891 35.952 -1.061 1
1 828 . 4 1 1 A 71 71 VAL N N 71 122.315 122.508 -0.193 1
1 829 . 4 1 1 A 72 72 SER H H 72 8.750 9.001 -0.251 1
1 830 . 4 1 1 A 72 72 SER HA H 72 4.742 4.944 -0.202 1
1 833 . 4 1 1 A 72 72 SER C C 72 173.058 172.796 0.262 1
1 834 . 4 1 1 A 72 72 SER CA C 72 57.190 57.781 -0.591 1
1 835 . 4 1 1 A 72 72 SER CB C 72 65.612 67.253 -1.641 1
1 836 . 4 1 1 A 72 72 SER N N 72 118.611 120.922 -2.311 1
1 837 . 4 1 1 A 73 73 ALA H H 73 9.009 8.482 0.527 1
1 838 . 4 1 1 A 73 73 ALA HA H 73 4.406 4.924 -0.518 1
1 842 . 4 1 1 A 73 73 ALA C C 73 176.708 176.684 0.024 1
1 843 . 4 1 1 A 73 73 ALA CA C 73 52.672 51.132 1.540 1
1 844 . 4 1 1 A 73 73 ALA CB C 73 18.812 20.344 -1.532 1
1 845 . 4 1 1 A 73 73 ALA N N 73 125.694 126.096 -0.402 1
1 846 . 4 1 1 A 74 74 LEU H H 74 7.800 8.447 -0.647 1
1 847 . 4 1 1 A 74 74 LEU HA H 74 4.716 5.133 -0.417 1
1 857 . 4 1 1 A 74 74 LEU C C 74 176.551 175.655 0.896 1
1 858 . 4 1 1 A 74 74 LEU CA C 74 53.784 53.131 0.653 1
1 859 . 4 1 1 A 74 74 LEU CB C 74 43.446 45.009 -1.563 1
1 863 . 4 1 1 A 74 74 LEU N N 74 122.271 119.985 2.286 1
1 864 . 4 1 1 A 75 75 GLU H H 75 8.855 8.532 0.323 1
1 865 . 4 1 1 A 75 75 GLU HA H 75 4.336 4.757 -0.421 1
1 870 . 4 1 1 A 75 75 GLU C C 75 176.465 174.629 1.836 1
1 871 . 4 1 1 A 75 75 GLU CA C 75 56.507 56.665 -0.158 1
1 872 . 4 1 1 A 75 75 GLU CB C 75 30.245 33.000 -2.755 1
1 874 . 4 1 1 A 75 75 GLU N N 75 122.678 121.985 0.693 1
1 875 . 4 1 1 A 76 76 ASP H H 76 8.542 8.800 -0.258 1
1 876 . 4 1 1 A 76 76 ASP HA H 76 4.665 4.862 -0.197 1
1 879 . 4 1 1 A 76 76 ASP C C 76 176.087 175.687 0.400 1
1 880 . 4 1 1 A 76 76 ASP CA C 76 55.107 53.532 1.575 1
1 881 . 4 1 1 A 76 76 ASP CB C 76 41.431 40.688 0.743 1
1 882 . 4 1 1 A 76 76 ASP N N 76 121.488 123.447 -1.959 1
1 883 . 4 1 1 A 77 77 ASN H H 77 8.322 8.796 -0.474 1
1 884 . 4 1 1 A 77 77 ASN HA H 77 4.729 4.581 0.148 1
1 889 . 4 1 1 A 77 77 ASN C C 77 175.566 174.716 0.850 1
1 890 . 4 1 1 A 77 77 ASN CA C 77 53.131 55.107 -1.976 1
1 891 . 4 1 1 A 77 77 ASN CB C 77 38.617 37.798 0.819 1
1 892 . 4 1 1 A 77 77 ASN N N 77 118.676 123.433 -4.757 1
1 894 . 4 1 1 A 78 78 GLY H H 78 8.311 8.525 -0.214 1
1 895 . 4 1 1 A 78 78 GLY HA2 H 78 3.897 4.080 -0.183 1
1 896 . 4 1 1 A 78 78 GLY HA3 H 78 3.897 4.081 -0.184 1
1 897 . 4 1 1 A 78 78 GLY C C 78 173.376 174.191 -0.815 1
1 898 . 4 1 1 A 78 78 GLY CA C 78 45.224 46.067 -0.843 1
1 899 . 4 1 1 A 78 78 GLY N N 78 108.939 105.739 3.200 1
1 900 . 4 1 1 A 79 79 VAL H H 79 7.882 7.891 -0.009 1
1 901 . 4 1 1 A 79 79 VAL HA H 79 4.345 4.260 0.085 1
1 909 . 4 1 1 A 79 79 VAL CA C 79 59.995 60.914 -0.919 1
1 910 . 4 1 1 A 79 79 VAL CB C 79 32.589 32.241 0.348 1
1 913 . 4 1 1 A 79 79 VAL N N 79 121.135 119.164 1.971 1
1 914 . 4 1 1 A 80 80 PRO HA H 80 4.461 4.460 0.001 1
1 921 . 4 1 1 A 80 80 PRO C C 80 176.979 177.262 -0.283 1
1 922 . 4 1 1 A 80 80 PRO CA C 80 63.101 65.716 -2.615 1
1 923 . 4 1 1 A 80 80 PRO CB C 80 32.177 31.909 0.268 1
1 926 . 4 1 1 A 81 81 THR H H 81 8.281 7.864 0.417 1
1 927 . 4 1 1 A 81 81 THR HA H 81 4.095 4.584 -0.489 1
1 932 . 4 1 1 A 81 81 THR C C 81 175.270 174.711 0.559 1
1 933 . 4 1 1 A 81 81 THR CA C 81 62.872 63.304 -0.432 1
1 934 . 4 1 1 A 81 81 THR CB C 81 69.642 70.726 -1.084 1
1 936 . 4 1 1 A 81 81 THR N N 81 114.684 109.973 4.711 1
1 937 . 4 1 1 A 82 82 GLY H H 82 8.338 7.959 0.379 1
1 938 . 4 1 1 A 82 82 GLY HA2 H 82 4.095 3.874 0.221 1
1 939 . 4 1 1 A 82 82 GLY HA3 H 82 3.668 3.904 -0.236 1
1 940 . 4 1 1 A 82 82 GLY C C 82 174.139 172.718 1.421 1
1 941 . 4 1 1 A 82 82 GLY CA C 82 45.083 46.717 -1.634 1
1 942 . 4 1 1 A 82 82 GLY N N 82 111.289 108.308 2.981 1
1 943 . 4 1 1 A 83 83 VAL H H 83 7.668 8.106 -0.438 1
1 944 . 4 1 1 A 83 83 VAL HA H 83 3.985 4.499 -0.514 1
1 952 . 4 1 1 A 83 83 VAL C C 83 176.054 175.503 0.551 1
1 953 . 4 1 1 A 83 83 VAL CA C 83 62.431 61.252 1.179 1
1 954 . 4 1 1 A 83 83 VAL CB C 83 32.260 34.135 -1.875 1
1 957 . 4 1 1 A 83 83 VAL N N 83 120.003 120.403 -0.400 1
1 958 . 4 1 1 A 84 84 LYS H H 84 8.645 8.607 0.038 1
1 959 . 4 1 1 A 84 84 LYS HA H 84 4.276 4.085 0.191 1
1 968 . 4 1 1 A 84 84 LYS C C 84 176.832 176.932 -0.100 1
1 969 . 4 1 1 A 84 84 LYS CA C 84 56.272 56.454 -0.182 1
1 970 . 4 1 1 A 84 84 LYS CB C 84 32.876 32.702 0.174 1
1 974 . 4 1 1 A 84 84 LYS N N 84 126.447 127.577 -1.130 1
1 975 . 4 1 1 A 85 85 GLY H H 85 8.410 8.828 -0.418 1
1 976 . 4 1 1 A 85 85 GLY HA2 H 85 4.066 3.821 0.245 1
1 977 . 4 1 1 A 85 85 GLY HA3 H 85 3.781 3.831 -0.050 1
1 978 . 4 1 1 A 85 85 GLY C C 85 173.969 173.266 0.703 1
1 979 . 4 1 1 A 85 85 GLY CA C 85 45.146 47.305 -2.159 1
1 980 . 4 1 1 A 85 85 GLY N N 85 109.957 110.316 -0.359 1
1 981 . 4 1 1 A 86 86 ASN H H 86 8.298 7.805 0.493 1
1 982 . 4 1 1 A 86 86 ASN HA H 86 4.665 5.086 -0.421 1
1 987 . 4 1 1 A 86 86 ASN C C 86 174.987 174.193 0.794 1
1 988 . 4 1 1 A 86 86 ASN CA C 86 52.989 52.270 0.719 1
1 989 . 4 1 1 A 86 86 ASN CB C 86 38.376 40.922 -2.546 1
1 990 . 4 1 1 A 86 86 ASN N N 86 118.457 117.885 0.572 1
1 992 . 4 1 1 A 87 87 VAL H H 87 7.660 8.644 -0.984 1
1 993 . 4 1 1 A 87 87 VAL HA H 87 3.946 4.457 -0.511 1
1 1001 . 4 1 1 A 87 87 VAL C C 87 174.902 176.604 -1.702 1
1 1002 . 4 1 1 A 87 87 VAL CA C 87 62.307 62.083 0.224 1
1 1003 . 4 1 1 A 87 87 VAL CB C 87 32.548 33.920 -1.372 1
1 1006 . 4 1 1 A 87 87 VAL N N 87 120.557 118.677 1.880 1
1 1007 . 4 1 1 A 88 88 GLN H H 88 8.115 8.383 -0.268 1
1 1008 . 4 1 1 A 88 88 GLN HA H 88 4.302 4.145 0.157 1
1 1015 . 4 1 1 A 88 88 GLN C C 88 175.637 176.330 -0.693 1
1 1016 . 4 1 1 A 88 88 GLN CA C 88 55.336 58.010 -2.674 1
1 1017 . 4 1 1 A 88 88 GLN CB C 88 30.574 28.824 1.750 1
1 1019 . 4 1 1 A 88 88 GLN N N 88 122.280 122.040 0.240 1
1 1021 . 4 1 1 A 89 89 GLY H H 89 8.544 7.187 1.357 1
1 1022 . 4 1 1 A 89 89 GLY HA2 H 89 3.885 4.032 -0.147 1
1 1023 . 4 1 1 A 89 89 GLY HA3 H 89 3.885 4.042 -0.157 1
1 1024 . 4 1 1 A 89 89 GLY C C 89 172.861 173.044 -0.183 1
1 1025 . 4 1 1 A 89 89 GLY CA C 89 44.889 45.720 -0.831 1
1 1026 . 4 1 1 A 89 89 GLY N N 89 110.135 103.572 6.563 1
1 1027 . 4 1 1 A 90 90 ASN H H 90 8.451 8.781 -0.330 1
1 1028 . 4 1 1 A 90 90 ASN HA H 90 4.222 4.229 -0.007 1
1 1033 . 4 1 1 A 90 90 ASN C C 90 174.926 174.414 0.512 1
1 1034 . 4 1 1 A 90 90 ASN CA C 90 54.613 54.028 0.585 1
1 1035 . 4 1 1 A 90 90 ASN CB C 90 37.852 37.121 0.731 1
1 1036 . 4 1 1 A 90 90 ASN N N 90 114.322 116.987 -2.665 1
1 1038 . 4 1 1 A 91 91 LEU H H 91 8.933 7.646 1.287 1
1 1039 . 4 1 1 A 91 91 LEU HA H 91 5.367 4.869 0.498 1
1 1049 . 4 1 1 A 91 91 LEU C C 91 178.732 175.538 3.194 1
1 1050 . 4 1 1 A 91 91 LEU CA C 91 55.160 53.370 1.790 1
1 1051 . 4 1 1 A 91 91 LEU CB C 91 45.461 43.781 1.680 1
1 1055 . 4 1 1 A 91 91 LEU N N 91 120.057 118.823 1.234 1
1 1056 . 4 1 1 A 92 92 PHE H H 92 9.901 8.164 1.737 1
1 1057 . 4 1 1 A 92 92 PHE HA H 92 5.105 5.119 -0.014 1
1 1065 . 4 1 1 A 92 92 PHE C C 92 170.140 172.616 -2.476 1
1 1066 . 4 1 1 A 92 92 PHE CA C 92 56.236 56.108 0.128 1
1 1067 . 4 1 1 A 92 92 PHE CB C 92 42.664 41.217 1.447 1
1 1073 . 4 1 1 A 92 92 PHE N N 92 119.740 116.738 3.002 1
1 1074 . 4 1 1 A 93 93 LYS H H 93 9.154 9.316 -0.162 1
1 1075 . 4 1 1 A 93 93 LYS HA H 93 5.584 5.436 0.148 1
1 1083 . 4 1 1 A 93 93 LYS C C 93 174.830 175.206 -0.376 1
1 1084 . 4 1 1 A 93 93 LYS CA C 93 53.148 53.931 -0.783 1
1 1085 . 4 1 1 A 93 93 LYS CB C 93 36.660 36.197 0.463 1
1 1089 . 4 1 1 A 93 93 LYS N N 93 117.710 118.525 -0.815 1
1 1090 . 4 1 1 A 94 94 VAL H H 94 8.507 8.516 -0.009 1
1 1091 . 4 1 1 A 94 94 VAL HA H 94 4.872 5.205 -0.333 1
1 1099 . 4 1 1 A 94 94 VAL C C 94 174.408 174.630 -0.222 1
1 1100 . 4 1 1 A 94 94 VAL CA C 94 60.525 61.140 -0.615 1
1 1101 . 4 1 1 A 94 94 VAL CB C 94 34.862 34.635 0.227 1
1 1104 . 4 1 1 A 94 94 VAL N N 94 121.741 120.532 1.209 1
1 1105 . 4 1 1 A 95 95 ILE H H 95 8.959 9.158 -0.199 1
1 1106 . 4 1 1 A 95 95 ILE HA H 95 4.794 5.409 -0.615 1
1 1116 . 4 1 1 A 95 95 ILE C C 95 177.642 176.274 1.368 1
1 1117 . 4 1 1 A 95 95 ILE CA C 95 59.713 60.430 -0.717 1
1 1118 . 4 1 1 A 95 95 ILE CB C 95 40.032 38.702 1.330 1
1 1122 . 4 1 1 A 95 95 ILE N N 95 126.794 129.069 -2.275 1
1 1123 . 4 1 1 A 96 96 THR H H 96 8.765 8.851 -0.086 1
1 1124 . 4 1 1 A 96 96 THR HA H 96 4.584 4.864 -0.280 1
1 1129 . 4 1 1 A 96 96 THR C C 96 177.023 176.417 0.606 1
1 1130 . 4 1 1 A 96 96 THR CA C 96 61.372 60.675 0.697 1
1 1131 . 4 1 1 A 96 96 THR CB C 96 70.794 71.825 -1.031 1
1 1133 . 4 1 1 A 96 96 THR N N 96 117.225 120.303 -3.078 1
1 1134 . 4 1 1 A 97 97 LYS H H 97 8.736 8.705 0.031 1
1 1135 . 4 1 1 A 97 97 LYS HA H 97 4.101 4.090 0.011 1
1 1144 . 4 1 1 A 97 97 LYS C C 97 176.490 177.037 -0.547 1
1 1145 . 4 1 1 A 97 97 LYS CA C 97 58.583 58.739 -0.156 1
1 1146 . 4 1 1 A 97 97 LYS CB C 97 31.848 32.126 -0.278 1
1 1150 . 4 1 1 A 97 97 LYS N N 97 120.457 119.827 0.630 1
1 1151 . 4 1 1 A 98 98 ASP H H 98 7.762 7.975 -0.213 1
1 1152 . 4 1 1 A 98 98 ASP HA H 98 4.633 4.807 -0.174 1
1 1155 . 4 1 1 A 98 98 ASP C C 98 175.270 175.043 0.227 1
1 1156 . 4 1 1 A 98 98 ASP CA C 98 53.272 53.920 -0.648 1
1 1157 . 4 1 1 A 98 98 ASP CB C 98 39.909 41.054 -1.145 1
1 1158 . 4 1 1 A 98 98 ASP N N 98 116.281 119.519 -3.238 1
1 1159 . 4 1 1 A 99 99 ASP H H 99 8.340 8.748 -0.408 1
1 1160 . 4 1 1 A 99 99 ASP HA H 99 4.245 4.335 -0.090 1
1 1163 . 4 1 1 A 99 99 ASP C C 99 175.315 174.743 0.572 1
1 1164 . 4 1 1 A 99 99 ASP CA C 99 55.989 55.345 0.644 1
1 1165 . 4 1 1 A 99 99 ASP CB C 99 39.827 39.838 -0.011 1
1 1166 . 4 1 1 A 99 99 ASP N N 99 116.687 118.077 -1.390 1
1 1167 . 4 1 1 A 100 100 THR H H 100 7.511 7.539 -0.028 1
1 1168 . 4 1 1 A 100 100 THR HA H 100 4.185 4.263 -0.078 1
1 1173 . 4 1 1 A 100 100 THR C C 100 173.376 173.861 -0.485 1
1 1174 . 4 1 1 A 100 100 THR CA C 100 63.489 61.985 1.504 1
1 1175 . 4 1 1 A 100 100 THR CB C 100 67.909 69.563 -1.654 1
1 1177 . 4 1 1 A 100 100 THR N N 100 116.525 113.979 2.546 1
1 1178 . 4 1 1 A 101 101 HIS H H 101 8.753 9.053 -0.300 1
1 1179 . 4 1 1 A 101 101 HIS HA H 101 4.898 5.052 -0.154 1
1 1184 . 4 1 1 A 101 101 HIS C C 101 174.345 174.068 0.277 1
1 1185 . 4 1 1 A 101 101 HIS CA C 101 55.072 54.636 0.436 1
1 1186 . 4 1 1 A 101 101 HIS CB C 101 32.835 30.042 2.793 1
1 1189 . 4 1 1 A 101 101 HIS N N 101 125.953 126.311 -0.358 1
1 1190 . 4 1 1 A 102 102 TYR H H 102 9.023 9.253 -0.230 1
1 1191 . 4 1 1 A 102 102 TYR HA H 102 4.545 4.966 -0.421 1
1 1198 . 4 1 1 A 102 102 TYR C C 102 174.126 174.998 -0.872 1
1 1199 . 4 1 1 A 102 102 TYR CA C 102 57.260 56.722 0.538 1
1 1200 . 4 1 1 A 102 102 TYR CB C 102 40.381 38.199 2.182 1
1 1205 . 4 1 1 A 102 102 TYR N N 102 121.975 124.152 -2.177 1
1 1206 . 4 1 1 A 103 103 TYR H H 103 8.899 9.073 -0.174 1
1 1207 . 4 1 1 A 103 103 TYR HA H 103 4.729 4.801 -0.072 1
1 1214 . 4 1 1 A 103 103 TYR C C 103 174.139 176.073 -1.934 1
1 1215 . 4 1 1 A 103 103 TYR CA C 103 58.036 58.446 -0.410 1
1 1216 . 4 1 1 A 103 103 TYR CB C 103 40.485 39.000 1.485 1
1 1221 . 4 1 1 A 103 103 TYR N N 103 122.012 124.628 -2.616 1
1 1222 . 4 1 1 A 104 104 ILE H H 104 8.605 8.791 -0.186 1
1 1223 . 4 1 1 A 104 104 ILE HA H 104 4.859 4.915 -0.056 1
1 1233 . 4 1 1 A 104 104 ILE C C 104 172.769 173.208 -0.439 1
1 1234 . 4 1 1 A 104 104 ILE CA C 104 59.554 59.294 0.260 1
1 1235 . 4 1 1 A 104 104 ILE CB C 104 40.631 41.292 -0.661 1
1 1239 . 4 1 1 A 104 104 ILE N N 104 123.443 123.508 -0.065 1
1 1240 . 4 1 1 A 105 105 GLN H H 105 9.369 8.672 0.697 1
1 1241 . 4 1 1 A 105 105 GLN HA H 105 4.895 4.942 -0.047 1
1 1248 . 4 1 1 A 105 105 GLN C C 105 175.642 175.126 0.516 1
1 1249 . 4 1 1 A 105 105 GLN CA C 105 54.965 53.790 1.175 1
1 1250 . 4 1 1 A 105 105 GLN CB C 105 32.856 31.001 1.855 1
1 1252 . 4 1 1 A 105 105 GLN N N 105 125.079 125.562 -0.483 1
1 1254 . 4 1 1 A 106 106 ALA H H 106 8.513 8.492 0.021 1
1 1255 . 4 1 1 A 106 106 ALA HA H 106 4.962 4.754 0.208 1
1 1259 . 4 1 1 A 106 106 ALA C C 106 175.854 177.999 -2.145 1
1 1260 . 4 1 1 A 106 106 ALA CA C 106 50.272 50.400 -0.128 1
1 1261 . 4 1 1 A 106 106 ALA CB C 106 21.197 21.628 -0.431 1
1 1262 . 4 1 1 A 106 106 ALA N N 106 129.303 128.396 0.907 1
1 1263 . 4 1 1 A 107 107 SER H H 107 9.468 8.941 0.527 1
1 1264 . 4 1 1 A 107 107 SER HA H 107 4.447 4.242 0.205 1
1 1267 . 4 1 1 A 107 107 SER C C 107 173.785 173.511 0.274 1
1 1268 . 4 1 1 A 107 107 SER CA C 107 60.048 61.562 -1.514 1
1 1269 . 4 1 1 A 107 107 SER CB C 107 64.643 63.345 1.298 1
1 1270 . 4 1 1 A 107 107 SER N N 107 112.962 116.385 -3.423 1
1 1271 . 4 1 1 A 108 108 SER H H 108 7.555 7.903 -0.348 1
1 1272 . 4 1 1 A 108 108 SER HA H 108 4.665 4.866 -0.201 1
1 1275 . 4 1 1 A 108 108 SER C C 108 174.381 174.734 -0.353 1
1 1276 . 4 1 1 A 108 108 SER CA C 108 56.907 56.736 0.171 1
1 1277 . 4 1 1 A 108 108 SER CB C 108 66.370 66.808 -0.438 1
1 1278 . 4 1 1 A 108 108 SER N N 108 112.243 112.576 -0.333 1
1 1279 . 4 1 1 A 109 109 LYS H H 109 8.978 8.717 0.261 1
1 1280 . 4 1 1 A 109 109 LYS HA H 109 4.777 3.934 0.843 1
1 1287 . 4 1 1 A 109 109 LYS C C 109 179.992 177.691 2.301 1
1 1288 . 4 1 1 A 109 109 LYS CA C 109 59.766 59.256 0.510 1
1 1289 . 4 1 1 A 109 109 LYS CB C 109 32.342 32.070 0.272 1
1 1293 . 4 1 1 A 109 109 LYS N N 109 123.170 124.811 -1.641 1
1 1294 . 4 1 1 A 110 110 ALA H H 110 8.608 8.108 0.500 1
1 1295 . 4 1 1 A 110 110 ALA HA H 110 4.178 4.067 0.111 1
1 1299 . 4 1 1 A 110 110 ALA C C 110 179.895 179.352 0.543 1
1 1300 . 4 1 1 A 110 110 ALA CA C 110 54.871 55.435 -0.564 1
1 1301 . 4 1 1 A 110 110 ALA CB C 110 18.065 18.698 -0.633 1
1 1302 . 4 1 1 A 110 110 ALA N N 110 123.750 121.873 1.877 1
1 1303 . 4 1 1 A 111 111 GLU H H 111 8.185 8.274 -0.089 1
1 1304 . 4 1 1 A 111 111 GLU HA H 111 4.180 4.045 0.135 1
1 1309 . 4 1 1 A 111 111 GLU C C 111 178.587 178.949 -0.362 1
1 1310 . 4 1 1 A 111 111 GLU CA C 111 59.466 59.765 -0.299 1
1 1311 . 4 1 1 A 111 111 GLU CB C 111 31.067 29.401 1.666 1
1 1313 . 4 1 1 A 111 111 GLU N N 111 119.757 118.774 0.983 1
1 1314 . 4 1 1 A 112 112 ARG H H 112 8.008 7.770 0.238 1
1 1315 . 4 1 1 A 112 112 ARG HA H 112 3.642 4.181 -0.539 1
1 1322 . 4 1 1 A 112 112 ARG C C 112 176.481 178.210 -1.729 1
1 1323 . 4 1 1 A 112 112 ARG CA C 112 60.419 59.749 0.670 1
1 1324 . 4 1 1 A 112 112 ARG CB C 112 29.957 30.223 -0.266 1
1 1327 . 4 1 1 A 112 112 ARG N N 112 118.430 119.907 -1.477 1
1 1328 . 4 1 1 A 113 113 ALA H H 113 7.985 7.671 0.314 1
1 1329 . 4 1 1 A 113 113 ALA HA H 113 3.925 4.071 -0.146 1
1 1333 . 4 1 1 A 113 113 ALA C C 113 180.117 179.830 0.287 1
1 1334 . 4 1 1 A 113 113 ALA CA C 113 55.372 55.085 0.287 1
1 1335 . 4 1 1 A 113 113 ALA CB C 113 17.825 18.542 -0.717 1
1 1336 . 4 1 1 A 113 113 ALA N N 113 119.980 120.599 -0.619 1
1 1337 . 4 1 1 A 114 114 GLU H H 114 8.093 8.155 -0.062 1
1 1338 . 4 1 1 A 114 114 GLU HA H 114 3.936 3.914 0.022 1
1 1343 . 4 1 1 A 114 114 GLU C C 114 180.586 179.222 1.364 1
1 1344 . 4 1 1 A 114 114 GLU CA C 114 59.148 59.245 -0.097 1
1 1345 . 4 1 1 A 114 114 GLU CB C 114 30.080 29.201 0.879 1
1 1347 . 4 1 1 A 114 114 GLU N N 114 117.168 117.803 -0.635 1
1 1348 . 4 1 1 A 115 115 TRP H H 115 7.980 9.058 -1.078 1
1 1349 . 4 1 1 A 115 115 TRP HA H 115 3.775 4.378 -0.603 1
1 1358 . 4 1 1 A 115 115 TRP C C 115 177.714 178.710 -0.996 1
1 1359 . 4 1 1 A 115 115 TRP CA C 115 62.696 59.485 3.211 1
1 1360 . 4 1 1 A 115 115 TRP CB C 115 29.052 28.936 0.116 1
1 1366 . 4 1 1 A 115 115 TRP N N 115 120.974 120.717 0.257 1
1 1368 . 4 1 1 A 116 116 ILE H H 116 8.297 8.657 -0.360 1
1 1369 . 4 1 1 A 116 116 ILE HA H 116 3.270 3.448 -0.178 1
1 1379 . 4 1 1 A 116 116 ILE C C 116 177.568 177.619 -0.051 1
1 1380 . 4 1 1 A 116 116 ILE CA C 116 66.643 64.335 2.308 1
1 1381 . 4 1 1 A 116 116 ILE CB C 116 37.606 37.452 0.154 1
1 1385 . 4 1 1 A 116 116 ILE N N 116 118.408 120.561 -2.153 1
1 1386 . 4 1 1 A 117 117 GLU H H 117 8.026 8.925 -0.899 1
1 1387 . 4 1 1 A 117 117 GLU HA H 117 3.880 3.943 -0.063 1
1 1392 . 4 1 1 A 117 117 GLU C C 117 178.476 178.955 -0.479 1
1 1393 . 4 1 1 A 117 117 GLU CA C 117 59.219 59.715 -0.496 1
1 1394 . 4 1 1 A 117 117 GLU CB C 117 29.381 29.418 -0.037 1
1 1396 . 4 1 1 A 117 117 GLU N N 117 117.096 120.277 -3.181 1
1 1397 . 4 1 1 A 118 118 ALA H H 118 7.555 7.928 -0.373 1
1 1398 . 4 1 1 A 118 118 ALA HA H 118 3.952 4.039 -0.087 1
1 1402 . 4 1 1 A 118 118 ALA C C 118 179.862 179.936 -0.074 1
1 1403 . 4 1 1 A 118 118 ALA CA C 118 54.772 55.031 -0.259 1
1 1404 . 4 1 1 A 118 118 ALA CB C 118 18.277 18.393 -0.116 1
1 1405 . 4 1 1 A 118 118 ALA N N 118 119.817 121.814 -1.997 1
1 1406 . 4 1 1 A 119 119 ILE H H 119 8.167 7.912 0.255 1
1 1407 . 4 1 1 A 119 119 ILE HA H 119 3.558 3.719 -0.161 1
1 1417 . 4 1 1 A 119 119 ILE C C 119 178.564 177.818 0.746 1
1 1418 . 4 1 1 A 119 119 ILE CA C 119 65.766 65.240 0.526 1
1 1419 . 4 1 1 A 119 119 ILE CB C 119 38.840 37.864 0.976 1
1 1423 . 4 1 1 A 119 119 ILE N N 119 116.280 117.741 -1.461 1
1 1424 . 4 1 1 A 120 120 LYS H H 120 8.790 8.016 0.774 1
1 1425 . 4 1 1 A 120 120 LYS HA H 120 3.965 4.105 -0.140 1
1 1434 . 4 1 1 A 120 120 LYS C C 120 179.673 179.242 0.431 1
1 1435 . 4 1 1 A 120 120 LYS CA C 120 60.031 60.339 -0.308 1
1 1436 . 4 1 1 A 120 120 LYS CB C 120 32.547 32.298 0.249 1
1 1440 . 4 1 1 A 120 120 LYS N N 120 119.650 118.995 0.655 1
1 1441 . 4 1 1 A 121 121 LYS H H 121 7.594 7.897 -0.303 1
1 1442 . 4 1 1 A 121 121 LYS HA H 121 4.095 3.954 0.141 1
1 1451 . 4 1 1 A 121 121 LYS C C 121 177.962 179.135 -1.173 1
1 1452 . 4 1 1 A 121 121 LYS CA C 121 58.848 59.166 -0.318 1
1 1453 . 4 1 1 A 121 121 LYS CB C 121 32.547 32.189 0.358 1
1 1457 . 4 1 1 A 121 121 LYS N N 121 117.197 119.626 -2.429 1
1 1458 . 4 1 1 A 122 122 LEU H H 122 7.586 7.792 -0.206 1
1 1459 . 4 1 1 A 122 122 LEU HA H 122 4.535 3.979 0.556 1
1 1469 . 4 1 1 A 122 122 LEU C C 122 177.902 177.996 -0.094 1
1 1470 . 4 1 1 A 122 122 LEU CA C 122 55.071 57.925 -2.854 1
1 1471 . 4 1 1 A 122 122 LEU CB C 122 42.888 41.805 1.083 1
1 1475 . 4 1 1 A 122 122 LEU N N 122 116.861 120.040 -3.179 1
1 1476 . 4 1 1 A 123 123 THR H H 123 7.636 7.881 -0.245 1
1 1477 . 4 1 1 A 123 123 THR HA H 123 4.445 4.353 0.092 1
1 1482 . 4 1 1 A 123 123 THR C C 123 175.714 174.660 1.054 1
1 1483 . 4 1 1 A 123 123 THR CA C 123 62.643 61.572 1.071 1
1 1484 . 4 1 1 A 123 123 THR CB C 123 70.259 67.888 2.371 1
1 1486 . 4 1 1 A 123 123 THR N N 123 108.963 108.033 0.930 1
1 1487 . 4 1 1 A 124 124 SER H H 124 7.912 8.508 -0.596 1
1 1488 . 4 1 1 A 124 124 SER HA H 124 4.626 4.105 0.521 1
1 1491 . 4 1 1 A 124 124 SER C C 124 174.405 173.616 0.789 1
1 1492 . 4 1 1 A 124 124 SER CA C 124 58.390 59.362 -0.972 1
1 1493 . 4 1 1 A 124 124 SER CB C 124 64.255 62.285 1.970 1
1 1494 . 4 1 1 A 124 124 SER N N 124 116.876 116.011 0.865 1
1 1495 . 4 1 1 A 125 125 GLY H H 125 8.307 8.105 0.202 1
1 1496 . 4 1 1 A 125 125 GLY HA2 H 125 4.166 4.188 -0.022 1
1 1497 . 4 1 1 A 125 125 GLY HA3 H 125 4.166 4.190 -0.024 1
1 1498 . 4 1 1 A 125 125 GLY C C 125 171.921 172.540 -0.619 1
1 1499 . 4 1 1 A 125 125 GLY CA C 125 44.748 45.606 -0.858 1
1 1500 . 4 1 1 A 125 125 GLY N N 125 110.006 112.916 -2.910 1
1 1501 . 4 1 1 A 126 126 PRO HA H 126 4.510 4.360 0.150 1
1 1508 . 4 1 1 A 126 126 PRO C C 126 177.471 177.027 0.444 1
1 1509 . 4 1 1 A 126 126 PRO CA C 126 63.419 63.439 -0.020 1
1 1510 . 4 1 1 A 126 126 PRO CB C 126 32.106 31.345 0.761 1
1 1513 . 4 1 1 A 127 127 SER H H 127 8.607 8.630 -0.023 1
1 1514 . 4 1 1 A 127 127 SER C C 127 174.628 174.142 0.486 1
1 1515 . 4 1 1 A 127 127 SER CA C 127 58.513 58.756 -0.243 1
1 1516 . 4 1 1 A 127 127 SER CB C 127 63.679 61.826 1.853 1
1 1517 . 4 1 1 A 127 127 SER N N 127 116.390 113.542 2.848 1
1 1518 . 4 1 1 A 128 128 SER H H 128 8.272 8.060 0.212 1
1 1519 . 4 1 1 A 128 128 SER HA H 128 4.496 4.677 -0.181 1
1 1520 . 4 1 1 A 128 128 SER C C 128 173.921 174.945 -1.024 1
1 1521 . 4 1 1 A 128 128 SER CA C 128 58.442 58.638 -0.196 1
1 1522 . 4 1 1 A 128 128 SER CB C 128 64.173 64.532 -0.359 1
1 1523 . 4 1 1 A 128 128 SER N N 128 117.506 114.757 2.749 1
1 1 . 5 1 1 A 7 7 GLY HA2 H 7 3.978 4.235 -0.257 1
1 2 . 5 1 1 A 7 7 GLY HA3 H 7 3.978 4.237 -0.259 1
1 3 . 5 1 1 A 7 7 GLY C C 7 174.274 173.045 1.229 1
1 4 . 5 1 1 A 7 7 GLY CA C 7 45.383 45.448 -0.065 1
1 5 . 5 1 1 A 8 8 SER H H 8 8.211 8.642 -0.431 1
1 6 . 5 1 1 A 8 8 SER HA H 8 4.425 4.036 0.389 1
1 9 . 5 1 1 A 8 8 SER C C 8 174.635 173.032 1.603 1
1 10 . 5 1 1 A 8 8 SER CA C 8 58.425 58.870 -0.445 1
1 11 . 5 1 1 A 8 8 SER CB C 8 63.885 61.961 1.924 1
1 12 . 5 1 1 A 8 8 SER N N 8 115.732 113.920 1.812 1
1 13 . 5 1 1 A 9 9 LEU H H 9 8.316 7.946 0.370 1
1 14 . 5 1 1 A 9 9 LEU HA H 9 4.334 4.708 -0.374 1
1 24 . 5 1 1 A 9 9 LEU C C 9 177.447 175.220 2.227 1
1 25 . 5 1 1 A 9 9 LEU CA C 9 55.407 54.323 1.084 1
1 26 . 5 1 1 A 9 9 LEU CB C 9 42.171 44.403 -2.232 1
1 30 . 5 1 1 A 9 9 LEU N N 9 123.943 126.521 -2.578 1
1 31 . 5 1 1 A 10 10 SER H H 10 8.304 8.682 -0.378 1
1 32 . 5 1 1 A 10 10 SER HA H 10 4.424 4.239 0.185 1
1 35 . 5 1 1 A 10 10 SER C C 10 175.025 174.966 0.059 1
1 36 . 5 1 1 A 10 10 SER CA C 10 58.425 60.046 -1.621 1
1 37 . 5 1 1 A 10 10 SER CB C 10 63.638 63.105 0.533 1
1 38 . 5 1 1 A 10 10 SER N N 10 116.718 123.391 -6.673 1
1 39 . 5 1 1 A 11 11 THR H H 11 8.003 8.499 -0.496 1
1 40 . 5 1 1 A 11 11 THR HA H 11 4.196 4.253 -0.057 1
1 45 . 5 1 1 A 11 11 THR C C 11 176.296 174.151 2.145 1
1 46 . 5 1 1 A 11 11 THR CA C 11 62.483 63.872 -1.389 1
1 47 . 5 1 1 A 11 11 THR CB C 11 69.266 69.475 -0.209 1
1 49 . 5 1 1 A 11 11 THR N N 11 114.902 121.945 -7.043 1
1 50 . 5 1 1 A 12 12 VAL H H 12 8.095 8.370 -0.275 1
1 51 . 5 1 1 A 12 12 VAL HA H 12 3.826 4.328 -0.502 1
1 59 . 5 1 1 A 12 12 VAL C C 12 178.501 176.770 1.731 1
1 60 . 5 1 1 A 12 12 VAL CA C 12 64.760 63.332 1.428 1
1 61 . 5 1 1 A 12 12 VAL CB C 12 32.013 32.800 -0.787 1
1 64 . 5 1 1 A 12 12 VAL N N 12 122.111 122.357 -0.246 1
1 65 . 5 1 1 A 13 13 GLU H H 13 8.151 8.773 -0.622 1
1 66 . 5 1 1 A 13 13 GLU HA H 13 3.244 3.522 -0.278 1
1 71 . 5 1 1 A 13 13 GLU C C 13 175.702 178.535 -2.833 1
1 72 . 5 1 1 A 13 13 GLU CA C 13 58.354 59.089 -0.735 1
1 73 . 5 1 1 A 13 13 GLU CB C 13 28.843 28.272 0.571 1
1 75 . 5 1 1 A 13 13 GLU N N 13 120.316 122.874 -2.558 1
1 76 . 5 1 1 A 14 14 LEU H H 14 7.067 7.602 -0.535 1
1 77 . 5 1 1 A 14 14 LEU HA H 14 4.157 4.108 0.049 1
1 87 . 5 1 1 A 14 14 LEU C C 14 176.863 177.651 -0.788 1
1 88 . 5 1 1 A 14 14 LEU CA C 14 53.324 55.580 -2.256 1
1 89 . 5 1 1 A 14 14 LEU CB C 14 41.636 41.422 0.214 1
1 93 . 5 1 1 A 14 14 LEU N N 14 117.035 120.100 -3.065 1
1 94 . 5 1 1 A 15 15 SER H H 15 7.645 7.729 -0.084 1
1 95 . 5 1 1 A 15 15 SER HA H 15 4.305 4.454 -0.149 1
1 98 . 5 1 1 A 15 15 SER C C 15 175.340 174.030 1.310 1
1 99 . 5 1 1 A 15 15 SER CA C 15 59.783 57.443 2.340 1
1 100 . 5 1 1 A 15 15 SER CB C 15 64.625 62.605 2.020 1
1 101 . 5 1 1 A 15 15 SER N N 15 114.216 111.209 3.007 1
1 102 . 5 1 1 A 16 16 GLY H H 16 8.506 7.860 0.646 1
1 103 . 5 1 1 A 16 16 GLY HA2 H 16 4.237 4.247 -0.010 1
1 104 . 5 1 1 A 16 16 GLY HA3 H 16 3.927 4.266 -0.339 1
1 105 . 5 1 1 A 16 16 GLY C C 16 173.661 172.311 1.350 1
1 106 . 5 1 1 A 16 16 GLY CA C 16 44.995 43.598 1.397 1
1 107 . 5 1 1 A 16 16 GLY N N 16 111.838 110.457 1.381 1
1 108 . 5 1 1 A 17 17 THR H H 17 8.482 8.876 -0.394 1
1 109 . 5 1 1 A 17 17 THR HA H 17 4.319 4.413 -0.094 1
1 114 . 5 1 1 A 17 17 THR C C 17 174.758 174.378 0.380 1
1 115 . 5 1 1 A 17 17 THR CA C 17 62.272 63.517 -1.245 1
1 116 . 5 1 1 A 17 17 THR CB C 17 70.706 69.027 1.679 1
1 118 . 5 1 1 A 17 17 THR N N 17 116.679 115.049 1.630 1
1 119 . 5 1 1 A 18 18 VAL H H 18 8.948 8.754 0.194 1
1 120 . 5 1 1 A 18 18 VAL HA H 18 3.950 4.388 -0.438 1
1 128 . 5 1 1 A 18 18 VAL C C 18 176.669 176.907 -0.238 1
1 129 . 5 1 1 A 18 18 VAL CA C 18 64.813 63.612 1.201 1
1 130 . 5 1 1 A 18 18 VAL CB C 18 31.807 31.551 0.256 1
1 133 . 5 1 1 A 18 18 VAL N N 18 127.156 127.370 -0.214 1
1 134 . 5 1 1 A 19 19 VAL H H 19 9.359 9.062 0.297 1
1 135 . 5 1 1 A 19 19 VAL HA H 19 4.234 4.395 -0.161 1
1 143 . 5 1 1 A 19 19 VAL C C 19 175.738 175.813 -0.075 1
1 144 . 5 1 1 A 19 19 VAL CA C 19 62.060 62.082 -0.022 1
1 145 . 5 1 1 A 19 19 VAL CB C 19 33.822 33.456 0.366 1
1 148 . 5 1 1 A 19 19 VAL N N 19 125.162 121.807 3.355 1
1 149 . 5 1 1 A 20 20 LYS H H 20 7.584 7.255 0.329 1
1 150 . 5 1 1 A 20 20 LYS HA H 20 4.346 4.619 -0.273 1
1 159 . 5 1 1 A 20 20 LYS C C 20 172.818 173.946 -1.128 1
1 160 . 5 1 1 A 20 20 LYS CA C 20 56.801 55.571 1.230 1
1 161 . 5 1 1 A 20 20 LYS CB C 20 36.624 35.435 1.189 1
1 165 . 5 1 1 A 20 20 LYS N N 20 121.024 121.001 0.023 1
1 166 . 5 1 1 A 21 21 GLN H H 21 8.625 8.502 0.123 1
1 167 . 5 1 1 A 21 21 GLN HA H 21 6.003 5.389 0.614 1
1 174 . 5 1 1 A 21 21 GLN C C 21 174.914 174.848 0.066 1
1 175 . 5 1 1 A 21 21 GLN CA C 21 54.207 54.731 -0.524 1
1 176 . 5 1 1 A 21 21 GLN CB C 21 33.452 33.696 -0.244 1
1 178 . 5 1 1 A 21 21 GLN N N 21 122.108 124.134 -2.026 1
1 180 . 5 1 1 A 22 22 GLY H H 22 8.964 8.349 0.615 1
1 181 . 5 1 1 A 22 22 GLY HA2 H 22 4.665 4.435 0.230 1
1 182 . 5 1 1 A 22 22 GLY HA3 H 22 4.295 4.596 -0.301 1
1 183 . 5 1 1 A 22 22 GLY C C 22 170.879 171.597 -0.718 1
1 184 . 5 1 1 A 22 22 GLY CA C 22 45.683 45.745 -0.062 1
1 185 . 5 1 1 A 22 22 GLY N N 22 108.508 109.002 -0.494 1
1 186 . 5 1 1 A 23 23 TYR H H 23 9.145 8.634 0.511 1
1 187 . 5 1 1 A 23 23 TYR HA H 23 5.595 5.308 0.287 1
1 194 . 5 1 1 A 23 23 TYR C C 23 175.824 175.210 0.614 1
1 195 . 5 1 1 A 23 23 TYR CA C 23 58.019 57.090 0.929 1
1 196 . 5 1 1 A 23 23 TYR CB C 23 39.251 40.851 -1.600 1
1 201 . 5 1 1 A 23 23 TYR N N 23 120.809 119.601 1.208 1
1 202 . 5 1 1 A 24 24 LEU H H 24 8.935 9.748 -0.813 1
1 203 . 5 1 1 A 24 24 LEU HA H 24 4.716 5.063 -0.347 1
1 213 . 5 1 1 A 24 24 LEU C C 24 174.648 175.628 -0.980 1
1 214 . 5 1 1 A 24 24 LEU CA C 24 53.907 53.369 0.538 1
1 215 . 5 1 1 A 24 24 LEU CB C 24 46.078 45.785 0.293 1
1 219 . 5 1 1 A 24 24 LEU N N 24 122.887 124.173 -1.286 1
1 220 . 5 1 1 A 25 25 ALA H H 25 8.145 8.895 -0.750 1
1 221 . 5 1 1 A 25 25 ALA HA H 25 5.477 5.242 0.235 1
1 225 . 5 1 1 A 25 25 ALA C C 25 175.751 175.764 -0.013 1
1 226 . 5 1 1 A 25 25 ALA CA C 25 50.719 50.523 0.196 1
1 227 . 5 1 1 A 25 25 ALA CB C 25 21.074 20.363 0.711 1
1 228 . 5 1 1 A 25 25 ALA N N 25 122.280 123.669 -1.389 1
1 229 . 5 1 1 A 26 26 LYS H H 26 9.167 8.376 0.791 1
1 230 . 5 1 1 A 26 26 LYS HA H 26 5.221 4.354 0.867 1
1 239 . 5 1 1 A 26 26 LYS C C 26 175.421 175.992 -0.571 1
1 240 . 5 1 1 A 26 26 LYS CA C 26 54.383 55.638 -1.255 1
1 241 . 5 1 1 A 26 26 LYS CB C 26 36.125 32.310 3.815 1
1 245 . 5 1 1 A 26 26 LYS N N 26 120.638 125.148 -4.510 1
1 246 . 5 1 1 A 27 27 GLN H H 27 7.866 7.655 0.211 1
1 247 . 5 1 1 A 27 27 GLN HA H 27 3.525 3.220 0.305 1
1 254 . 5 1 1 A 27 27 GLN C C 27 177.022 175.915 1.107 1
1 255 . 5 1 1 A 27 27 GLN CA C 27 55.778 58.585 -2.807 1
1 256 . 5 1 1 A 27 27 GLN CB C 27 29.864 27.442 2.422 1
1 258 . 5 1 1 A 27 27 GLN N N 27 130.194 126.935 3.259 1
1 260 . 5 1 1 A 28 28 GLY H H 28 8.565 7.853 0.712 1
1 261 . 5 1 1 A 28 28 GLY HA2 H 28 4.125 3.816 0.309 1
1 262 . 5 1 1 A 28 28 GLY HA3 H 28 4.034 3.828 0.206 1
1 263 . 5 1 1 A 28 28 GLY C C 28 174.030 174.539 -0.509 1
1 264 . 5 1 1 A 28 28 GLY CA C 28 45.665 46.940 -1.275 1
1 265 . 5 1 1 A 28 28 GLY N N 28 115.528 106.515 9.013 1
1 266 . 5 1 1 A 29 29 HIS HA H 29 4.355 4.227 0.128 1
1 271 . 5 1 1 A 29 29 HIS CA C 29 58.795 57.142 1.653 1
1 272 . 5 1 1 A 29 29 HIS CB C 29 31.283 30.328 0.955 1
1 275 . 5 1 1 A 30 30 LYS HA H 30 4.096 4.427 -0.331 1
1 284 . 5 1 1 A 30 30 LYS CA C 30 57.290 56.958 0.332 1
1 285 . 5 1 1 A 30 30 LYS CB C 30 31.951 34.789 -2.838 1
1 289 . 5 1 1 A 31 31 ARG HA H 31 3.975 4.499 -0.524 1
1 296 . 5 1 1 A 31 31 ARG CA C 31 55.973 57.018 -1.045 1
1 297 . 5 1 1 A 31 31 ARG CB C 31 29.902 33.238 -3.336 1
1 300 . 5 1 1 A 32 32 LYS HA H 32 4.160 4.442 -0.282 1
1 309 . 5 1 1 A 32 32 LYS C C 32 175.678 176.858 -1.180 1
1 310 . 5 1 1 A 32 32 LYS CA C 32 56.254 55.445 0.809 1
1 311 . 5 1 1 A 32 32 LYS CB C 32 31.602 32.681 -1.079 1
1 315 . 5 1 1 A 33 33 ASN H H 33 7.925 8.653 -0.728 1
1 316 . 5 1 1 A 33 33 ASN HA H 33 4.799 4.352 0.447 1
1 321 . 5 1 1 A 33 33 ASN C C 33 174.005 176.087 -2.082 1
1 322 . 5 1 1 A 33 33 ASN CA C 33 52.407 56.800 -4.393 1
1 323 . 5 1 1 A 33 33 ASN CB C 33 39.879 38.789 1.090 1
1 324 . 5 1 1 A 33 33 ASN N N 33 116.990 122.465 -5.475 1
1 326 . 5 1 1 A 34 34 TRP H H 34 8.798 7.620 1.178 1
1 327 . 5 1 1 A 34 34 TRP HA H 34 4.755 5.389 -0.634 1
1 336 . 5 1 1 A 34 34 TRP C C 34 176.090 175.163 0.927 1
1 337 . 5 1 1 A 34 34 TRP CA C 34 57.119 55.734 1.385 1
1 338 . 5 1 1 A 34 34 TRP CB C 34 30.596 33.942 -3.346 1
1 344 . 5 1 1 A 34 34 TRP N N 34 121.917 115.722 6.195 1
1 346 . 5 1 1 A 35 35 LYS H H 35 8.404 8.661 -0.257 1
1 347 . 5 1 1 A 35 35 LYS HA H 35 4.846 4.936 -0.090 1
1 354 . 5 1 1 A 35 35 LYS C C 35 176.088 175.865 0.223 1
1 355 . 5 1 1 A 35 35 LYS CA C 35 54.418 54.644 -0.226 1
1 356 . 5 1 1 A 35 35 LYS CB C 35 36.125 36.093 0.032 1
1 360 . 5 1 1 A 35 35 LYS N N 35 120.864 122.432 -1.568 1
1 361 . 5 1 1 A 36 36 VAL H H 36 8.977 8.735 0.242 1
1 362 . 5 1 1 A 36 36 VAL HA H 36 4.274 4.502 -0.228 1
1 370 . 5 1 1 A 36 36 VAL C C 36 176.733 175.958 0.775 1
1 371 . 5 1 1 A 36 36 VAL CA C 36 64.319 63.327 0.992 1
1 372 . 5 1 1 A 36 36 VAL CB C 36 31.602 32.449 -0.847 1
1 375 . 5 1 1 A 36 36 VAL N N 36 124.314 123.922 0.392 1
1 376 . 5 1 1 A 37 37 ARG H H 37 9.498 9.904 -0.406 1
1 377 . 5 1 1 A 37 37 ARG HA H 37 5.053 4.850 0.203 1
1 384 . 5 1 1 A 37 37 ARG C C 37 174.442 174.512 -0.070 1
1 385 . 5 1 1 A 37 37 ARG CA C 37 53.272 54.846 -1.574 1
1 386 . 5 1 1 A 37 37 ARG CB C 37 34.563 34.155 0.408 1
1 389 . 5 1 1 A 37 37 ARG N N 37 128.121 126.221 1.900 1
1 390 . 5 1 1 A 38 38 ARG H H 38 8.755 8.326 0.429 1
1 391 . 5 1 1 A 38 38 ARG HA H 38 4.626 4.233 0.393 1
1 398 . 5 1 1 A 38 38 ARG C C 38 175.514 175.145 0.369 1
1 399 . 5 1 1 A 38 38 ARG CA C 38 55.601 55.954 -0.353 1
1 400 . 5 1 1 A 38 38 ARG CB C 38 32.219 30.500 1.719 1
1 403 . 5 1 1 A 38 38 ARG N N 38 121.442 127.896 -6.454 1
1 404 . 5 1 1 A 39 39 PHE H H 39 9.865 8.939 0.926 1
1 405 . 5 1 1 A 39 39 PHE HA H 39 5.424 5.052 0.372 1
1 413 . 5 1 1 A 39 39 PHE C C 39 175.423 174.786 0.637 1
1 414 . 5 1 1 A 39 39 PHE CA C 39 57.419 56.971 0.448 1
1 415 . 5 1 1 A 39 39 PHE CB C 39 42.623 40.584 2.039 1
1 421 . 5 1 1 A 39 39 PHE N N 39 130.027 126.494 3.533 1
1 422 . 5 1 1 A 40 40 VAL H H 40 9.300 9.848 -0.548 1
1 423 . 5 1 1 A 40 40 VAL HA H 40 4.846 5.351 -0.505 1
1 431 . 5 1 1 A 40 40 VAL C C 40 174.477 173.340 1.137 1
1 432 . 5 1 1 A 40 40 VAL CA C 40 62.343 59.776 2.567 1
1 433 . 5 1 1 A 40 40 VAL CB C 40 35.755 34.795 0.960 1
1 436 . 5 1 1 A 40 40 VAL N N 40 119.369 122.781 -3.412 1
1 437 . 5 1 1 A 41 41 LEU H H 41 9.557 9.997 -0.440 1
1 438 . 5 1 1 A 41 41 LEU HA H 41 5.292 5.569 -0.277 1
1 448 . 5 1 1 A 41 41 LEU C C 41 174.632 175.350 -0.718 1
1 449 . 5 1 1 A 41 41 LEU CA C 41 53.571 53.704 -0.133 1
1 450 . 5 1 1 A 41 41 LEU CB C 41 45.337 44.941 0.396 1
1 454 . 5 1 1 A 41 41 LEU N N 41 132.121 128.839 3.282 1
1 455 . 5 1 1 A 42 42 ARG H H 42 9.396 8.904 0.492 1
1 456 . 5 1 1 A 42 42 ARG HA H 42 5.366 5.509 -0.143 1
1 464 . 5 1 1 A 42 42 ARG C C 42 173.997 174.784 -0.787 1
1 465 . 5 1 1 A 42 42 ARG CA C 42 54.631 54.107 0.524 1
1 466 . 5 1 1 A 42 42 ARG CB C 42 35.550 34.788 0.762 1
1 469 . 5 1 1 A 42 42 ARG N N 42 128.120 123.690 4.430 1
1 471 . 5 1 1 A 43 43 LYS H H 43 8.597 8.571 0.026 1
1 472 . 5 1 1 A 43 43 LYS HA H 43 4.558 4.914 -0.356 1
1 481 . 5 1 1 A 43 43 LYS C C 43 174.648 175.162 -0.514 1
1 482 . 5 1 1 A 43 43 LYS CA C 43 53.378 55.218 -1.840 1
1 483 . 5 1 1 A 43 43 LYS CB C 43 37.303 35.641 1.662 1
1 487 . 5 1 1 A 43 43 LYS N N 43 114.484 117.722 -3.238 1
1 488 . 5 1 1 A 44 44 ASP H H 44 8.388 9.050 -0.662 1
1 489 . 5 1 1 A 44 44 ASP HA H 44 4.349 4.281 0.068 1
1 492 . 5 1 1 A 44 44 ASP C C 44 173.376 174.259 -0.883 1
1 493 . 5 1 1 A 44 44 ASP CA C 44 54.842 54.961 -0.119 1
1 494 . 5 1 1 A 44 44 ASP CB C 44 39.991 39.637 0.354 1
1 495 . 5 1 1 A 44 44 ASP N N 44 115.453 119.495 -4.042 1
1 496 . 5 1 1 A 45 45 PRO HA H 45 4.652 4.622 0.030 1
1 503 . 5 1 1 A 45 45 PRO C C 45 176.914 175.518 1.396 1
1 504 . 5 1 1 A 45 45 PRO CA C 45 63.490 62.643 0.847 1
1 505 . 5 1 1 A 45 45 PRO CB C 45 34.892 32.667 2.225 1
1 508 . 5 1 1 A 46 46 ALA H H 46 8.112 8.413 -0.301 1
1 509 . 5 1 1 A 46 46 ALA HA H 46 5.455 4.706 0.749 1
1 513 . 5 1 1 A 46 46 ALA C C 46 177.234 176.787 0.447 1
1 514 . 5 1 1 A 46 46 ALA CA C 46 51.560 50.730 0.830 1
1 515 . 5 1 1 A 46 46 ALA CB C 46 20.122 19.718 0.404 1
1 516 . 5 1 1 A 46 46 ALA N N 46 120.155 123.204 -3.049 1
1 517 . 5 1 1 A 47 47 PHE H H 47 8.717 8.962 -0.245 1
1 518 . 5 1 1 A 47 47 PHE HA H 47 4.795 5.025 -0.230 1
1 526 . 5 1 1 A 47 47 PHE C C 47 172.588 174.305 -1.717 1
1 527 . 5 1 1 A 47 47 PHE CA C 47 57.348 56.164 1.184 1
1 528 . 5 1 1 A 47 47 PHE CB C 47 47.123 44.142 2.981 1
1 534 . 5 1 1 A 47 47 PHE N N 47 129.946 119.299 10.647 1
1 535 . 5 1 1 A 48 48 LEU H H 48 7.883 8.122 -0.239 1
1 536 . 5 1 1 A 48 48 LEU HA H 48 5.198 5.121 0.077 1
1 546 . 5 1 1 A 48 48 LEU C C 48 173.569 174.447 -0.878 1
1 547 . 5 1 1 A 48 48 LEU CA C 48 53.290 54.238 -0.948 1
1 548 . 5 1 1 A 48 48 LEU CB C 48 45.502 45.678 -0.176 1
1 552 . 5 1 1 A 48 48 LEU N N 48 121.108 121.612 -0.504 1
1 553 . 5 1 1 A 49 49 HIS H H 49 8.606 8.863 -0.257 1
1 554 . 5 1 1 A 49 49 HIS HA H 49 5.035 4.901 0.134 1
1 559 . 5 1 1 A 49 49 HIS C C 49 173.993 173.599 0.394 1
1 560 . 5 1 1 A 49 49 HIS CA C 49 56.483 53.907 2.576 1
1 561 . 5 1 1 A 49 49 HIS CB C 49 35.919 33.623 2.296 1
1 564 . 5 1 1 A 49 49 HIS N N 49 121.199 125.739 -4.540 1
1 565 . 5 1 1 A 50 50 TYR H H 50 7.777 7.978 -0.201 1
1 566 . 5 1 1 A 50 50 TYR HA H 50 5.695 5.616 0.079 1
1 573 . 5 1 1 A 50 50 TYR C C 50 174.284 172.288 1.996 1
1 574 . 5 1 1 A 50 50 TYR CA C 50 53.430 55.362 -1.932 1
1 575 . 5 1 1 A 50 50 TYR CB C 50 38.552 40.519 -1.967 1
1 580 . 5 1 1 A 50 50 TYR N N 50 114.156 117.427 -3.271 1
1 581 . 5 1 1 A 51 51 TYR H H 51 9.323 8.567 0.756 1
1 582 . 5 1 1 A 51 51 TYR HA H 51 4.600 4.974 -0.374 1
1 589 . 5 1 1 A 51 51 TYR C C 51 175.352 174.115 1.237 1
1 590 . 5 1 1 A 51 51 TYR CA C 51 57.330 56.678 0.652 1
1 591 . 5 1 1 A 51 51 TYR CB C 51 41.683 42.469 -0.786 1
1 596 . 5 1 1 A 51 51 TYR N N 51 119.100 116.864 2.236 1
1 597 . 5 1 1 A 52 52 ASP H H 52 9.375 8.797 0.578 1
1 598 . 5 1 1 A 52 52 ASP HA H 52 5.064 4.896 0.168 1
1 601 . 5 1 1 A 52 52 ASP C C 52 175.484 175.803 -0.319 1
1 602 . 5 1 1 A 52 52 ASP CA C 52 51.313 51.235 0.078 1
1 603 . 5 1 1 A 52 52 ASP CB C 52 41.883 42.032 -0.149 1
1 604 . 5 1 1 A 52 52 ASP N N 52 124.636 123.713 0.923 1
1 605 . 5 1 1 A 53 53 PRO HA H 53 4.678 4.649 0.029 1
1 612 . 5 1 1 A 53 53 PRO C C 53 176.781 177.823 -1.042 1
1 613 . 5 1 1 A 53 53 PRO CA C 53 64.054 64.206 -0.152 1
1 614 . 5 1 1 A 53 53 PRO CB C 53 32.589 32.115 0.474 1
1 617 . 5 1 1 A 54 54 SER H H 54 8.685 9.035 -0.350 1
1 618 . 5 1 1 A 54 54 SER HA H 54 4.483 4.373 0.110 1
1 621 . 5 1 1 A 54 54 SER C C 54 174.006 174.380 -0.374 1
1 622 . 5 1 1 A 54 54 SER CA C 54 59.378 60.416 -1.038 1
1 623 . 5 1 1 A 54 54 SER CB C 54 64.132 63.486 0.646 1
1 624 . 5 1 1 A 54 54 SER N N 54 113.769 112.829 0.940 1
1 625 . 5 1 1 A 55 55 LYS H H 55 7.706 7.765 -0.059 1
1 626 . 5 1 1 A 55 55 LYS HA H 55 4.580 4.754 -0.174 1
1 635 . 5 1 1 A 55 55 LYS C C 55 175.969 175.562 0.407 1
1 636 . 5 1 1 A 55 55 LYS CA C 55 55.160 54.899 0.261 1
1 637 . 5 1 1 A 55 55 LYS CB C 55 34.069 34.137 -0.068 1
1 641 . 5 1 1 A 55 55 LYS N N 55 122.222 120.034 2.188 1
1 642 . 5 1 1 A 56 56 GLU H H 56 8.666 8.667 -0.001 1
1 643 . 5 1 1 A 56 56 GLU HA H 56 4.174 5.197 -1.023 1
1 648 . 5 1 1 A 56 56 GLU C C 56 177.084 174.574 2.510 1
1 649 . 5 1 1 A 56 56 GLU CA C 56 57.099 55.550 1.549 1
1 650 . 5 1 1 A 56 56 GLU CB C 56 29.694 31.443 -1.749 1
1 652 . 5 1 1 A 56 56 GLU N N 56 122.015 118.783 3.232 1
1 653 . 5 1 1 A 57 57 GLU H H 57 8.303 8.761 -0.458 1
1 654 . 5 1 1 A 57 57 GLU HA H 57 4.214 4.739 -0.525 1
1 659 . 5 1 1 A 57 57 GLU CA C 57 56.960 55.400 1.560 1
1 660 . 5 1 1 A 57 57 GLU CB C 57 30.264 33.618 -3.354 1
1 662 . 5 1 1 A 57 57 GLU N N 57 119.884 124.069 -4.185 1
1 663 . 5 1 1 A 58 58 ASN HA H 58 4.768 4.965 -0.197 1
1 668 . 5 1 1 A 58 58 ASN C C 58 174.902 172.534 2.368 1
1 669 . 5 1 1 A 58 58 ASN CA C 58 52.740 53.213 -0.473 1
1 670 . 5 1 1 A 58 58 ASN CB C 58 38.116 39.397 -1.281 1
1 672 . 5 1 1 A 59 59 ARG H H 59 7.805 7.692 0.113 1
1 673 . 5 1 1 A 59 59 ARG HA H 59 4.762 4.942 -0.180 1
1 680 . 5 1 1 A 59 59 ARG CA C 59 53.151 52.746 0.405 1
1 681 . 5 1 1 A 59 59 ARG CB C 59 31.519 31.711 -0.192 1
1 684 . 5 1 1 A 59 59 ARG N N 59 121.060 118.458 2.602 1
1 685 . 5 1 1 A 60 60 PRO HA H 60 3.357 4.290 -0.933 1
1 692 . 5 1 1 A 60 60 PRO C C 60 176.817 176.634 0.183 1
1 693 . 5 1 1 A 60 60 PRO CA C 60 63.031 62.092 0.939 1
1 694 . 5 1 1 A 60 60 PRO CB C 60 31.273 32.044 -0.771 1
1 697 . 5 1 1 A 61 61 VAL H H 61 8.627 7.977 0.650 1
1 698 . 5 1 1 A 61 61 VAL HA H 61 3.966 3.891 0.075 1
1 706 . 5 1 1 A 61 61 VAL C C 61 176.503 176.452 0.051 1
1 707 . 5 1 1 A 61 61 VAL CA C 61 63.154 64.762 -1.608 1
1 708 . 5 1 1 A 61 61 VAL CB C 61 32.048 32.412 -0.364 1
1 711 . 5 1 1 A 61 61 VAL N N 61 119.185 120.384 -1.199 1
1 712 . 5 1 1 A 62 62 GLY H H 62 6.715 7.079 -0.364 1
1 713 . 5 1 1 A 62 62 GLY HA2 H 62 3.940 4.025 -0.085 1
1 714 . 5 1 1 A 62 62 GLY HA3 H 62 3.538 4.118 -0.580 1
1 715 . 5 1 1 A 62 62 GLY C C 62 169.983 172.096 -2.113 1
1 716 . 5 1 1 A 62 62 GLY CA C 62 44.465 45.758 -1.293 1
1 717 . 5 1 1 A 62 62 GLY N N 62 105.813 106.143 -0.330 1
1 718 . 5 1 1 A 63 63 GLY H H 63 8.004 8.322 -0.318 1
1 719 . 5 1 1 A 63 63 GLY HA2 H 63 4.095 3.102 0.993 1
1 720 . 5 1 1 A 63 63 GLY HA3 H 63 3.813 3.578 0.235 1
1 721 . 5 1 1 A 63 63 GLY C C 63 171.870 172.437 -0.567 1
1 722 . 5 1 1 A 63 63 GLY CA C 63 47.148 44.032 3.116 1
1 723 . 5 1 1 A 63 63 GLY N N 63 105.089 107.637 -2.548 1
1 724 . 5 1 1 A 64 64 PHE H H 64 7.967 7.971 -0.004 1
1 725 . 5 1 1 A 64 64 PHE HA H 64 4.934 5.488 -0.554 1
1 733 . 5 1 1 A 64 64 PHE C C 64 173.140 174.073 -0.933 1
1 734 . 5 1 1 A 64 64 PHE CA C 64 55.248 55.406 -0.158 1
1 735 . 5 1 1 A 64 64 PHE CB C 64 40.238 41.732 -1.494 1
1 741 . 5 1 1 A 64 64 PHE N N 64 113.387 119.658 -6.271 1
1 742 . 5 1 1 A 65 65 SER H H 65 8.518 9.092 -0.574 1
1 743 . 5 1 1 A 65 65 SER HA H 65 3.264 4.103 -0.839 1
1 746 . 5 1 1 A 65 65 SER C C 65 176.417 174.137 2.280 1
1 747 . 5 1 1 A 65 65 SER CA C 65 56.819 57.376 -0.557 1
1 748 . 5 1 1 A 65 65 SER CB C 65 63.391 64.793 -1.402 1
1 749 . 5 1 1 A 65 65 SER N N 65 114.674 115.743 -1.069 1
1 750 . 5 1 1 A 66 66 LEU H H 66 7.404 7.381 0.023 1
1 751 . 5 1 1 A 66 66 LEU HA H 66 4.470 4.285 0.185 1
1 761 . 5 1 1 A 66 66 LEU C C 66 177.993 178.030 -0.037 1
1 762 . 5 1 1 A 66 66 LEU CA C 66 54.242 55.737 -1.495 1
1 763 . 5 1 1 A 66 66 LEU CB C 66 42.787 42.278 0.509 1
1 767 . 5 1 1 A 66 66 LEU N N 66 123.988 121.242 2.746 1
1 768 . 5 1 1 A 67 67 ARG H H 67 7.865 7.878 -0.013 1
1 769 . 5 1 1 A 67 67 ARG HA H 67 4.175 3.904 0.271 1
1 776 . 5 1 1 A 67 67 ARG C C 67 178.562 177.970 0.592 1
1 777 . 5 1 1 A 67 67 ARG CA C 67 58.143 59.410 -1.267 1
1 778 . 5 1 1 A 67 67 ARG CB C 67 29.052 29.964 -0.912 1
1 781 . 5 1 1 A 67 67 ARG N N 67 122.494 118.023 4.471 1
1 782 . 5 1 1 A 68 68 GLY H H 68 9.398 8.146 1.252 1
1 783 . 5 1 1 A 68 68 GLY HA2 H 68 4.066 3.871 0.195 1
1 784 . 5 1 1 A 68 68 GLY HA3 H 68 3.908 3.874 0.034 1
1 785 . 5 1 1 A 68 68 GLY C C 68 173.982 173.541 0.441 1
1 786 . 5 1 1 A 68 68 GLY CA C 68 46.230 46.544 -0.314 1
1 787 . 5 1 1 A 68 68 GLY N N 68 117.548 107.669 9.879 1
1 788 . 5 1 1 A 69 69 SER H H 69 7.829 7.490 0.339 1
1 789 . 5 1 1 A 69 69 SER HA H 69 4.807 5.212 -0.405 1
1 792 . 5 1 1 A 69 69 SER C C 69 172.854 172.735 0.119 1
1 793 . 5 1 1 A 69 69 SER CA C 69 59.290 57.309 1.981 1
1 794 . 5 1 1 A 69 69 SER CB C 69 65.366 67.625 -2.259 1
1 795 . 5 1 1 A 69 69 SER N N 69 115.188 114.514 0.674 1
1 796 . 5 1 1 A 70 70 LEU H H 70 8.805 8.561 0.244 1
1 797 . 5 1 1 A 70 70 LEU HA H 70 4.846 4.839 0.007 1
1 807 . 5 1 1 A 70 70 LEU C C 70 175.775 174.175 1.600 1
1 808 . 5 1 1 A 70 70 LEU CA C 70 53.907 54.059 -0.152 1
1 809 . 5 1 1 A 70 70 LEU CB C 70 45.337 46.089 -0.752 1
1 813 . 5 1 1 A 70 70 LEU N N 70 121.265 122.814 -1.549 1
1 814 . 5 1 1 A 71 71 VAL H H 71 8.644 8.748 -0.104 1
1 815 . 5 1 1 A 71 71 VAL HA H 71 5.555 5.164 0.391 1
1 823 . 5 1 1 A 71 71 VAL C C 71 173.636 173.064 0.572 1
1 824 . 5 1 1 A 71 71 VAL CA C 71 58.760 59.784 -1.024 1
1 825 . 5 1 1 A 71 71 VAL CB C 71 34.891 35.783 -0.892 1
1 828 . 5 1 1 A 71 71 VAL N N 71 122.315 122.511 -0.196 1
1 829 . 5 1 1 A 72 72 SER H H 72 8.750 9.071 -0.321 1
1 830 . 5 1 1 A 72 72 SER HA H 72 4.742 5.011 -0.269 1
1 833 . 5 1 1 A 72 72 SER C C 72 173.058 172.837 0.221 1
1 834 . 5 1 1 A 72 72 SER CA C 72 57.190 57.812 -0.622 1
1 835 . 5 1 1 A 72 72 SER CB C 72 65.612 67.354 -1.742 1
1 836 . 5 1 1 A 72 72 SER N N 72 118.611 123.359 -4.748 1
1 837 . 5 1 1 A 73 73 ALA H H 73 9.009 8.789 0.220 1
1 838 . 5 1 1 A 73 73 ALA HA H 73 4.406 5.280 -0.874 1
1 842 . 5 1 1 A 73 73 ALA C C 73 176.708 176.567 0.141 1
1 843 . 5 1 1 A 73 73 ALA CA C 73 52.672 50.289 2.383 1
1 844 . 5 1 1 A 73 73 ALA CB C 73 18.812 22.029 -3.217 1
1 845 . 5 1 1 A 73 73 ALA N N 73 125.694 125.578 0.116 1
1 846 . 5 1 1 A 74 74 LEU H H 74 7.800 7.844 -0.044 1
1 847 . 5 1 1 A 74 74 LEU HA H 74 4.716 5.218 -0.502 1
1 857 . 5 1 1 A 74 74 LEU C C 74 176.551 175.802 0.749 1
1 858 . 5 1 1 A 74 74 LEU CA C 74 53.784 53.399 0.385 1
1 859 . 5 1 1 A 74 74 LEU CB C 74 43.446 44.070 -0.624 1
1 863 . 5 1 1 A 74 74 LEU N N 74 122.271 120.254 2.017 1
1 864 . 5 1 1 A 75 75 GLU H H 75 8.855 8.679 0.176 1
1 865 . 5 1 1 A 75 75 GLU HA H 75 4.336 4.554 -0.218 1
1 870 . 5 1 1 A 75 75 GLU C C 75 176.465 175.710 0.755 1
1 871 . 5 1 1 A 75 75 GLU CA C 75 56.507 54.996 1.511 1
1 872 . 5 1 1 A 75 75 GLU CB C 75 30.245 33.951 -3.706 1
1 874 . 5 1 1 A 75 75 GLU N N 75 122.678 122.251 0.427 1
1 875 . 5 1 1 A 76 76 ASP H H 76 8.542 8.933 -0.391 1
1 876 . 5 1 1 A 76 76 ASP HA H 76 4.665 4.422 0.243 1
1 879 . 5 1 1 A 76 76 ASP C C 76 176.087 175.124 0.963 1
1 880 . 5 1 1 A 76 76 ASP CA C 76 55.107 56.343 -1.236 1
1 881 . 5 1 1 A 76 76 ASP CB C 76 41.431 39.994 1.437 1
1 882 . 5 1 1 A 76 76 ASP N N 76 121.488 119.817 1.671 1
1 883 . 5 1 1 A 77 77 ASN H H 77 8.322 8.754 -0.432 1
1 884 . 5 1 1 A 77 77 ASN HA H 77 4.729 4.871 -0.142 1
1 889 . 5 1 1 A 77 77 ASN C C 77 175.566 175.977 -0.411 1
1 890 . 5 1 1 A 77 77 ASN CA C 77 53.131 52.490 0.641 1
1 891 . 5 1 1 A 77 77 ASN CB C 77 38.617 39.722 -1.105 1
1 892 . 5 1 1 A 77 77 ASN N N 77 118.676 117.134 1.542 1
1 894 . 5 1 1 A 78 78 GLY H H 78 8.311 8.649 -0.338 1
1 895 . 5 1 1 A 78 78 GLY HA2 H 78 3.897 3.857 0.040 1
1 896 . 5 1 1 A 78 78 GLY HA3 H 78 3.897 3.860 0.037 1
1 897 . 5 1 1 A 78 78 GLY C C 78 173.376 174.726 -1.350 1
1 898 . 5 1 1 A 78 78 GLY CA C 78 45.224 46.721 -1.497 1
1 899 . 5 1 1 A 78 78 GLY N N 78 108.939 111.834 -2.895 1
1 900 . 5 1 1 A 79 79 VAL H H 79 7.882 8.053 -0.171 1
1 901 . 5 1 1 A 79 79 VAL HA H 79 4.345 4.171 0.174 1
1 909 . 5 1 1 A 79 79 VAL CA C 79 59.995 60.547 -0.552 1
1 910 . 5 1 1 A 79 79 VAL CB C 79 32.589 32.161 0.428 1
1 913 . 5 1 1 A 79 79 VAL N N 79 121.135 119.303 1.832 1
1 914 . 5 1 1 A 80 80 PRO HA H 80 4.461 4.584 -0.123 1
1 921 . 5 1 1 A 80 80 PRO C C 80 176.979 176.147 0.832 1
1 922 . 5 1 1 A 80 80 PRO CA C 80 63.101 62.132 0.969 1
1 923 . 5 1 1 A 80 80 PRO CB C 80 32.177 32.650 -0.473 1
1 926 . 5 1 1 A 81 81 THR H H 81 8.281 8.431 -0.150 1
1 927 . 5 1 1 A 81 81 THR HA H 81 4.095 3.827 0.268 1
1 932 . 5 1 1 A 81 81 THR C C 81 175.270 175.968 -0.698 1
1 933 . 5 1 1 A 81 81 THR CA C 81 62.872 64.526 -1.654 1
1 934 . 5 1 1 A 81 81 THR CB C 81 69.642 68.484 1.158 1
1 936 . 5 1 1 A 81 81 THR N N 81 114.684 116.945 -2.261 1
1 937 . 5 1 1 A 82 82 GLY H H 82 8.338 8.843 -0.505 1
1 938 . 5 1 1 A 82 82 GLY HA2 H 82 4.095 3.837 0.258 1
1 939 . 5 1 1 A 82 82 GLY HA3 H 82 3.668 3.842 -0.174 1
1 940 . 5 1 1 A 82 82 GLY C C 82 174.139 174.461 -0.322 1
1 941 . 5 1 1 A 82 82 GLY CA C 82 45.083 47.032 -1.949 1
1 942 . 5 1 1 A 82 82 GLY N N 82 111.289 114.236 -2.947 1
1 943 . 5 1 1 A 83 83 VAL H H 83 7.668 8.077 -0.409 1
1 944 . 5 1 1 A 83 83 VAL HA H 83 3.985 3.796 0.189 1
1 952 . 5 1 1 A 83 83 VAL C C 83 176.054 175.782 0.272 1
1 953 . 5 1 1 A 83 83 VAL CA C 83 62.431 62.275 0.156 1
1 954 . 5 1 1 A 83 83 VAL CB C 83 32.260 30.258 2.002 1
1 957 . 5 1 1 A 83 83 VAL N N 83 120.003 121.099 -1.096 1
1 958 . 5 1 1 A 84 84 LYS H H 84 8.645 7.911 0.734 1
1 959 . 5 1 1 A 84 84 LYS HA H 84 4.276 3.944 0.332 1
1 968 . 5 1 1 A 84 84 LYS C C 84 176.832 178.570 -1.738 1
1 969 . 5 1 1 A 84 84 LYS CA C 84 56.272 59.425 -3.153 1
1 970 . 5 1 1 A 84 84 LYS CB C 84 32.876 32.006 0.870 1
1 974 . 5 1 1 A 84 84 LYS N N 84 126.447 127.943 -1.496 1
1 975 . 5 1 1 A 85 85 GLY H H 85 8.410 7.945 0.465 1
1 976 . 5 1 1 A 85 85 GLY HA2 H 85 4.066 4.057 0.009 1
1 977 . 5 1 1 A 85 85 GLY HA3 H 85 3.781 4.133 -0.352 1
1 978 . 5 1 1 A 85 85 GLY C C 85 173.969 173.461 0.508 1
1 979 . 5 1 1 A 85 85 GLY CA C 85 45.146 44.366 0.780 1
1 980 . 5 1 1 A 85 85 GLY N N 85 109.957 107.938 2.019 1
1 981 . 5 1 1 A 86 86 ASN H H 86 8.298 8.808 -0.510 1
1 982 . 5 1 1 A 86 86 ASN HA H 86 4.665 5.291 -0.626 1
1 987 . 5 1 1 A 86 86 ASN C C 86 174.987 173.555 1.432 1
1 988 . 5 1 1 A 86 86 ASN CA C 86 52.989 52.878 0.111 1
1 989 . 5 1 1 A 86 86 ASN CB C 86 38.376 41.135 -2.759 1
1 990 . 5 1 1 A 86 86 ASN N N 86 118.457 117.771 0.686 1
1 992 . 5 1 1 A 87 87 VAL H H 87 7.660 8.638 -0.978 1
1 993 . 5 1 1 A 87 87 VAL HA H 87 3.946 4.294 -0.348 1
1 1001 . 5 1 1 A 87 87 VAL C C 87 174.902 174.606 0.296 1
1 1002 . 5 1 1 A 87 87 VAL CA C 87 62.307 60.343 1.964 1
1 1003 . 5 1 1 A 87 87 VAL CB C 87 32.548 32.885 -0.337 1
1 1006 . 5 1 1 A 87 87 VAL N N 87 120.557 120.697 -0.140 1
1 1007 . 5 1 1 A 88 88 GLN H H 88 8.115 8.360 -0.245 1
1 1008 . 5 1 1 A 88 88 GLN HA H 88 4.302 4.656 -0.354 1
1 1015 . 5 1 1 A 88 88 GLN C C 88 175.637 175.564 0.073 1
1 1016 . 5 1 1 A 88 88 GLN CA C 88 55.336 54.189 1.147 1
1 1017 . 5 1 1 A 88 88 GLN CB C 88 30.574 31.077 -0.503 1
1 1019 . 5 1 1 A 88 88 GLN N N 88 122.280 117.221 5.059 1
1 1021 . 5 1 1 A 89 89 GLY H H 89 8.544 8.413 0.131 1
1 1022 . 5 1 1 A 89 89 GLY HA2 H 89 3.885 3.943 -0.058 1
1 1023 . 5 1 1 A 89 89 GLY HA3 H 89 3.885 3.951 -0.066 1
1 1024 . 5 1 1 A 89 89 GLY C C 89 172.861 173.637 -0.776 1
1 1025 . 5 1 1 A 89 89 GLY CA C 89 44.889 46.481 -1.592 1
1 1026 . 5 1 1 A 89 89 GLY N N 89 110.135 108.083 2.052 1
1 1027 . 5 1 1 A 90 90 ASN H H 90 8.451 7.908 0.543 1
1 1028 . 5 1 1 A 90 90 ASN HA H 90 4.222 4.978 -0.756 1
1 1033 . 5 1 1 A 90 90 ASN C C 90 174.926 175.909 -0.983 1
1 1034 . 5 1 1 A 90 90 ASN CA C 90 54.613 54.137 0.476 1
1 1035 . 5 1 1 A 90 90 ASN CB C 90 37.852 40.982 -3.130 1
1 1036 . 5 1 1 A 90 90 ASN N N 90 114.322 121.123 -6.801 1
1 1038 . 5 1 1 A 91 91 LEU H H 91 8.933 8.140 0.793 1
1 1039 . 5 1 1 A 91 91 LEU HA H 91 5.367 4.261 1.106 1
1 1049 . 5 1 1 A 91 91 LEU C C 91 178.732 175.815 2.917 1
1 1050 . 5 1 1 A 91 91 LEU CA C 91 55.160 57.188 -2.028 1
1 1051 . 5 1 1 A 91 91 LEU CB C 91 45.461 40.882 4.579 1
1 1055 . 5 1 1 A 91 91 LEU N N 91 120.057 118.850 1.207 1
1 1056 . 5 1 1 A 92 92 PHE H H 92 9.901 8.086 1.815 1
1 1057 . 5 1 1 A 92 92 PHE HA H 92 5.105 5.282 -0.177 1
1 1065 . 5 1 1 A 92 92 PHE C C 92 170.140 172.682 -2.542 1
1 1066 . 5 1 1 A 92 92 PHE CA C 92 56.236 56.193 0.043 1
1 1067 . 5 1 1 A 92 92 PHE CB C 92 42.664 41.216 1.448 1
1 1073 . 5 1 1 A 92 92 PHE N N 92 119.740 115.828 3.912 1
1 1074 . 5 1 1 A 93 93 LYS H H 93 9.154 8.909 0.245 1
1 1075 . 5 1 1 A 93 93 LYS HA H 93 5.584 5.261 0.323 1
1 1083 . 5 1 1 A 93 93 LYS C C 93 174.830 175.137 -0.307 1
1 1084 . 5 1 1 A 93 93 LYS CA C 93 53.148 54.063 -0.915 1
1 1085 . 5 1 1 A 93 93 LYS CB C 93 36.660 36.314 0.346 1
1 1089 . 5 1 1 A 93 93 LYS N N 93 117.710 118.705 -0.995 1
1 1090 . 5 1 1 A 94 94 VAL H H 94 8.507 8.369 0.138 1
1 1091 . 5 1 1 A 94 94 VAL HA H 94 4.872 5.103 -0.231 1
1 1099 . 5 1 1 A 94 94 VAL C C 94 174.408 174.644 -0.236 1
1 1100 . 5 1 1 A 94 94 VAL CA C 94 60.525 61.230 -0.705 1
1 1101 . 5 1 1 A 94 94 VAL CB C 94 34.862 34.554 0.308 1
1 1104 . 5 1 1 A 94 94 VAL N N 94 121.741 120.578 1.163 1
1 1105 . 5 1 1 A 95 95 ILE H H 95 8.959 9.098 -0.139 1
1 1106 . 5 1 1 A 95 95 ILE HA H 95 4.794 5.159 -0.365 1
1 1116 . 5 1 1 A 95 95 ILE C C 95 177.642 176.242 1.400 1
1 1117 . 5 1 1 A 95 95 ILE CA C 95 59.713 60.697 -0.984 1
1 1118 . 5 1 1 A 95 95 ILE CB C 95 40.032 37.838 2.194 1
1 1122 . 5 1 1 A 95 95 ILE N N 95 126.794 128.731 -1.937 1
1 1123 . 5 1 1 A 96 96 THR H H 96 8.765 8.746 0.019 1
1 1124 . 5 1 1 A 96 96 THR HA H 96 4.584 4.855 -0.271 1
1 1129 . 5 1 1 A 96 96 THR C C 96 177.023 175.614 1.409 1
1 1130 . 5 1 1 A 96 96 THR CA C 96 61.372 60.730 0.642 1
1 1131 . 5 1 1 A 96 96 THR CB C 96 70.794 71.737 -0.943 1
1 1133 . 5 1 1 A 96 96 THR N N 96 117.225 120.837 -3.612 1
1 1134 . 5 1 1 A 97 97 LYS H H 97 8.736 8.702 0.034 1
1 1135 . 5 1 1 A 97 97 LYS HA H 97 4.101 4.014 0.087 1
1 1144 . 5 1 1 A 97 97 LYS C C 97 176.490 177.281 -0.791 1
1 1145 . 5 1 1 A 97 97 LYS CA C 97 58.583 59.306 -0.723 1
1 1146 . 5 1 1 A 97 97 LYS CB C 97 31.848 32.475 -0.627 1
1 1150 . 5 1 1 A 97 97 LYS N N 97 120.457 122.828 -2.371 1
1 1151 . 5 1 1 A 98 98 ASP H H 98 7.762 7.967 -0.205 1
1 1152 . 5 1 1 A 98 98 ASP HA H 98 4.633 4.775 -0.142 1
1 1155 . 5 1 1 A 98 98 ASP C C 98 175.270 174.938 0.332 1
1 1156 . 5 1 1 A 98 98 ASP CA C 98 53.272 53.968 -0.696 1
1 1157 . 5 1 1 A 98 98 ASP CB C 98 39.909 40.859 -0.950 1
1 1158 . 5 1 1 A 98 98 ASP N N 98 116.281 116.435 -0.154 1
1 1159 . 5 1 1 A 99 99 ASP H H 99 8.340 8.708 -0.368 1
1 1160 . 5 1 1 A 99 99 ASP HA H 99 4.245 4.226 0.019 1
1 1163 . 5 1 1 A 99 99 ASP C C 99 175.315 175.654 -0.339 1
1 1164 . 5 1 1 A 99 99 ASP CA C 99 55.989 55.501 0.488 1
1 1165 . 5 1 1 A 99 99 ASP CB C 99 39.827 40.574 -0.747 1
1 1166 . 5 1 1 A 99 99 ASP N N 99 116.687 117.554 -0.867 1
1 1167 . 5 1 1 A 100 100 THR H H 100 7.511 7.396 0.115 1
1 1168 . 5 1 1 A 100 100 THR HA H 100 4.185 4.111 0.074 1
1 1173 . 5 1 1 A 100 100 THR C C 100 173.376 173.776 -0.400 1
1 1174 . 5 1 1 A 100 100 THR CA C 100 63.489 62.401 1.088 1
1 1175 . 5 1 1 A 100 100 THR CB C 100 67.909 69.117 -1.208 1
1 1177 . 5 1 1 A 100 100 THR N N 100 116.525 114.103 2.422 1
1 1178 . 5 1 1 A 101 101 HIS H H 101 8.753 8.773 -0.020 1
1 1179 . 5 1 1 A 101 101 HIS HA H 101 4.898 4.821 0.077 1
1 1184 . 5 1 1 A 101 101 HIS C C 101 174.345 173.646 0.699 1
1 1185 . 5 1 1 A 101 101 HIS CA C 101 55.072 54.356 0.716 1
1 1186 . 5 1 1 A 101 101 HIS CB C 101 32.835 29.498 3.337 1
1 1189 . 5 1 1 A 101 101 HIS N N 101 125.953 126.053 -0.100 1
1 1190 . 5 1 1 A 102 102 TYR H H 102 9.023 8.996 0.027 1
1 1191 . 5 1 1 A 102 102 TYR HA H 102 4.545 4.718 -0.173 1
1 1198 . 5 1 1 A 102 102 TYR C C 102 174.126 174.679 -0.553 1
1 1199 . 5 1 1 A 102 102 TYR CA C 102 57.260 56.528 0.732 1
1 1200 . 5 1 1 A 102 102 TYR CB C 102 40.381 37.823 2.558 1
1 1205 . 5 1 1 A 102 102 TYR N N 102 121.975 124.028 -2.053 1
1 1206 . 5 1 1 A 103 103 TYR H H 103 8.899 8.831 0.068 1
1 1207 . 5 1 1 A 103 103 TYR HA H 103 4.729 4.968 -0.239 1
1 1214 . 5 1 1 A 103 103 TYR C C 103 174.139 175.963 -1.824 1
1 1215 . 5 1 1 A 103 103 TYR CA C 103 58.036 58.126 -0.090 1
1 1216 . 5 1 1 A 103 103 TYR CB C 103 40.485 39.001 1.484 1
1 1221 . 5 1 1 A 103 103 TYR N N 103 122.012 124.462 -2.450 1
1 1222 . 5 1 1 A 104 104 ILE H H 104 8.605 8.863 -0.258 1
1 1223 . 5 1 1 A 104 104 ILE HA H 104 4.859 4.820 0.039 1
1 1233 . 5 1 1 A 104 104 ILE C C 104 172.769 174.235 -1.466 1
1 1234 . 5 1 1 A 104 104 ILE CA C 104 59.554 59.593 -0.039 1
1 1235 . 5 1 1 A 104 104 ILE CB C 104 40.631 41.292 -0.661 1
1 1239 . 5 1 1 A 104 104 ILE N N 104 123.443 123.807 -0.364 1
1 1240 . 5 1 1 A 105 105 GLN H H 105 9.369 8.606 0.763 1
1 1241 . 5 1 1 A 105 105 GLN HA H 105 4.895 5.095 -0.200 1
1 1248 . 5 1 1 A 105 105 GLN C C 105 175.642 174.589 1.053 1
1 1249 . 5 1 1 A 105 105 GLN CA C 105 54.965 53.879 1.086 1
1 1250 . 5 1 1 A 105 105 GLN CB C 105 32.856 32.316 0.540 1
1 1252 . 5 1 1 A 105 105 GLN N N 105 125.079 123.645 1.434 1
1 1254 . 5 1 1 A 106 106 ALA H H 106 8.513 8.440 0.073 1
1 1255 . 5 1 1 A 106 106 ALA HA H 106 4.962 4.882 0.080 1
1 1259 . 5 1 1 A 106 106 ALA C C 106 175.854 177.751 -1.897 1
1 1260 . 5 1 1 A 106 106 ALA CA C 106 50.272 50.078 0.194 1
1 1261 . 5 1 1 A 106 106 ALA CB C 106 21.197 22.246 -1.049 1
1 1262 . 5 1 1 A 106 106 ALA N N 106 129.303 128.759 0.544 1
1 1263 . 5 1 1 A 107 107 SER H H 107 9.468 8.688 0.780 1
1 1264 . 5 1 1 A 107 107 SER HA H 107 4.447 4.216 0.231 1
1 1267 . 5 1 1 A 107 107 SER C C 107 173.785 174.505 -0.720 1
1 1268 . 5 1 1 A 107 107 SER CA C 107 60.048 61.944 -1.896 1
1 1269 . 5 1 1 A 107 107 SER CB C 107 64.643 63.191 1.452 1
1 1270 . 5 1 1 A 107 107 SER N N 107 112.962 116.034 -3.072 1
1 1271 . 5 1 1 A 108 108 SER H H 108 7.555 7.854 -0.299 1
1 1272 . 5 1 1 A 108 108 SER HA H 108 4.665 4.814 -0.149 1
1 1275 . 5 1 1 A 108 108 SER C C 108 174.381 174.699 -0.318 1
1 1276 . 5 1 1 A 108 108 SER CA C 108 56.907 55.922 0.985 1
1 1277 . 5 1 1 A 108 108 SER CB C 108 66.370 65.929 0.441 1
1 1278 . 5 1 1 A 108 108 SER N N 108 112.243 112.818 -0.575 1
1 1279 . 5 1 1 A 109 109 LYS H H 109 8.978 8.674 0.304 1
1 1280 . 5 1 1 A 109 109 LYS HA H 109 4.777 3.964 0.813 1
1 1287 . 5 1 1 A 109 109 LYS C C 109 179.992 177.630 2.362 1
1 1288 . 5 1 1 A 109 109 LYS CA C 109 59.766 59.859 -0.093 1
1 1289 . 5 1 1 A 109 109 LYS CB C 109 32.342 32.029 0.313 1
1 1293 . 5 1 1 A 109 109 LYS N N 109 123.170 125.534 -2.364 1
1 1294 . 5 1 1 A 110 110 ALA H H 110 8.608 8.085 0.523 1
1 1295 . 5 1 1 A 110 110 ALA HA H 110 4.178 4.025 0.153 1
1 1299 . 5 1 1 A 110 110 ALA C C 110 179.895 179.257 0.638 1
1 1300 . 5 1 1 A 110 110 ALA CA C 110 54.871 55.486 -0.615 1
1 1301 . 5 1 1 A 110 110 ALA CB C 110 18.065 18.509 -0.444 1
1 1302 . 5 1 1 A 110 110 ALA N N 110 123.750 121.575 2.175 1
1 1303 . 5 1 1 A 111 111 GLU H H 111 8.185 8.262 -0.077 1
1 1304 . 5 1 1 A 111 111 GLU HA H 111 4.180 4.067 0.113 1
1 1309 . 5 1 1 A 111 111 GLU C C 111 178.587 178.833 -0.246 1
1 1310 . 5 1 1 A 111 111 GLU CA C 111 59.466 59.662 -0.196 1
1 1311 . 5 1 1 A 111 111 GLU CB C 111 31.067 29.402 1.665 1
1 1313 . 5 1 1 A 111 111 GLU N N 111 119.757 118.588 1.169 1
1 1314 . 5 1 1 A 112 112 ARG H H 112 8.008 7.844 0.164 1
1 1315 . 5 1 1 A 112 112 ARG HA H 112 3.642 4.169 -0.527 1
1 1322 . 5 1 1 A 112 112 ARG C C 112 176.481 178.253 -1.772 1
1 1323 . 5 1 1 A 112 112 ARG CA C 112 60.419 59.743 0.676 1
1 1324 . 5 1 1 A 112 112 ARG CB C 112 29.957 30.210 -0.253 1
1 1327 . 5 1 1 A 112 112 ARG N N 112 118.430 119.806 -1.376 1
1 1328 . 5 1 1 A 113 113 ALA H H 113 7.985 7.675 0.310 1
1 1329 . 5 1 1 A 113 113 ALA HA H 113 3.925 4.096 -0.171 1
1 1333 . 5 1 1 A 113 113 ALA C C 113 180.117 180.256 -0.139 1
1 1334 . 5 1 1 A 113 113 ALA CA C 113 55.372 55.095 0.277 1
1 1335 . 5 1 1 A 113 113 ALA CB C 113 17.825 18.590 -0.765 1
1 1336 . 5 1 1 A 113 113 ALA N N 113 119.980 120.673 -0.693 1
1 1337 . 5 1 1 A 114 114 GLU H H 114 8.093 8.444 -0.351 1
1 1338 . 5 1 1 A 114 114 GLU HA H 114 3.936 3.932 0.004 1
1 1343 . 5 1 1 A 114 114 GLU C C 114 180.586 179.388 1.198 1
1 1344 . 5 1 1 A 114 114 GLU CA C 114 59.148 59.583 -0.435 1
1 1345 . 5 1 1 A 114 114 GLU CB C 114 30.080 29.225 0.855 1
1 1347 . 5 1 1 A 114 114 GLU N N 114 117.168 117.501 -0.333 1
1 1348 . 5 1 1 A 115 115 TRP H H 115 7.980 8.125 -0.145 1
1 1349 . 5 1 1 A 115 115 TRP HA H 115 3.775 4.396 -0.621 1
1 1358 . 5 1 1 A 115 115 TRP C C 115 177.714 178.643 -0.929 1
1 1359 . 5 1 1 A 115 115 TRP CA C 115 62.696 59.264 3.432 1
1 1360 . 5 1 1 A 115 115 TRP CB C 115 29.052 29.332 -0.280 1
1 1366 . 5 1 1 A 115 115 TRP N N 115 120.974 120.733 0.241 1
1 1368 . 5 1 1 A 116 116 ILE H H 116 8.297 8.786 -0.489 1
1 1369 . 5 1 1 A 116 116 ILE HA H 116 3.270 3.403 -0.133 1
1 1379 . 5 1 1 A 116 116 ILE C C 116 177.568 177.708 -0.140 1
1 1380 . 5 1 1 A 116 116 ILE CA C 116 66.643 64.906 1.737 1
1 1381 . 5 1 1 A 116 116 ILE CB C 116 37.606 37.392 0.214 1
1 1385 . 5 1 1 A 116 116 ILE N N 116 118.408 119.749 -1.341 1
1 1386 . 5 1 1 A 117 117 GLU H H 117 8.026 8.994 -0.968 1
1 1387 . 5 1 1 A 117 117 GLU HA H 117 3.880 3.974 -0.094 1
1 1392 . 5 1 1 A 117 117 GLU C C 117 178.476 178.891 -0.415 1
1 1393 . 5 1 1 A 117 117 GLU CA C 117 59.219 59.703 -0.484 1
1 1394 . 5 1 1 A 117 117 GLU CB C 117 29.381 29.342 0.039 1
1 1396 . 5 1 1 A 117 117 GLU N N 117 117.096 120.633 -3.537 1
1 1397 . 5 1 1 A 118 118 ALA H H 118 7.555 8.107 -0.552 1
1 1398 . 5 1 1 A 118 118 ALA HA H 118 3.952 4.044 -0.092 1
1 1402 . 5 1 1 A 118 118 ALA C C 118 179.862 179.872 -0.010 1
1 1403 . 5 1 1 A 118 118 ALA CA C 118 54.772 55.111 -0.339 1
1 1404 . 5 1 1 A 118 118 ALA CB C 118 18.277 18.343 -0.066 1
1 1405 . 5 1 1 A 118 118 ALA N N 118 119.817 121.830 -2.013 1
1 1406 . 5 1 1 A 119 119 ILE H H 119 8.167 8.357 -0.190 1
1 1407 . 5 1 1 A 119 119 ILE HA H 119 3.558 3.660 -0.102 1
1 1417 . 5 1 1 A 119 119 ILE C C 119 178.564 178.097 0.467 1
1 1418 . 5 1 1 A 119 119 ILE CA C 119 65.766 65.610 0.156 1
1 1419 . 5 1 1 A 119 119 ILE CB C 119 38.840 38.175 0.665 1
1 1423 . 5 1 1 A 119 119 ILE N N 119 116.280 117.457 -1.177 1
1 1424 . 5 1 1 A 120 120 LYS H H 120 8.790 8.308 0.482 1
1 1425 . 5 1 1 A 120 120 LYS HA H 120 3.965 4.140 -0.175 1
1 1434 . 5 1 1 A 120 120 LYS C C 120 179.673 179.256 0.417 1
1 1435 . 5 1 1 A 120 120 LYS CA C 120 60.031 60.253 -0.222 1
1 1436 . 5 1 1 A 120 120 LYS CB C 120 32.547 32.387 0.160 1
1 1440 . 5 1 1 A 120 120 LYS N N 120 119.650 118.648 1.002 1
1 1441 . 5 1 1 A 121 121 LYS H H 121 7.594 7.680 -0.086 1
1 1442 . 5 1 1 A 121 121 LYS HA H 121 4.095 3.995 0.100 1
1 1451 . 5 1 1 A 121 121 LYS C C 121 177.962 179.225 -1.263 1
1 1452 . 5 1 1 A 121 121 LYS CA C 121 58.848 59.099 -0.251 1
1 1453 . 5 1 1 A 121 121 LYS CB C 121 32.547 32.310 0.237 1
1 1457 . 5 1 1 A 121 121 LYS N N 121 117.197 120.278 -3.081 1
1 1458 . 5 1 1 A 122 122 LEU H H 122 7.586 7.823 -0.237 1
1 1459 . 5 1 1 A 122 122 LEU HA H 122 4.535 3.895 0.640 1
1 1469 . 5 1 1 A 122 122 LEU C C 122 177.902 179.142 -1.240 1
1 1470 . 5 1 1 A 122 122 LEU CA C 122 55.071 57.978 -2.907 1
1 1471 . 5 1 1 A 122 122 LEU CB C 122 42.888 41.822 1.066 1
1 1475 . 5 1 1 A 122 122 LEU N N 122 116.861 120.315 -3.454 1
1 1476 . 5 1 1 A 123 123 THR H H 123 7.636 7.979 -0.343 1
1 1477 . 5 1 1 A 123 123 THR HA H 123 4.445 4.116 0.329 1
1 1482 . 5 1 1 A 123 123 THR C C 123 175.714 174.694 1.020 1
1 1483 . 5 1 1 A 123 123 THR CA C 123 62.643 64.797 -2.154 1
1 1484 . 5 1 1 A 123 123 THR CB C 123 70.259 68.833 1.426 1
1 1486 . 5 1 1 A 123 123 THR N N 123 108.963 110.212 -1.249 1
1 1487 . 5 1 1 A 124 124 SER H H 124 7.912 8.194 -0.282 1
1 1488 . 5 1 1 A 124 124 SER HA H 124 4.626 4.698 -0.072 1
1 1491 . 5 1 1 A 124 124 SER C C 124 174.405 173.058 1.347 1
1 1492 . 5 1 1 A 124 124 SER CA C 124 58.390 58.102 0.288 1
1 1493 . 5 1 1 A 124 124 SER CB C 124 64.255 64.907 -0.652 1
1 1494 . 5 1 1 A 124 124 SER N N 124 116.876 115.492 1.384 1
1 1495 . 5 1 1 A 125 125 GLY H H 125 8.307 8.805 -0.498 1
1 1496 . 5 1 1 A 125 125 GLY HA2 H 125 4.166 4.124 0.042 1
1 1497 . 5 1 1 A 125 125 GLY HA3 H 125 4.166 4.125 0.041 1
1 1498 . 5 1 1 A 125 125 GLY C C 125 171.921 173.570 -1.649 1
1 1499 . 5 1 1 A 125 125 GLY CA C 125 44.748 44.715 0.033 1
1 1500 . 5 1 1 A 125 125 GLY N N 125 110.006 114.995 -4.989 1
1 1501 . 5 1 1 A 126 126 PRO HA H 126 4.510 4.543 -0.033 1
1 1508 . 5 1 1 A 126 126 PRO C C 126 177.471 176.644 0.827 1
1 1509 . 5 1 1 A 126 126 PRO CA C 126 63.419 62.382 1.037 1
1 1510 . 5 1 1 A 126 126 PRO CB C 126 32.106 32.582 -0.476 1
1 1513 . 5 1 1 A 127 127 SER H H 127 8.607 8.330 0.277 1
1 1514 . 5 1 1 A 127 127 SER C C 127 174.628 174.505 0.123 1
1 1515 . 5 1 1 A 127 127 SER CA C 127 58.513 58.777 -0.264 1
1 1516 . 5 1 1 A 127 127 SER CB C 127 63.679 63.132 0.547 1
1 1517 . 5 1 1 A 127 127 SER N N 127 116.390 116.123 0.267 1
1 1518 . 5 1 1 A 128 128 SER H H 128 8.272 8.541 -0.269 1
1 1519 . 5 1 1 A 128 128 SER HA H 128 4.496 4.350 0.146 1
1 1520 . 5 1 1 A 128 128 SER C C 128 173.921 173.514 0.407 1
1 1521 . 5 1 1 A 128 128 SER CA C 128 58.442 60.432 -1.990 1
1 1522 . 5 1 1 A 128 128 SER CB C 128 64.173 62.227 1.946 1
1 1523 . 5 1 1 A 128 128 SER N N 128 117.506 116.425 1.081 1
1 1 . 6 1 1 A 7 7 GLY HA2 H 7 3.978 4.062 -0.084 1
1 2 . 6 1 1 A 7 7 GLY HA3 H 7 3.978 4.064 -0.086 1
1 3 . 6 1 1 A 7 7 GLY C C 7 174.274 172.904 1.370 1
1 4 . 6 1 1 A 7 7 GLY CA C 7 45.383 44.542 0.841 1
1 5 . 6 1 1 A 8 8 SER H H 8 8.211 8.347 -0.136 1
1 6 . 6 1 1 A 8 8 SER HA H 8 4.425 4.612 -0.187 1
1 9 . 6 1 1 A 8 8 SER C C 8 174.635 174.548 0.087 1
1 10 . 6 1 1 A 8 8 SER CA C 8 58.425 59.349 -0.924 1
1 11 . 6 1 1 A 8 8 SER CB C 8 63.885 64.760 -0.875 1
1 12 . 6 1 1 A 8 8 SER N N 8 115.732 116.360 -0.628 1
1 13 . 6 1 1 A 9 9 LEU H H 9 8.316 8.153 0.163 1
1 14 . 6 1 1 A 9 9 LEU HA H 9 4.334 3.810 0.524 1
1 24 . 6 1 1 A 9 9 LEU C C 9 177.447 175.160 2.287 1
1 25 . 6 1 1 A 9 9 LEU CA C 9 55.407 55.940 -0.533 1
1 26 . 6 1 1 A 9 9 LEU CB C 9 42.171 40.262 1.909 1
1 30 . 6 1 1 A 9 9 LEU N N 9 123.943 120.481 3.462 1
1 31 . 6 1 1 A 10 10 SER H H 10 8.304 7.748 0.556 1
1 32 . 6 1 1 A 10 10 SER HA H 10 4.424 4.805 -0.381 1
1 35 . 6 1 1 A 10 10 SER C C 10 175.025 173.384 1.641 1
1 36 . 6 1 1 A 10 10 SER CA C 10 58.425 57.894 0.531 1
1 37 . 6 1 1 A 10 10 SER CB C 10 63.638 64.804 -1.166 1
1 38 . 6 1 1 A 10 10 SER N N 10 116.718 113.459 3.259 1
1 39 . 6 1 1 A 11 11 THR H H 11 8.003 8.980 -0.977 1
1 40 . 6 1 1 A 11 11 THR HA H 11 4.196 4.783 -0.587 1
1 45 . 6 1 1 A 11 11 THR C C 11 176.296 174.046 2.250 1
1 46 . 6 1 1 A 11 11 THR CA C 11 62.483 61.720 0.763 1
1 47 . 6 1 1 A 11 11 THR CB C 11 69.266 71.003 -1.737 1
1 49 . 6 1 1 A 11 11 THR N N 11 114.902 122.405 -7.503 1
1 50 . 6 1 1 A 12 12 VAL H H 12 8.095 8.603 -0.508 1
1 51 . 6 1 1 A 12 12 VAL HA H 12 3.826 4.157 -0.331 1
1 59 . 6 1 1 A 12 12 VAL C C 12 178.501 176.765 1.736 1
1 60 . 6 1 1 A 12 12 VAL CA C 12 64.760 63.420 1.340 1
1 61 . 6 1 1 A 12 12 VAL CB C 12 32.013 32.718 -0.705 1
1 64 . 6 1 1 A 12 12 VAL N N 12 122.111 120.613 1.498 1
1 65 . 6 1 1 A 13 13 GLU H H 13 8.151 8.873 -0.722 1
1 66 . 6 1 1 A 13 13 GLU HA H 13 3.244 3.377 -0.133 1
1 71 . 6 1 1 A 13 13 GLU C C 13 175.702 178.486 -2.784 1
1 72 . 6 1 1 A 13 13 GLU CA C 13 58.354 59.055 -0.701 1
1 73 . 6 1 1 A 13 13 GLU CB C 13 28.843 28.436 0.407 1
1 75 . 6 1 1 A 13 13 GLU N N 13 120.316 122.979 -2.663 1
1 76 . 6 1 1 A 14 14 LEU H H 14 7.067 7.586 -0.519 1
1 77 . 6 1 1 A 14 14 LEU HA H 14 4.157 4.117 0.040 1
1 87 . 6 1 1 A 14 14 LEU C C 14 176.863 177.845 -0.982 1
1 88 . 6 1 1 A 14 14 LEU CA C 14 53.324 55.490 -2.166 1
1 89 . 6 1 1 A 14 14 LEU CB C 14 41.636 41.789 -0.153 1
1 93 . 6 1 1 A 14 14 LEU N N 14 117.035 119.720 -2.685 1
1 94 . 6 1 1 A 15 15 SER H H 15 7.645 7.522 0.123 1
1 95 . 6 1 1 A 15 15 SER HA H 15 4.305 4.448 -0.143 1
1 98 . 6 1 1 A 15 15 SER C C 15 175.340 173.016 2.324 1
1 99 . 6 1 1 A 15 15 SER CA C 15 59.783 57.499 2.284 1
1 100 . 6 1 1 A 15 15 SER CB C 15 64.625 61.685 2.940 1
1 101 . 6 1 1 A 15 15 SER N N 15 114.216 113.580 0.636 1
1 102 . 6 1 1 A 16 16 GLY H H 16 8.506 8.226 0.280 1
1 103 . 6 1 1 A 16 16 GLY HA2 H 16 4.237 4.288 -0.051 1
1 104 . 6 1 1 A 16 16 GLY HA3 H 16 3.927 4.307 -0.380 1
1 105 . 6 1 1 A 16 16 GLY C C 16 173.661 172.191 1.470 1
1 106 . 6 1 1 A 16 16 GLY CA C 16 44.995 44.564 0.431 1
1 107 . 6 1 1 A 16 16 GLY N N 16 111.838 112.303 -0.465 1
1 108 . 6 1 1 A 17 17 THR H H 17 8.482 9.042 -0.560 1
1 109 . 6 1 1 A 17 17 THR HA H 17 4.319 4.548 -0.229 1
1 114 . 6 1 1 A 17 17 THR C C 17 174.758 174.650 0.108 1
1 115 . 6 1 1 A 17 17 THR CA C 17 62.272 62.776 -0.504 1
1 116 . 6 1 1 A 17 17 THR CB C 17 70.706 69.331 1.375 1
1 118 . 6 1 1 A 17 17 THR N N 17 116.679 115.223 1.456 1
1 119 . 6 1 1 A 18 18 VAL H H 18 8.948 8.750 0.198 1
1 120 . 6 1 1 A 18 18 VAL HA H 18 3.950 4.152 -0.202 1
1 128 . 6 1 1 A 18 18 VAL C C 18 176.669 176.686 -0.017 1
1 129 . 6 1 1 A 18 18 VAL CA C 18 64.813 63.222 1.591 1
1 130 . 6 1 1 A 18 18 VAL CB C 18 31.807 31.817 -0.010 1
1 133 . 6 1 1 A 18 18 VAL N N 18 127.156 125.929 1.227 1
1 134 . 6 1 1 A 19 19 VAL H H 19 9.359 9.541 -0.182 1
1 135 . 6 1 1 A 19 19 VAL HA H 19 4.234 4.372 -0.138 1
1 143 . 6 1 1 A 19 19 VAL C C 19 175.738 175.677 0.061 1
1 144 . 6 1 1 A 19 19 VAL CA C 19 62.060 62.306 -0.246 1
1 145 . 6 1 1 A 19 19 VAL CB C 19 33.822 33.364 0.458 1
1 148 . 6 1 1 A 19 19 VAL N N 19 125.162 121.438 3.724 1
1 149 . 6 1 1 A 20 20 LYS H H 20 7.584 7.345 0.239 1
1 150 . 6 1 1 A 20 20 LYS HA H 20 4.346 4.664 -0.318 1
1 159 . 6 1 1 A 20 20 LYS C C 20 172.818 174.055 -1.237 1
1 160 . 6 1 1 A 20 20 LYS CA C 20 56.801 55.468 1.333 1
1 161 . 6 1 1 A 20 20 LYS CB C 20 36.624 35.319 1.305 1
1 165 . 6 1 1 A 20 20 LYS N N 20 121.024 120.905 0.119 1
1 166 . 6 1 1 A 21 21 GLN H H 21 8.625 8.533 0.092 1
1 167 . 6 1 1 A 21 21 GLN HA H 21 6.003 5.402 0.601 1
1 174 . 6 1 1 A 21 21 GLN C C 21 174.914 175.067 -0.153 1
1 175 . 6 1 1 A 21 21 GLN CA C 21 54.207 54.542 -0.335 1
1 176 . 6 1 1 A 21 21 GLN CB C 21 33.452 33.240 0.212 1
1 178 . 6 1 1 A 21 21 GLN N N 21 122.108 124.122 -2.014 1
1 180 . 6 1 1 A 22 22 GLY H H 22 8.964 8.426 0.538 1
1 181 . 6 1 1 A 22 22 GLY HA2 H 22 4.665 4.403 0.262 1
1 182 . 6 1 1 A 22 22 GLY HA3 H 22 4.295 4.597 -0.302 1
1 183 . 6 1 1 A 22 22 GLY C C 22 170.879 171.654 -0.775 1
1 184 . 6 1 1 A 22 22 GLY CA C 22 45.683 46.182 -0.499 1
1 185 . 6 1 1 A 22 22 GLY N N 22 108.508 109.182 -0.674 1
1 186 . 6 1 1 A 23 23 TYR H H 23 9.145 8.807 0.338 1
1 187 . 6 1 1 A 23 23 TYR HA H 23 5.595 5.633 -0.038 1
1 194 . 6 1 1 A 23 23 TYR C C 23 175.824 175.335 0.489 1
1 195 . 6 1 1 A 23 23 TYR CA C 23 58.019 56.582 1.437 1
1 196 . 6 1 1 A 23 23 TYR CB C 23 39.251 40.947 -1.696 1
1 201 . 6 1 1 A 23 23 TYR N N 23 120.809 120.121 0.688 1
1 202 . 6 1 1 A 24 24 LEU H H 24 8.935 9.716 -0.781 1
1 203 . 6 1 1 A 24 24 LEU HA H 24 4.716 5.044 -0.328 1
1 213 . 6 1 1 A 24 24 LEU C C 24 174.648 175.997 -1.349 1
1 214 . 6 1 1 A 24 24 LEU CA C 24 53.907 53.273 0.634 1
1 215 . 6 1 1 A 24 24 LEU CB C 24 46.078 44.803 1.275 1
1 219 . 6 1 1 A 24 24 LEU N N 24 122.887 124.758 -1.871 1
1 220 . 6 1 1 A 25 25 ALA H H 25 8.145 8.903 -0.758 1
1 221 . 6 1 1 A 25 25 ALA HA H 25 5.477 5.601 -0.124 1
1 225 . 6 1 1 A 25 25 ALA C C 25 175.751 175.493 0.258 1
1 226 . 6 1 1 A 25 25 ALA CA C 25 50.719 50.491 0.228 1
1 227 . 6 1 1 A 25 25 ALA CB C 25 21.074 20.568 0.506 1
1 228 . 6 1 1 A 25 25 ALA N N 25 122.280 123.306 -1.026 1
1 229 . 6 1 1 A 26 26 LYS H H 26 9.167 8.603 0.564 1
1 230 . 6 1 1 A 26 26 LYS HA H 26 5.221 4.455 0.766 1
1 239 . 6 1 1 A 26 26 LYS C C 26 175.421 176.014 -0.593 1
1 240 . 6 1 1 A 26 26 LYS CA C 26 54.383 55.059 -0.676 1
1 241 . 6 1 1 A 26 26 LYS CB C 26 36.125 33.720 2.405 1
1 245 . 6 1 1 A 26 26 LYS N N 26 120.638 125.878 -5.240 1
1 246 . 6 1 1 A 27 27 GLN H H 27 7.866 7.719 0.147 1
1 247 . 6 1 1 A 27 27 GLN HA H 27 3.525 2.857 0.668 1
1 254 . 6 1 1 A 27 27 GLN C C 27 177.022 177.356 -0.334 1
1 255 . 6 1 1 A 27 27 GLN CA C 27 55.778 56.260 -0.482 1
1 256 . 6 1 1 A 27 27 GLN CB C 27 29.864 28.999 0.865 1
1 258 . 6 1 1 A 27 27 GLN N N 27 130.194 125.367 4.827 1
1 260 . 6 1 1 A 28 28 GLY H H 28 8.565 8.949 -0.384 1
1 261 . 6 1 1 A 28 28 GLY HA2 H 28 4.125 3.763 0.362 1
1 262 . 6 1 1 A 28 28 GLY HA3 H 28 4.034 3.788 0.246 1
1 263 . 6 1 1 A 28 28 GLY C C 28 174.030 174.838 -0.808 1
1 264 . 6 1 1 A 28 28 GLY CA C 28 45.665 47.524 -1.859 1
1 265 . 6 1 1 A 28 28 GLY N N 28 115.528 113.026 2.502 1
1 266 . 6 1 1 A 29 29 HIS HA H 29 4.355 4.356 -0.001 1
1 271 . 6 1 1 A 29 29 HIS CA C 29 58.795 58.062 0.733 1
1 272 . 6 1 1 A 29 29 HIS CB C 29 31.283 29.236 2.047 1
1 275 . 6 1 1 A 30 30 LYS HA H 30 4.096 4.028 0.068 1
1 284 . 6 1 1 A 30 30 LYS CA C 30 57.290 58.889 -1.599 1
1 285 . 6 1 1 A 30 30 LYS CB C 30 31.951 32.838 -0.887 1
1 289 . 6 1 1 A 31 31 ARG HA H 31 3.975 3.991 -0.016 1
1 296 . 6 1 1 A 31 31 ARG CA C 31 55.973 59.723 -3.750 1
1 297 . 6 1 1 A 31 31 ARG CB C 31 29.902 30.367 -0.465 1
1 300 . 6 1 1 A 32 32 LYS HA H 32 4.160 4.825 -0.665 1
1 309 . 6 1 1 A 32 32 LYS C C 32 175.678 176.384 -0.706 1
1 310 . 6 1 1 A 32 32 LYS CA C 32 56.254 54.284 1.970 1
1 311 . 6 1 1 A 32 32 LYS CB C 32 31.602 36.733 -5.131 1
1 315 . 6 1 1 A 33 33 ASN H H 33 7.925 8.800 -0.875 1
1 316 . 6 1 1 A 33 33 ASN HA H 33 4.799 4.755 0.044 1
1 321 . 6 1 1 A 33 33 ASN C C 33 174.005 174.979 -0.974 1
1 322 . 6 1 1 A 33 33 ASN CA C 33 52.407 55.513 -3.106 1
1 323 . 6 1 1 A 33 33 ASN CB C 33 39.879 38.987 0.892 1
1 324 . 6 1 1 A 33 33 ASN N N 33 116.990 118.524 -1.534 1
1 326 . 6 1 1 A 34 34 TRP H H 34 8.798 7.656 1.142 1
1 327 . 6 1 1 A 34 34 TRP HA H 34 4.755 5.429 -0.674 1
1 336 . 6 1 1 A 34 34 TRP C C 34 176.090 175.052 1.038 1
1 337 . 6 1 1 A 34 34 TRP CA C 34 57.119 55.999 1.120 1
1 338 . 6 1 1 A 34 34 TRP CB C 34 30.596 33.716 -3.120 1
1 344 . 6 1 1 A 34 34 TRP N N 34 121.917 115.265 6.652 1
1 346 . 6 1 1 A 35 35 LYS H H 35 8.404 8.351 0.053 1
1 347 . 6 1 1 A 35 35 LYS HA H 35 4.846 4.991 -0.145 1
1 354 . 6 1 1 A 35 35 LYS C C 35 176.088 175.715 0.373 1
1 355 . 6 1 1 A 35 35 LYS CA C 35 54.418 54.770 -0.352 1
1 356 . 6 1 1 A 35 35 LYS CB C 35 36.125 35.724 0.401 1
1 360 . 6 1 1 A 35 35 LYS N N 35 120.864 123.352 -2.488 1
1 361 . 6 1 1 A 36 36 VAL H H 36 8.977 8.757 0.220 1
1 362 . 6 1 1 A 36 36 VAL HA H 36 4.274 4.815 -0.541 1
1 370 . 6 1 1 A 36 36 VAL C C 36 176.733 175.904 0.829 1
1 371 . 6 1 1 A 36 36 VAL CA C 36 64.319 61.971 2.348 1
1 372 . 6 1 1 A 36 36 VAL CB C 36 31.602 32.507 -0.905 1
1 375 . 6 1 1 A 36 36 VAL N N 36 124.314 123.401 0.913 1
1 376 . 6 1 1 A 37 37 ARG H H 37 9.498 10.210 -0.712 1
1 377 . 6 1 1 A 37 37 ARG HA H 37 5.053 4.929 0.124 1
1 384 . 6 1 1 A 37 37 ARG C C 37 174.442 174.459 -0.017 1
1 385 . 6 1 1 A 37 37 ARG CA C 37 53.272 54.756 -1.484 1
1 386 . 6 1 1 A 37 37 ARG CB C 37 34.563 34.345 0.218 1
1 389 . 6 1 1 A 37 37 ARG N N 37 128.121 126.738 1.383 1
1 390 . 6 1 1 A 38 38 ARG H H 38 8.755 8.543 0.212 1
1 391 . 6 1 1 A 38 38 ARG HA H 38 4.626 4.333 0.293 1
1 398 . 6 1 1 A 38 38 ARG C C 38 175.514 175.057 0.457 1
1 399 . 6 1 1 A 38 38 ARG CA C 38 55.601 55.739 -0.138 1
1 400 . 6 1 1 A 38 38 ARG CB C 38 32.219 30.679 1.540 1
1 403 . 6 1 1 A 38 38 ARG N N 38 121.442 124.486 -3.044 1
1 404 . 6 1 1 A 39 39 PHE H H 39 9.865 8.983 0.882 1
1 405 . 6 1 1 A 39 39 PHE HA H 39 5.424 5.041 0.383 1
1 413 . 6 1 1 A 39 39 PHE C C 39 175.423 174.845 0.578 1
1 414 . 6 1 1 A 39 39 PHE CA C 39 57.419 57.067 0.352 1
1 415 . 6 1 1 A 39 39 PHE CB C 39 42.623 41.129 1.494 1
1 421 . 6 1 1 A 39 39 PHE N N 39 130.027 126.474 3.553 1
1 422 . 6 1 1 A 40 40 VAL H H 40 9.300 10.058 -0.758 1
1 423 . 6 1 1 A 40 40 VAL HA H 40 4.846 5.331 -0.485 1
1 431 . 6 1 1 A 40 40 VAL C C 40 174.477 173.443 1.034 1
1 432 . 6 1 1 A 40 40 VAL CA C 40 62.343 59.884 2.459 1
1 433 . 6 1 1 A 40 40 VAL CB C 40 35.755 35.035 0.720 1
1 436 . 6 1 1 A 40 40 VAL N N 40 119.369 122.180 -2.811 1
1 437 . 6 1 1 A 41 41 LEU H H 41 9.557 10.046 -0.489 1
1 438 . 6 1 1 A 41 41 LEU HA H 41 5.292 5.306 -0.014 1
1 448 . 6 1 1 A 41 41 LEU C C 41 174.632 175.524 -0.892 1
1 449 . 6 1 1 A 41 41 LEU CA C 41 53.571 53.904 -0.333 1
1 450 . 6 1 1 A 41 41 LEU CB C 41 45.337 44.119 1.218 1
1 454 . 6 1 1 A 41 41 LEU N N 41 132.121 129.379 2.742 1
1 455 . 6 1 1 A 42 42 ARG H H 42 9.396 8.832 0.564 1
1 456 . 6 1 1 A 42 42 ARG HA H 42 5.366 5.610 -0.244 1
1 464 . 6 1 1 A 42 42 ARG C C 42 173.997 175.310 -1.313 1
1 465 . 6 1 1 A 42 42 ARG CA C 42 54.631 54.355 0.276 1
1 466 . 6 1 1 A 42 42 ARG CB C 42 35.550 33.644 1.906 1
1 469 . 6 1 1 A 42 42 ARG N N 42 128.120 125.300 2.820 1
1 471 . 6 1 1 A 43 43 LYS H H 43 8.597 9.639 -1.042 1
1 472 . 6 1 1 A 43 43 LYS HA H 43 4.558 4.955 -0.397 1
1 481 . 6 1 1 A 43 43 LYS C C 43 174.648 175.312 -0.664 1
1 482 . 6 1 1 A 43 43 LYS CA C 43 53.378 54.666 -1.288 1
1 483 . 6 1 1 A 43 43 LYS CB C 43 37.303 35.871 1.432 1
1 487 . 6 1 1 A 43 43 LYS N N 43 114.484 119.606 -5.122 1
1 488 . 6 1 1 A 44 44 ASP H H 44 8.388 9.029 -0.641 1
1 489 . 6 1 1 A 44 44 ASP HA H 44 4.349 4.303 0.046 1
1 492 . 6 1 1 A 44 44 ASP C C 44 173.376 174.413 -1.037 1
1 493 . 6 1 1 A 44 44 ASP CA C 44 54.842 54.964 -0.122 1
1 494 . 6 1 1 A 44 44 ASP CB C 44 39.991 39.473 0.518 1
1 495 . 6 1 1 A 44 44 ASP N N 44 115.453 119.512 -4.059 1
1 496 . 6 1 1 A 45 45 PRO HA H 45 4.652 4.653 -0.001 1
1 503 . 6 1 1 A 45 45 PRO C C 45 176.914 175.582 1.332 1
1 504 . 6 1 1 A 45 45 PRO CA C 45 63.490 62.669 0.821 1
1 505 . 6 1 1 A 45 45 PRO CB C 45 34.892 32.672 2.220 1
1 508 . 6 1 1 A 46 46 ALA H H 46 8.112 8.447 -0.335 1
1 509 . 6 1 1 A 46 46 ALA HA H 46 5.455 4.723 0.732 1
1 513 . 6 1 1 A 46 46 ALA C C 46 177.234 176.623 0.611 1
1 514 . 6 1 1 A 46 46 ALA CA C 46 51.560 50.868 0.692 1
1 515 . 6 1 1 A 46 46 ALA CB C 46 20.122 19.821 0.301 1
1 516 . 6 1 1 A 46 46 ALA N N 46 120.155 123.413 -3.258 1
1 517 . 6 1 1 A 47 47 PHE H H 47 8.717 8.935 -0.218 1
1 518 . 6 1 1 A 47 47 PHE HA H 47 4.795 5.091 -0.296 1
1 526 . 6 1 1 A 47 47 PHE C C 47 172.588 174.220 -1.632 1
1 527 . 6 1 1 A 47 47 PHE CA C 47 57.348 56.339 1.009 1
1 528 . 6 1 1 A 47 47 PHE CB C 47 47.123 44.413 2.710 1
1 534 . 6 1 1 A 47 47 PHE N N 47 129.946 119.247 10.699 1
1 535 . 6 1 1 A 48 48 LEU H H 48 7.883 8.016 -0.133 1
1 536 . 6 1 1 A 48 48 LEU HA H 48 5.198 5.076 0.122 1
1 546 . 6 1 1 A 48 48 LEU C C 48 173.569 174.500 -0.931 1
1 547 . 6 1 1 A 48 48 LEU CA C 48 53.290 54.785 -1.495 1
1 548 . 6 1 1 A 48 48 LEU CB C 48 45.502 45.638 -0.136 1
1 552 . 6 1 1 A 48 48 LEU N N 48 121.108 121.036 0.072 1
1 553 . 6 1 1 A 49 49 HIS H H 49 8.606 9.016 -0.410 1
1 554 . 6 1 1 A 49 49 HIS HA H 49 5.035 5.092 -0.057 1
1 559 . 6 1 1 A 49 49 HIS C C 49 173.993 173.587 0.406 1
1 560 . 6 1 1 A 49 49 HIS CA C 49 56.483 53.977 2.506 1
1 561 . 6 1 1 A 49 49 HIS CB C 49 35.919 33.847 2.072 1
1 564 . 6 1 1 A 49 49 HIS N N 49 121.199 124.650 -3.451 1
1 565 . 6 1 1 A 50 50 TYR H H 50 7.777 7.986 -0.209 1
1 566 . 6 1 1 A 50 50 TYR HA H 50 5.695 5.666 0.029 1
1 573 . 6 1 1 A 50 50 TYR C C 50 174.284 172.469 1.815 1
1 574 . 6 1 1 A 50 50 TYR CA C 50 53.430 55.094 -1.664 1
1 575 . 6 1 1 A 50 50 TYR CB C 50 38.552 40.703 -2.151 1
1 580 . 6 1 1 A 50 50 TYR N N 50 114.156 117.497 -3.341 1
1 581 . 6 1 1 A 51 51 TYR H H 51 9.323 8.676 0.647 1
1 582 . 6 1 1 A 51 51 TYR HA H 51 4.600 4.899 -0.299 1
1 589 . 6 1 1 A 51 51 TYR C C 51 175.352 174.059 1.293 1
1 590 . 6 1 1 A 51 51 TYR CA C 51 57.330 56.541 0.789 1
1 591 . 6 1 1 A 51 51 TYR CB C 51 41.683 42.716 -1.033 1
1 596 . 6 1 1 A 51 51 TYR N N 51 119.100 116.914 2.186 1
1 597 . 6 1 1 A 52 52 ASP H H 52 9.375 8.742 0.633 1
1 598 . 6 1 1 A 52 52 ASP HA H 52 5.064 4.881 0.183 1
1 601 . 6 1 1 A 52 52 ASP C C 52 175.484 175.708 -0.224 1
1 602 . 6 1 1 A 52 52 ASP CA C 52 51.313 51.428 -0.115 1
1 603 . 6 1 1 A 52 52 ASP CB C 52 41.883 42.053 -0.170 1
1 604 . 6 1 1 A 52 52 ASP N N 52 124.636 123.891 0.745 1
1 605 . 6 1 1 A 53 53 PRO HA H 53 4.678 4.650 0.028 1
1 612 . 6 1 1 A 53 53 PRO C C 53 176.781 177.973 -1.192 1
1 613 . 6 1 1 A 53 53 PRO CA C 53 64.054 64.022 0.032 1
1 614 . 6 1 1 A 53 53 PRO CB C 53 32.589 32.094 0.495 1
1 617 . 6 1 1 A 54 54 SER H H 54 8.685 9.147 -0.462 1
1 618 . 6 1 1 A 54 54 SER HA H 54 4.483 4.584 -0.101 1
1 621 . 6 1 1 A 54 54 SER C C 54 174.006 174.519 -0.513 1
1 622 . 6 1 1 A 54 54 SER CA C 54 59.378 60.702 -1.324 1
1 623 . 6 1 1 A 54 54 SER CB C 54 64.132 64.375 -0.243 1
1 624 . 6 1 1 A 54 54 SER N N 54 113.769 113.045 0.724 1
1 625 . 6 1 1 A 55 55 LYS H H 55 7.706 7.938 -0.232 1
1 626 . 6 1 1 A 55 55 LYS HA H 55 4.580 4.451 0.129 1
1 635 . 6 1 1 A 55 55 LYS C C 55 175.969 175.468 0.501 1
1 636 . 6 1 1 A 55 55 LYS CA C 55 55.160 56.279 -1.119 1
1 637 . 6 1 1 A 55 55 LYS CB C 55 34.069 33.728 0.341 1
1 641 . 6 1 1 A 55 55 LYS N N 55 122.222 120.182 2.040 1
1 642 . 6 1 1 A 56 56 GLU H H 56 8.666 8.712 -0.046 1
1 643 . 6 1 1 A 56 56 GLU HA H 56 4.174 5.221 -1.047 1
1 648 . 6 1 1 A 56 56 GLU C C 56 177.084 175.015 2.069 1
1 649 . 6 1 1 A 56 56 GLU CA C 56 57.099 55.418 1.681 1
1 650 . 6 1 1 A 56 56 GLU CB C 56 29.694 31.801 -2.107 1
1 652 . 6 1 1 A 56 56 GLU N N 56 122.015 119.104 2.911 1
1 653 . 6 1 1 A 57 57 GLU H H 57 8.303 8.801 -0.498 1
1 654 . 6 1 1 A 57 57 GLU HA H 57 4.214 4.678 -0.464 1
1 659 . 6 1 1 A 57 57 GLU CA C 57 56.960 55.388 1.572 1
1 660 . 6 1 1 A 57 57 GLU CB C 57 30.264 33.523 -3.259 1
1 662 . 6 1 1 A 57 57 GLU N N 57 119.884 124.143 -4.259 1
1 663 . 6 1 1 A 58 58 ASN HA H 58 4.768 5.023 -0.255 1
1 668 . 6 1 1 A 58 58 ASN C C 58 174.902 172.399 2.503 1
1 669 . 6 1 1 A 58 58 ASN CA C 58 52.740 53.029 -0.289 1
1 670 . 6 1 1 A 58 58 ASN CB C 58 38.116 39.746 -1.630 1
1 672 . 6 1 1 A 59 59 ARG H H 59 7.805 7.712 0.093 1
1 673 . 6 1 1 A 59 59 ARG HA H 59 4.762 4.839 -0.077 1
1 680 . 6 1 1 A 59 59 ARG CA C 59 53.151 52.775 0.376 1
1 681 . 6 1 1 A 59 59 ARG CB C 59 31.519 32.079 -0.560 1
1 684 . 6 1 1 A 59 59 ARG N N 59 121.060 117.925 3.135 1
1 685 . 6 1 1 A 60 60 PRO HA H 60 3.357 4.186 -0.829 1
1 692 . 6 1 1 A 60 60 PRO C C 60 176.817 176.780 0.037 1
1 693 . 6 1 1 A 60 60 PRO CA C 60 63.031 61.892 1.139 1
1 694 . 6 1 1 A 60 60 PRO CB C 60 31.273 31.845 -0.572 1
1 697 . 6 1 1 A 61 61 VAL H H 61 8.627 7.873 0.754 1
1 698 . 6 1 1 A 61 61 VAL HA H 61 3.966 3.823 0.143 1
1 706 . 6 1 1 A 61 61 VAL C C 61 176.503 176.202 0.301 1
1 707 . 6 1 1 A 61 61 VAL CA C 61 63.154 64.687 -1.533 1
1 708 . 6 1 1 A 61 61 VAL CB C 61 32.048 32.437 -0.389 1
1 711 . 6 1 1 A 61 61 VAL N N 61 119.185 120.105 -0.920 1
1 712 . 6 1 1 A 62 62 GLY H H 62 6.715 6.664 0.051 1
1 713 . 6 1 1 A 62 62 GLY HA2 H 62 3.940 3.945 -0.005 1
1 714 . 6 1 1 A 62 62 GLY HA3 H 62 3.538 4.004 -0.466 1
1 715 . 6 1 1 A 62 62 GLY C C 62 169.983 172.055 -2.072 1
1 716 . 6 1 1 A 62 62 GLY CA C 62 44.465 45.724 -1.259 1
1 717 . 6 1 1 A 62 62 GLY N N 62 105.813 105.870 -0.057 1
1 718 . 6 1 1 A 63 63 GLY H H 63 8.004 8.637 -0.633 1
1 719 . 6 1 1 A 63 63 GLY HA2 H 63 4.095 3.415 0.680 1
1 720 . 6 1 1 A 63 63 GLY HA3 H 63 3.813 4.022 -0.209 1
1 721 . 6 1 1 A 63 63 GLY C C 63 171.870 172.386 -0.516 1
1 722 . 6 1 1 A 63 63 GLY CA C 63 47.148 44.157 2.991 1
1 723 . 6 1 1 A 63 63 GLY N N 63 105.089 108.011 -2.922 1
1 724 . 6 1 1 A 64 64 PHE H H 64 7.967 8.116 -0.149 1
1 725 . 6 1 1 A 64 64 PHE HA H 64 4.934 5.544 -0.610 1
1 733 . 6 1 1 A 64 64 PHE C C 64 173.140 173.485 -0.345 1
1 734 . 6 1 1 A 64 64 PHE CA C 64 55.248 55.584 -0.336 1
1 735 . 6 1 1 A 64 64 PHE CB C 64 40.238 41.855 -1.617 1
1 741 . 6 1 1 A 64 64 PHE N N 64 113.387 118.700 -5.313 1
1 742 . 6 1 1 A 65 65 SER H H 65 8.518 9.056 -0.538 1
1 743 . 6 1 1 A 65 65 SER HA H 65 3.264 4.024 -0.760 1
1 746 . 6 1 1 A 65 65 SER C C 65 176.417 173.707 2.710 1
1 747 . 6 1 1 A 65 65 SER CA C 65 56.819 58.497 -1.678 1
1 748 . 6 1 1 A 65 65 SER CB C 65 63.391 63.564 -0.173 1
1 749 . 6 1 1 A 65 65 SER N N 65 114.674 117.309 -2.635 1
1 750 . 6 1 1 A 66 66 LEU H H 66 7.404 7.524 -0.120 1
1 751 . 6 1 1 A 66 66 LEU HA H 66 4.470 4.649 -0.179 1
1 761 . 6 1 1 A 66 66 LEU C C 66 177.993 178.116 -0.123 1
1 762 . 6 1 1 A 66 66 LEU CA C 66 54.242 55.529 -1.287 1
1 763 . 6 1 1 A 66 66 LEU CB C 66 42.787 41.843 0.944 1
1 767 . 6 1 1 A 66 66 LEU N N 66 123.988 125.421 -1.433 1
1 768 . 6 1 1 A 67 67 ARG H H 67 7.865 7.726 0.139 1
1 769 . 6 1 1 A 67 67 ARG HA H 67 4.175 3.932 0.243 1
1 776 . 6 1 1 A 67 67 ARG C C 67 178.562 177.951 0.611 1
1 777 . 6 1 1 A 67 67 ARG CA C 67 58.143 59.259 -1.116 1
1 778 . 6 1 1 A 67 67 ARG CB C 67 29.052 30.037 -0.985 1
1 781 . 6 1 1 A 67 67 ARG N N 67 122.494 118.354 4.140 1
1 782 . 6 1 1 A 68 68 GLY H H 68 9.398 8.049 1.349 1
1 783 . 6 1 1 A 68 68 GLY HA2 H 68 4.066 3.942 0.124 1
1 784 . 6 1 1 A 68 68 GLY HA3 H 68 3.908 3.946 -0.038 1
1 785 . 6 1 1 A 68 68 GLY C C 68 173.982 174.081 -0.099 1
1 786 . 6 1 1 A 68 68 GLY CA C 68 46.230 45.899 0.331 1
1 787 . 6 1 1 A 68 68 GLY N N 68 117.548 107.799 9.749 1
1 788 . 6 1 1 A 69 69 SER H H 69 7.829 8.264 -0.435 1
1 789 . 6 1 1 A 69 69 SER HA H 69 4.807 5.216 -0.409 1
1 792 . 6 1 1 A 69 69 SER C C 69 172.854 173.317 -0.463 1
1 793 . 6 1 1 A 69 69 SER CA C 69 59.290 56.333 2.957 1
1 794 . 6 1 1 A 69 69 SER CB C 69 65.366 66.545 -1.179 1
1 795 . 6 1 1 A 69 69 SER N N 69 115.188 113.111 2.077 1
1 796 . 6 1 1 A 70 70 LEU H H 70 8.805 8.722 0.083 1
1 797 . 6 1 1 A 70 70 LEU HA H 70 4.846 4.926 -0.080 1
1 807 . 6 1 1 A 70 70 LEU C C 70 175.775 174.613 1.162 1
1 808 . 6 1 1 A 70 70 LEU CA C 70 53.907 53.697 0.210 1
1 809 . 6 1 1 A 70 70 LEU CB C 70 45.337 44.198 1.139 1
1 813 . 6 1 1 A 70 70 LEU N N 70 121.265 121.641 -0.376 1
1 814 . 6 1 1 A 71 71 VAL H H 71 8.644 8.691 -0.047 1
1 815 . 6 1 1 A 71 71 VAL HA H 71 5.555 5.130 0.425 1
1 823 . 6 1 1 A 71 71 VAL C C 71 173.636 173.388 0.248 1
1 824 . 6 1 1 A 71 71 VAL CA C 71 58.760 60.291 -1.531 1
1 825 . 6 1 1 A 71 71 VAL CB C 71 34.891 35.469 -0.578 1
1 828 . 6 1 1 A 71 71 VAL N N 71 122.315 120.976 1.339 1
1 829 . 6 1 1 A 72 72 SER H H 72 8.750 8.651 0.099 1
1 830 . 6 1 1 A 72 72 SER HA H 72 4.742 4.971 -0.229 1
1 833 . 6 1 1 A 72 72 SER C C 72 173.058 172.655 0.403 1
1 834 . 6 1 1 A 72 72 SER CA C 72 57.190 57.791 -0.601 1
1 835 . 6 1 1 A 72 72 SER CB C 72 65.612 67.549 -1.937 1
1 836 . 6 1 1 A 72 72 SER N N 72 118.611 120.991 -2.380 1
1 837 . 6 1 1 A 73 73 ALA H H 73 9.009 8.675 0.334 1
1 838 . 6 1 1 A 73 73 ALA HA H 73 4.406 5.082 -0.676 1
1 842 . 6 1 1 A 73 73 ALA C C 73 176.708 177.226 -0.518 1
1 843 . 6 1 1 A 73 73 ALA CA C 73 52.672 50.344 2.328 1
1 844 . 6 1 1 A 73 73 ALA CB C 73 18.812 20.492 -1.680 1
1 845 . 6 1 1 A 73 73 ALA N N 73 125.694 125.694 0.000 1
1 846 . 6 1 1 A 74 74 LEU H H 74 7.800 8.316 -0.516 1
1 847 . 6 1 1 A 74 74 LEU HA H 74 4.716 4.376 0.340 1
1 857 . 6 1 1 A 74 74 LEU C C 74 176.551 176.285 0.266 1
1 858 . 6 1 1 A 74 74 LEU CA C 74 53.784 54.645 -0.861 1
1 859 . 6 1 1 A 74 74 LEU CB C 74 43.446 40.519 2.927 1
1 863 . 6 1 1 A 74 74 LEU N N 74 122.271 123.094 -0.823 1
1 864 . 6 1 1 A 75 75 GLU H H 75 8.855 8.600 0.255 1
1 865 . 6 1 1 A 75 75 GLU HA H 75 4.336 4.649 -0.313 1
1 870 . 6 1 1 A 75 75 GLU C C 75 176.465 175.625 0.840 1
1 871 . 6 1 1 A 75 75 GLU CA C 75 56.507 54.227 2.280 1
1 872 . 6 1 1 A 75 75 GLU CB C 75 30.245 30.954 -0.709 1
1 874 . 6 1 1 A 75 75 GLU N N 75 122.678 125.690 -3.012 1
1 875 . 6 1 1 A 76 76 ASP H H 76 8.542 9.077 -0.535 1
1 876 . 6 1 1 A 76 76 ASP HA H 76 4.665 4.254 0.411 1
1 879 . 6 1 1 A 76 76 ASP C C 76 176.087 175.441 0.646 1
1 880 . 6 1 1 A 76 76 ASP CA C 76 55.107 54.900 0.207 1
1 881 . 6 1 1 A 76 76 ASP CB C 76 41.431 39.339 2.092 1
1 882 . 6 1 1 A 76 76 ASP N N 76 121.488 119.760 1.728 1
1 883 . 6 1 1 A 77 77 ASN H H 77 8.322 8.105 0.217 1
1 884 . 6 1 1 A 77 77 ASN HA H 77 4.729 4.392 0.337 1
1 889 . 6 1 1 A 77 77 ASN C C 77 175.566 175.854 -0.288 1
1 890 . 6 1 1 A 77 77 ASN CA C 77 53.131 54.768 -1.637 1
1 891 . 6 1 1 A 77 77 ASN CB C 77 38.617 39.049 -0.432 1
1 892 . 6 1 1 A 77 77 ASN N N 77 118.676 120.995 -2.319 1
1 894 . 6 1 1 A 78 78 GLY H H 78 8.311 8.647 -0.336 1
1 895 . 6 1 1 A 78 78 GLY HA2 H 78 3.897 4.118 -0.221 1
1 896 . 6 1 1 A 78 78 GLY HA3 H 78 3.897 4.122 -0.225 1
1 897 . 6 1 1 A 78 78 GLY C C 78 173.376 174.077 -0.701 1
1 898 . 6 1 1 A 78 78 GLY CA C 78 45.224 44.168 1.056 1
1 899 . 6 1 1 A 78 78 GLY N N 78 108.939 108.686 0.253 1
1 900 . 6 1 1 A 79 79 VAL H H 79 7.882 8.461 -0.579 1
1 901 . 6 1 1 A 79 79 VAL HA H 79 4.345 4.181 0.164 1
1 909 . 6 1 1 A 79 79 VAL CA C 79 59.995 60.518 -0.523 1
1 910 . 6 1 1 A 79 79 VAL CB C 79 32.589 32.391 0.198 1
1 913 . 6 1 1 A 79 79 VAL N N 79 121.135 121.290 -0.155 1
1 914 . 6 1 1 A 80 80 PRO HA H 80 4.461 4.558 -0.097 1
1 921 . 6 1 1 A 80 80 PRO C C 80 176.979 176.816 0.163 1
1 922 . 6 1 1 A 80 80 PRO CA C 80 63.101 63.593 -0.492 1
1 923 . 6 1 1 A 80 80 PRO CB C 80 32.177 31.850 0.327 1
1 926 . 6 1 1 A 81 81 THR H H 81 8.281 8.582 -0.301 1
1 927 . 6 1 1 A 81 81 THR HA H 81 4.095 4.012 0.083 1
1 932 . 6 1 1 A 81 81 THR C C 81 175.270 174.279 0.991 1
1 933 . 6 1 1 A 81 81 THR CA C 81 62.872 64.517 -1.645 1
1 934 . 6 1 1 A 81 81 THR CB C 81 69.642 67.510 2.132 1
1 936 . 6 1 1 A 81 81 THR N N 81 114.684 110.913 3.771 1
1 937 . 6 1 1 A 82 82 GLY H H 82 8.338 8.439 -0.101 1
1 938 . 6 1 1 A 82 82 GLY HA2 H 82 4.095 4.125 -0.030 1
1 939 . 6 1 1 A 82 82 GLY HA3 H 82 3.668 4.138 -0.470 1
1 940 . 6 1 1 A 82 82 GLY C C 82 174.139 174.868 -0.729 1
1 941 . 6 1 1 A 82 82 GLY CA C 82 45.083 45.813 -0.730 1
1 942 . 6 1 1 A 82 82 GLY N N 82 111.289 112.789 -1.500 1
1 943 . 6 1 1 A 83 83 VAL H H 83 7.668 7.940 -0.272 1
1 944 . 6 1 1 A 83 83 VAL HA H 83 3.985 3.746 0.239 1
1 952 . 6 1 1 A 83 83 VAL C C 83 176.054 175.474 0.580 1
1 953 . 6 1 1 A 83 83 VAL CA C 83 62.431 65.209 -2.778 1
1 954 . 6 1 1 A 83 83 VAL CB C 83 32.260 31.774 0.486 1
1 957 . 6 1 1 A 83 83 VAL N N 83 120.003 117.999 2.004 1
1 958 . 6 1 1 A 84 84 LYS H H 84 8.645 7.996 0.649 1
1 959 . 6 1 1 A 84 84 LYS HA H 84 4.276 3.924 0.352 1
1 968 . 6 1 1 A 84 84 LYS C C 84 176.832 176.359 0.473 1
1 969 . 6 1 1 A 84 84 LYS CA C 84 56.272 57.340 -1.068 1
1 970 . 6 1 1 A 84 84 LYS CB C 84 32.876 30.761 2.115 1
1 974 . 6 1 1 A 84 84 LYS N N 84 126.447 119.089 7.358 1
1 975 . 6 1 1 A 85 85 GLY H H 85 8.410 8.292 0.118 1
1 976 . 6 1 1 A 85 85 GLY HA2 H 85 4.066 4.134 -0.068 1
1 977 . 6 1 1 A 85 85 GLY HA3 H 85 3.781 4.151 -0.370 1
1 978 . 6 1 1 A 85 85 GLY C C 85 173.969 173.517 0.452 1
1 979 . 6 1 1 A 85 85 GLY CA C 85 45.146 45.215 -0.069 1
1 980 . 6 1 1 A 85 85 GLY N N 85 109.957 104.740 5.217 1
1 981 . 6 1 1 A 86 86 ASN H H 86 8.298 8.585 -0.287 1
1 982 . 6 1 1 A 86 86 ASN HA H 86 4.665 4.675 -0.010 1
1 987 . 6 1 1 A 86 86 ASN C C 86 174.987 174.909 0.078 1
1 988 . 6 1 1 A 86 86 ASN CA C 86 52.989 54.183 -1.194 1
1 989 . 6 1 1 A 86 86 ASN CB C 86 38.376 39.655 -1.279 1
1 990 . 6 1 1 A 86 86 ASN N N 86 118.457 123.565 -5.108 1
1 992 . 6 1 1 A 87 87 VAL H H 87 7.660 8.476 -0.816 1
1 993 . 6 1 1 A 87 87 VAL HA H 87 3.946 4.039 -0.093 1
1 1001 . 6 1 1 A 87 87 VAL C C 87 174.902 176.233 -1.331 1
1 1002 . 6 1 1 A 87 87 VAL CA C 87 62.307 61.953 0.354 1
1 1003 . 6 1 1 A 87 87 VAL CB C 87 32.548 33.177 -0.629 1
1 1006 . 6 1 1 A 87 87 VAL N N 87 120.557 124.849 -4.292 1
1 1007 . 6 1 1 A 88 88 GLN H H 88 8.115 8.312 -0.197 1
1 1008 . 6 1 1 A 88 88 GLN HA H 88 4.302 3.910 0.392 1
1 1015 . 6 1 1 A 88 88 GLN C C 88 175.637 178.224 -2.587 1
1 1016 . 6 1 1 A 88 88 GLN CA C 88 55.336 58.300 -2.964 1
1 1017 . 6 1 1 A 88 88 GLN CB C 88 30.574 28.615 1.959 1
1 1019 . 6 1 1 A 88 88 GLN N N 88 122.280 120.658 1.622 1
1 1021 . 6 1 1 A 89 89 GLY H H 89 8.544 8.036 0.508 1
1 1022 . 6 1 1 A 89 89 GLY HA2 H 89 3.885 4.052 -0.167 1
1 1023 . 6 1 1 A 89 89 GLY HA3 H 89 3.885 4.057 -0.172 1
1 1024 . 6 1 1 A 89 89 GLY C C 89 172.861 175.159 -2.298 1
1 1025 . 6 1 1 A 89 89 GLY CA C 89 44.889 44.836 0.053 1
1 1026 . 6 1 1 A 89 89 GLY N N 89 110.135 108.155 1.980 1
1 1027 . 6 1 1 A 90 90 ASN H H 90 8.451 8.296 0.155 1
1 1028 . 6 1 1 A 90 90 ASN HA H 90 4.222 4.661 -0.439 1
1 1033 . 6 1 1 A 90 90 ASN C C 90 174.926 176.128 -1.202 1
1 1034 . 6 1 1 A 90 90 ASN CA C 90 54.613 55.552 -0.939 1
1 1035 . 6 1 1 A 90 90 ASN CB C 90 37.852 38.840 -0.988 1
1 1036 . 6 1 1 A 90 90 ASN N N 90 114.322 119.731 -5.409 1
1 1038 . 6 1 1 A 91 91 LEU H H 91 8.933 8.042 0.891 1
1 1039 . 6 1 1 A 91 91 LEU HA H 91 5.367 4.390 0.977 1
1 1049 . 6 1 1 A 91 91 LEU C C 91 178.732 175.857 2.875 1
1 1050 . 6 1 1 A 91 91 LEU CA C 91 55.160 57.207 -2.047 1
1 1051 . 6 1 1 A 91 91 LEU CB C 91 45.461 40.809 4.652 1
1 1055 . 6 1 1 A 91 91 LEU N N 91 120.057 118.077 1.980 1
1 1056 . 6 1 1 A 92 92 PHE H H 92 9.901 8.072 1.829 1
1 1057 . 6 1 1 A 92 92 PHE HA H 92 5.105 5.187 -0.082 1
1 1065 . 6 1 1 A 92 92 PHE C C 92 170.140 172.545 -2.405 1
1 1066 . 6 1 1 A 92 92 PHE CA C 92 56.236 55.815 0.421 1
1 1067 . 6 1 1 A 92 92 PHE CB C 92 42.664 41.829 0.835 1
1 1073 . 6 1 1 A 92 92 PHE N N 92 119.740 115.978 3.762 1
1 1074 . 6 1 1 A 93 93 LYS H H 93 9.154 9.055 0.099 1
1 1075 . 6 1 1 A 93 93 LYS HA H 93 5.584 5.157 0.427 1
1 1083 . 6 1 1 A 93 93 LYS C C 93 174.830 175.060 -0.230 1
1 1084 . 6 1 1 A 93 93 LYS CA C 93 53.148 53.754 -0.606 1
1 1085 . 6 1 1 A 93 93 LYS CB C 93 36.660 36.212 0.448 1
1 1089 . 6 1 1 A 93 93 LYS N N 93 117.710 118.277 -0.567 1
1 1090 . 6 1 1 A 94 94 VAL H H 94 8.507 8.606 -0.099 1
1 1091 . 6 1 1 A 94 94 VAL HA H 94 4.872 4.968 -0.096 1
1 1099 . 6 1 1 A 94 94 VAL C C 94 174.408 174.987 -0.579 1
1 1100 . 6 1 1 A 94 94 VAL CA C 94 60.525 61.652 -1.127 1
1 1101 . 6 1 1 A 94 94 VAL CB C 94 34.862 34.058 0.804 1
1 1104 . 6 1 1 A 94 94 VAL N N 94 121.741 120.237 1.504 1
1 1105 . 6 1 1 A 95 95 ILE H H 95 8.959 8.870 0.089 1
1 1106 . 6 1 1 A 95 95 ILE HA H 95 4.794 4.547 0.247 1
1 1116 . 6 1 1 A 95 95 ILE C C 95 177.642 176.213 1.429 1
1 1117 . 6 1 1 A 95 95 ILE CA C 95 59.713 60.717 -1.004 1
1 1118 . 6 1 1 A 95 95 ILE CB C 95 40.032 37.881 2.151 1
1 1122 . 6 1 1 A 95 95 ILE N N 95 126.794 128.515 -1.721 1
1 1123 . 6 1 1 A 96 96 THR H H 96 8.765 8.897 -0.132 1
1 1124 . 6 1 1 A 96 96 THR HA H 96 4.584 4.913 -0.329 1
1 1129 . 6 1 1 A 96 96 THR C C 96 177.023 176.196 0.827 1
1 1130 . 6 1 1 A 96 96 THR CA C 96 61.372 60.670 0.702 1
1 1131 . 6 1 1 A 96 96 THR CB C 96 70.794 70.699 0.095 1
1 1133 . 6 1 1 A 96 96 THR N N 96 117.225 119.950 -2.725 1
1 1134 . 6 1 1 A 97 97 LYS H H 97 8.736 8.987 -0.251 1
1 1135 . 6 1 1 A 97 97 LYS HA H 97 4.101 4.141 -0.040 1
1 1144 . 6 1 1 A 97 97 LYS C C 97 176.490 176.793 -0.303 1
1 1145 . 6 1 1 A 97 97 LYS CA C 97 58.583 58.464 0.119 1
1 1146 . 6 1 1 A 97 97 LYS CB C 97 31.848 31.835 0.013 1
1 1150 . 6 1 1 A 97 97 LYS N N 97 120.457 119.460 0.997 1
1 1151 . 6 1 1 A 98 98 ASP H H 98 7.762 7.670 0.092 1
1 1152 . 6 1 1 A 98 98 ASP HA H 98 4.633 4.762 -0.129 1
1 1155 . 6 1 1 A 98 98 ASP C C 98 175.270 174.851 0.419 1
1 1156 . 6 1 1 A 98 98 ASP CA C 98 53.272 53.755 -0.483 1
1 1157 . 6 1 1 A 98 98 ASP CB C 98 39.909 41.125 -1.216 1
1 1158 . 6 1 1 A 98 98 ASP N N 98 116.281 118.263 -1.982 1
1 1159 . 6 1 1 A 99 99 ASP H H 99 8.340 7.963 0.377 1
1 1160 . 6 1 1 A 99 99 ASP HA H 99 4.245 4.641 -0.396 1
1 1163 . 6 1 1 A 99 99 ASP C C 99 175.315 175.944 -0.629 1
1 1164 . 6 1 1 A 99 99 ASP CA C 99 55.989 55.338 0.651 1
1 1165 . 6 1 1 A 99 99 ASP CB C 99 39.827 39.896 -0.069 1
1 1166 . 6 1 1 A 99 99 ASP N N 99 116.687 117.894 -1.207 1
1 1167 . 6 1 1 A 100 100 THR H H 100 7.511 7.874 -0.363 1
1 1168 . 6 1 1 A 100 100 THR HA H 100 4.185 3.847 0.338 1
1 1173 . 6 1 1 A 100 100 THR C C 100 173.376 174.636 -1.260 1
1 1174 . 6 1 1 A 100 100 THR CA C 100 63.489 66.383 -2.894 1
1 1175 . 6 1 1 A 100 100 THR CB C 100 67.909 69.074 -1.165 1
1 1177 . 6 1 1 A 100 100 THR N N 100 116.525 111.624 4.901 1
1 1178 . 6 1 1 A 101 101 HIS H H 101 8.753 8.193 0.560 1
1 1179 . 6 1 1 A 101 101 HIS HA H 101 4.898 4.258 0.640 1
1 1184 . 6 1 1 A 101 101 HIS C C 101 174.345 173.611 0.734 1
1 1185 . 6 1 1 A 101 101 HIS CA C 101 55.072 56.125 -1.053 1
1 1186 . 6 1 1 A 101 101 HIS CB C 101 32.835 27.983 4.852 1
1 1189 . 6 1 1 A 101 101 HIS N N 101 125.953 116.879 9.074 1
1 1190 . 6 1 1 A 102 102 TYR H H 102 9.023 8.890 0.133 1
1 1191 . 6 1 1 A 102 102 TYR HA H 102 4.545 4.934 -0.389 1
1 1198 . 6 1 1 A 102 102 TYR C C 102 174.126 174.892 -0.766 1
1 1199 . 6 1 1 A 102 102 TYR CA C 102 57.260 56.382 0.878 1
1 1200 . 6 1 1 A 102 102 TYR CB C 102 40.381 39.584 0.797 1
1 1205 . 6 1 1 A 102 102 TYR N N 102 121.975 122.447 -0.472 1
1 1206 . 6 1 1 A 103 103 TYR H H 103 8.899 8.901 -0.002 1
1 1207 . 6 1 1 A 103 103 TYR HA H 103 4.729 4.865 -0.136 1
1 1214 . 6 1 1 A 103 103 TYR C C 103 174.139 175.382 -1.243 1
1 1215 . 6 1 1 A 103 103 TYR CA C 103 58.036 57.982 0.054 1
1 1216 . 6 1 1 A 103 103 TYR CB C 103 40.485 38.694 1.791 1
1 1221 . 6 1 1 A 103 103 TYR N N 103 122.012 123.775 -1.763 1
1 1222 . 6 1 1 A 104 104 ILE H H 104 8.605 8.555 0.050 1
1 1223 . 6 1 1 A 104 104 ILE HA H 104 4.859 4.876 -0.017 1
1 1233 . 6 1 1 A 104 104 ILE C C 104 172.769 174.621 -1.852 1
1 1234 . 6 1 1 A 104 104 ILE CA C 104 59.554 59.544 0.010 1
1 1235 . 6 1 1 A 104 104 ILE CB C 104 40.631 40.655 -0.024 1
1 1239 . 6 1 1 A 104 104 ILE N N 104 123.443 123.651 -0.208 1
1 1240 . 6 1 1 A 105 105 GLN H H 105 9.369 8.417 0.952 1
1 1241 . 6 1 1 A 105 105 GLN HA H 105 4.895 5.229 -0.334 1
1 1248 . 6 1 1 A 105 105 GLN C C 105 175.642 174.178 1.464 1
1 1249 . 6 1 1 A 105 105 GLN CA C 105 54.965 54.091 0.874 1
1 1250 . 6 1 1 A 105 105 GLN CB C 105 32.856 32.471 0.385 1
1 1252 . 6 1 1 A 105 105 GLN N N 105 125.079 123.887 1.192 1
1 1254 . 6 1 1 A 106 106 ALA H H 106 8.513 8.398 0.115 1
1 1255 . 6 1 1 A 106 106 ALA HA H 106 4.962 4.765 0.197 1
1 1259 . 6 1 1 A 106 106 ALA C C 106 175.854 178.056 -2.202 1
1 1260 . 6 1 1 A 106 106 ALA CA C 106 50.272 50.191 0.081 1
1 1261 . 6 1 1 A 106 106 ALA CB C 106 21.197 21.908 -0.711 1
1 1262 . 6 1 1 A 106 106 ALA N N 106 129.303 126.868 2.435 1
1 1263 . 6 1 1 A 107 107 SER H H 107 9.468 8.938 0.530 1
1 1264 . 6 1 1 A 107 107 SER HA H 107 4.447 4.370 0.077 1
1 1267 . 6 1 1 A 107 107 SER C C 107 173.785 173.594 0.191 1
1 1268 . 6 1 1 A 107 107 SER CA C 107 60.048 61.535 -1.487 1
1 1269 . 6 1 1 A 107 107 SER CB C 107 64.643 63.323 1.320 1
1 1270 . 6 1 1 A 107 107 SER N N 107 112.962 116.960 -3.998 1
1 1271 . 6 1 1 A 108 108 SER H H 108 7.555 7.845 -0.290 1
1 1272 . 6 1 1 A 108 108 SER HA H 108 4.665 4.833 -0.168 1
1 1275 . 6 1 1 A 108 108 SER C C 108 174.381 174.717 -0.336 1
1 1276 . 6 1 1 A 108 108 SER CA C 108 56.907 56.435 0.472 1
1 1277 . 6 1 1 A 108 108 SER CB C 108 66.370 65.288 1.082 1
1 1278 . 6 1 1 A 108 108 SER N N 108 112.243 114.215 -1.972 1
1 1279 . 6 1 1 A 109 109 LYS H H 109 8.978 8.759 0.219 1
1 1280 . 6 1 1 A 109 109 LYS HA H 109 4.777 3.940 0.837 1
1 1287 . 6 1 1 A 109 109 LYS C C 109 179.992 177.815 2.177 1
1 1288 . 6 1 1 A 109 109 LYS CA C 109 59.766 60.121 -0.355 1
1 1289 . 6 1 1 A 109 109 LYS CB C 109 32.342 32.110 0.232 1
1 1293 . 6 1 1 A 109 109 LYS N N 109 123.170 126.469 -3.299 1
1 1294 . 6 1 1 A 110 110 ALA H H 110 8.608 8.107 0.501 1
1 1295 . 6 1 1 A 110 110 ALA HA H 110 4.178 3.978 0.200 1
1 1299 . 6 1 1 A 110 110 ALA C C 110 179.895 179.347 0.548 1
1 1300 . 6 1 1 A 110 110 ALA CA C 110 54.871 55.583 -0.712 1
1 1301 . 6 1 1 A 110 110 ALA CB C 110 18.065 18.725 -0.660 1
1 1302 . 6 1 1 A 110 110 ALA N N 110 123.750 121.233 2.517 1
1 1303 . 6 1 1 A 111 111 GLU H H 111 8.185 8.263 -0.078 1
1 1304 . 6 1 1 A 111 111 GLU HA H 111 4.180 4.040 0.140 1
1 1309 . 6 1 1 A 111 111 GLU C C 111 178.587 178.884 -0.297 1
1 1310 . 6 1 1 A 111 111 GLU CA C 111 59.466 59.739 -0.273 1
1 1311 . 6 1 1 A 111 111 GLU CB C 111 31.067 29.513 1.554 1
1 1313 . 6 1 1 A 111 111 GLU N N 111 119.757 118.908 0.849 1
1 1314 . 6 1 1 A 112 112 ARG H H 112 8.008 8.014 -0.006 1
1 1315 . 6 1 1 A 112 112 ARG HA H 112 3.642 4.078 -0.436 1
1 1322 . 6 1 1 A 112 112 ARG C C 112 176.481 178.144 -1.663 1
1 1323 . 6 1 1 A 112 112 ARG CA C 112 60.419 59.571 0.848 1
1 1324 . 6 1 1 A 112 112 ARG CB C 112 29.957 30.148 -0.191 1
1 1327 . 6 1 1 A 112 112 ARG N N 112 118.430 119.857 -1.427 1
1 1328 . 6 1 1 A 113 113 ALA H H 113 7.985 7.758 0.227 1
1 1329 . 6 1 1 A 113 113 ALA HA H 113 3.925 4.053 -0.128 1
1 1333 . 6 1 1 A 113 113 ALA C C 113 180.117 180.203 -0.086 1
1 1334 . 6 1 1 A 113 113 ALA CA C 113 55.372 55.217 0.155 1
1 1335 . 6 1 1 A 113 113 ALA CB C 113 17.825 18.367 -0.542 1
1 1336 . 6 1 1 A 113 113 ALA N N 113 119.980 120.651 -0.671 1
1 1337 . 6 1 1 A 114 114 GLU H H 114 8.093 8.088 0.005 1
1 1338 . 6 1 1 A 114 114 GLU HA H 114 3.936 3.907 0.029 1
1 1343 . 6 1 1 A 114 114 GLU C C 114 180.586 179.251 1.335 1
1 1344 . 6 1 1 A 114 114 GLU CA C 114 59.148 59.318 -0.170 1
1 1345 . 6 1 1 A 114 114 GLU CB C 114 30.080 28.953 1.127 1
1 1347 . 6 1 1 A 114 114 GLU N N 114 117.168 117.387 -0.219 1
1 1348 . 6 1 1 A 115 115 TRP H H 115 7.980 9.133 -1.153 1
1 1349 . 6 1 1 A 115 115 TRP HA H 115 3.775 4.356 -0.581 1
1 1358 . 6 1 1 A 115 115 TRP C C 115 177.714 178.567 -0.853 1
1 1359 . 6 1 1 A 115 115 TRP CA C 115 62.696 59.638 3.058 1
1 1360 . 6 1 1 A 115 115 TRP CB C 115 29.052 29.067 -0.015 1
1 1366 . 6 1 1 A 115 115 TRP N N 115 120.974 120.718 0.256 1
1 1368 . 6 1 1 A 116 116 ILE H H 116 8.297 8.667 -0.370 1
1 1369 . 6 1 1 A 116 116 ILE HA H 116 3.270 3.462 -0.192 1
1 1379 . 6 1 1 A 116 116 ILE C C 116 177.568 177.931 -0.363 1
1 1380 . 6 1 1 A 116 116 ILE CA C 116 66.643 64.647 1.996 1
1 1381 . 6 1 1 A 116 116 ILE CB C 116 37.606 37.530 0.076 1
1 1385 . 6 1 1 A 116 116 ILE N N 116 118.408 119.947 -1.539 1
1 1386 . 6 1 1 A 117 117 GLU H H 117 8.026 9.082 -1.056 1
1 1387 . 6 1 1 A 117 117 GLU HA H 117 3.880 3.972 -0.092 1
1 1392 . 6 1 1 A 117 117 GLU C C 117 178.476 179.085 -0.609 1
1 1393 . 6 1 1 A 117 117 GLU CA C 117 59.219 59.646 -0.427 1
1 1394 . 6 1 1 A 117 117 GLU CB C 117 29.381 29.371 0.010 1
1 1396 . 6 1 1 A 117 117 GLU N N 117 117.096 120.198 -3.102 1
1 1397 . 6 1 1 A 118 118 ALA H H 118 7.555 8.261 -0.706 1
1 1398 . 6 1 1 A 118 118 ALA HA H 118 3.952 4.058 -0.106 1
1 1402 . 6 1 1 A 118 118 ALA C C 118 179.862 179.940 -0.078 1
1 1403 . 6 1 1 A 118 118 ALA CA C 118 54.772 55.127 -0.355 1
1 1404 . 6 1 1 A 118 118 ALA CB C 118 18.277 18.404 -0.127 1
1 1405 . 6 1 1 A 118 118 ALA N N 118 119.817 121.796 -1.979 1
1 1406 . 6 1 1 A 119 119 ILE H H 119 8.167 8.025 0.142 1
1 1407 . 6 1 1 A 119 119 ILE HA H 119 3.558 3.735 -0.177 1
1 1417 . 6 1 1 A 119 119 ILE C C 119 178.564 177.887 0.677 1
1 1418 . 6 1 1 A 119 119 ILE CA C 119 65.766 65.318 0.448 1
1 1419 . 6 1 1 A 119 119 ILE CB C 119 38.840 37.860 0.980 1
1 1423 . 6 1 1 A 119 119 ILE N N 119 116.280 118.114 -1.834 1
1 1424 . 6 1 1 A 120 120 LYS H H 120 8.790 8.029 0.761 1
1 1425 . 6 1 1 A 120 120 LYS HA H 120 3.965 4.270 -0.305 1
1 1434 . 6 1 1 A 120 120 LYS C C 120 179.673 179.369 0.304 1
1 1435 . 6 1 1 A 120 120 LYS CA C 120 60.031 60.213 -0.182 1
1 1436 . 6 1 1 A 120 120 LYS CB C 120 32.547 32.201 0.346 1
1 1440 . 6 1 1 A 120 120 LYS N N 120 119.650 118.998 0.652 1
1 1441 . 6 1 1 A 121 121 LYS H H 121 7.594 8.085 -0.491 1
1 1442 . 6 1 1 A 121 121 LYS HA H 121 4.095 3.948 0.147 1
1 1451 . 6 1 1 A 121 121 LYS C C 121 177.962 179.129 -1.167 1
1 1452 . 6 1 1 A 121 121 LYS CA C 121 58.848 59.467 -0.619 1
1 1453 . 6 1 1 A 121 121 LYS CB C 121 32.547 32.227 0.320 1
1 1457 . 6 1 1 A 121 121 LYS N N 121 117.197 119.741 -2.544 1
1 1458 . 6 1 1 A 122 122 LEU H H 122 7.586 7.928 -0.342 1
1 1459 . 6 1 1 A 122 122 LEU HA H 122 4.535 3.987 0.548 1
1 1469 . 6 1 1 A 122 122 LEU C C 122 177.902 178.190 -0.288 1
1 1470 . 6 1 1 A 122 122 LEU CA C 122 55.071 57.953 -2.882 1
1 1471 . 6 1 1 A 122 122 LEU CB C 122 42.888 41.739 1.149 1
1 1475 . 6 1 1 A 122 122 LEU N N 122 116.861 120.408 -3.547 1
1 1476 . 6 1 1 A 123 123 THR H H 123 7.636 7.782 -0.146 1
1 1477 . 6 1 1 A 123 123 THR HA H 123 4.445 4.367 0.078 1
1 1482 . 6 1 1 A 123 123 THR C C 123 175.714 174.889 0.825 1
1 1483 . 6 1 1 A 123 123 THR CA C 123 62.643 62.029 0.614 1
1 1484 . 6 1 1 A 123 123 THR CB C 123 70.259 68.024 2.235 1
1 1486 . 6 1 1 A 123 123 THR N N 123 108.963 108.427 0.536 1
1 1487 . 6 1 1 A 124 124 SER H H 124 7.912 8.473 -0.561 1
1 1488 . 6 1 1 A 124 124 SER HA H 124 4.626 4.383 0.243 1
1 1491 . 6 1 1 A 124 124 SER C C 124 174.405 174.198 0.207 1
1 1492 . 6 1 1 A 124 124 SER CA C 124 58.390 59.770 -1.380 1
1 1493 . 6 1 1 A 124 124 SER CB C 124 64.255 62.602 1.653 1
1 1494 . 6 1 1 A 124 124 SER N N 124 116.876 115.941 0.935 1
1 1495 . 6 1 1 A 125 125 GLY H H 125 8.307 8.673 -0.366 1
1 1496 . 6 1 1 A 125 125 GLY HA2 H 125 4.166 3.986 0.180 1
1 1497 . 6 1 1 A 125 125 GLY HA3 H 125 4.166 3.987 0.179 1
1 1498 . 6 1 1 A 125 125 GLY C C 125 171.921 173.183 -1.262 1
1 1499 . 6 1 1 A 125 125 GLY CA C 125 44.748 45.447 -0.699 1
1 1500 . 6 1 1 A 125 125 GLY N N 125 110.006 112.178 -2.172 1
1 1501 . 6 1 1 A 126 126 PRO HA H 126 4.510 4.630 -0.120 1
1 1508 . 6 1 1 A 126 126 PRO C C 126 177.471 175.369 2.102 1
1 1509 . 6 1 1 A 126 126 PRO CA C 126 63.419 62.548 0.871 1
1 1510 . 6 1 1 A 126 126 PRO CB C 126 32.106 32.867 -0.761 1
1 1513 . 6 1 1 A 127 127 SER H H 127 8.607 8.627 -0.020 1
1 1514 . 6 1 1 A 127 127 SER C C 127 174.628 174.254 0.374 1
1 1515 . 6 1 1 A 127 127 SER CA C 127 58.513 56.922 1.591 1
1 1516 . 6 1 1 A 127 127 SER CB C 127 63.679 64.741 -1.062 1
1 1517 . 6 1 1 A 127 127 SER N N 127 116.390 117.949 -1.559 1
1 1518 . 6 1 1 A 128 128 SER H H 128 8.272 8.772 -0.500 1
1 1519 . 6 1 1 A 128 128 SER HA H 128 4.496 4.394 0.102 1
1 1520 . 6 1 1 A 128 128 SER C C 128 173.921 174.724 -0.803 1
1 1521 . 6 1 1 A 128 128 SER CA C 128 58.442 60.818 -2.376 1
1 1522 . 6 1 1 A 128 128 SER CB C 128 64.173 63.549 0.624 1
1 1523 . 6 1 1 A 128 128 SER N N 128 117.506 123.002 -5.496 1
1 1 . 7 1 1 A 7 7 GLY HA2 H 7 3.978 4.162 -0.184 1
1 2 . 7 1 1 A 7 7 GLY HA3 H 7 3.978 4.165 -0.187 1
1 3 . 7 1 1 A 7 7 GLY C C 7 174.274 173.123 1.151 1
1 4 . 7 1 1 A 7 7 GLY CA C 7 45.383 45.296 0.087 1
1 5 . 7 1 1 A 8 8 SER H H 8 8.211 8.813 -0.602 1
1 6 . 7 1 1 A 8 8 SER HA H 8 4.425 4.712 -0.287 1
1 9 . 7 1 1 A 8 8 SER C C 8 174.635 174.075 0.560 1
1 10 . 7 1 1 A 8 8 SER CA C 8 58.425 58.552 -0.127 1
1 11 . 7 1 1 A 8 8 SER CB C 8 63.885 64.208 -0.323 1
1 12 . 7 1 1 A 8 8 SER N N 8 115.732 121.978 -6.246 1
1 13 . 7 1 1 A 9 9 LEU H H 9 8.316 8.612 -0.296 1
1 14 . 7 1 1 A 9 9 LEU HA H 9 4.334 4.750 -0.416 1
1 24 . 7 1 1 A 9 9 LEU C C 9 177.447 175.584 1.863 1
1 25 . 7 1 1 A 9 9 LEU CA C 9 55.407 53.068 2.339 1
1 26 . 7 1 1 A 9 9 LEU CB C 9 42.171 42.900 -0.729 1
1 30 . 7 1 1 A 9 9 LEU N N 9 123.943 124.793 -0.850 1
1 31 . 7 1 1 A 10 10 SER H H 10 8.304 9.270 -0.966 1
1 32 . 7 1 1 A 10 10 SER HA H 10 4.424 4.045 0.379 1
1 35 . 7 1 1 A 10 10 SER C C 10 175.025 173.845 1.180 1
1 36 . 7 1 1 A 10 10 SER CA C 10 58.425 59.393 -0.968 1
1 37 . 7 1 1 A 10 10 SER CB C 10 63.638 61.625 2.013 1
1 38 . 7 1 1 A 10 10 SER N N 10 116.718 121.826 -5.108 1
1 39 . 7 1 1 A 11 11 THR H H 11 8.003 8.285 -0.282 1
1 40 . 7 1 1 A 11 11 THR HA H 11 4.196 4.248 -0.052 1
1 45 . 7 1 1 A 11 11 THR C C 11 176.296 173.418 2.878 1
1 46 . 7 1 1 A 11 11 THR CA C 11 62.483 64.100 -1.617 1
1 47 . 7 1 1 A 11 11 THR CB C 11 69.266 67.644 1.622 1
1 49 . 7 1 1 A 11 11 THR N N 11 114.902 106.136 8.766 1
1 50 . 7 1 1 A 12 12 VAL H H 12 8.095 8.292 -0.197 1
1 51 . 7 1 1 A 12 12 VAL HA H 12 3.826 4.245 -0.419 1
1 59 . 7 1 1 A 12 12 VAL C C 12 178.501 176.838 1.663 1
1 60 . 7 1 1 A 12 12 VAL CA C 12 64.760 63.338 1.422 1
1 61 . 7 1 1 A 12 12 VAL CB C 12 32.013 32.961 -0.948 1
1 64 . 7 1 1 A 12 12 VAL N N 12 122.111 121.635 0.476 1
1 65 . 7 1 1 A 13 13 GLU H H 13 8.151 8.886 -0.735 1
1 66 . 7 1 1 A 13 13 GLU HA H 13 3.244 3.971 -0.727 1
1 71 . 7 1 1 A 13 13 GLU C C 13 175.702 178.314 -2.612 1
1 72 . 7 1 1 A 13 13 GLU CA C 13 58.354 59.363 -1.009 1
1 73 . 7 1 1 A 13 13 GLU CB C 13 28.843 28.421 0.422 1
1 75 . 7 1 1 A 13 13 GLU N N 13 120.316 123.166 -2.850 1
1 76 . 7 1 1 A 14 14 LEU H H 14 7.067 7.515 -0.448 1
1 77 . 7 1 1 A 14 14 LEU HA H 14 4.157 4.141 0.016 1
1 87 . 7 1 1 A 14 14 LEU C C 14 176.863 177.068 -0.205 1
1 88 . 7 1 1 A 14 14 LEU CA C 14 53.324 54.799 -1.475 1
1 89 . 7 1 1 A 14 14 LEU CB C 14 41.636 41.457 0.179 1
1 93 . 7 1 1 A 14 14 LEU N N 14 117.035 119.476 -2.441 1
1 94 . 7 1 1 A 15 15 SER H H 15 7.645 7.924 -0.279 1
1 95 . 7 1 1 A 15 15 SER HA H 15 4.305 4.618 -0.313 1
1 98 . 7 1 1 A 15 15 SER C C 15 175.340 172.830 2.510 1
1 99 . 7 1 1 A 15 15 SER CA C 15 59.783 56.954 2.829 1
1 100 . 7 1 1 A 15 15 SER CB C 15 64.625 62.596 2.029 1
1 101 . 7 1 1 A 15 15 SER N N 15 114.216 115.153 -0.937 1
1 102 . 7 1 1 A 16 16 GLY H H 16 8.506 8.397 0.109 1
1 103 . 7 1 1 A 16 16 GLY HA2 H 16 4.237 4.374 -0.137 1
1 104 . 7 1 1 A 16 16 GLY HA3 H 16 3.927 4.395 -0.468 1
1 105 . 7 1 1 A 16 16 GLY C C 16 173.661 172.124 1.537 1
1 106 . 7 1 1 A 16 16 GLY CA C 16 44.995 44.144 0.851 1
1 107 . 7 1 1 A 16 16 GLY N N 16 111.838 113.482 -1.644 1
1 108 . 7 1 1 A 17 17 THR H H 17 8.482 9.769 -1.287 1
1 109 . 7 1 1 A 17 17 THR HA H 17 4.319 4.537 -0.218 1
1 114 . 7 1 1 A 17 17 THR C C 17 174.758 174.443 0.315 1
1 115 . 7 1 1 A 17 17 THR CA C 17 62.272 63.558 -1.286 1
1 116 . 7 1 1 A 17 17 THR CB C 17 70.706 69.228 1.478 1
1 118 . 7 1 1 A 17 17 THR N N 17 116.679 115.475 1.204 1
1 119 . 7 1 1 A 18 18 VAL H H 18 8.948 8.819 0.129 1
1 120 . 7 1 1 A 18 18 VAL HA H 18 3.950 4.435 -0.485 1
1 128 . 7 1 1 A 18 18 VAL C C 18 176.669 177.069 -0.400 1
1 129 . 7 1 1 A 18 18 VAL CA C 18 64.813 63.630 1.183 1
1 130 . 7 1 1 A 18 18 VAL CB C 18 31.807 31.665 0.142 1
1 133 . 7 1 1 A 18 18 VAL N N 18 127.156 127.607 -0.451 1
1 134 . 7 1 1 A 19 19 VAL H H 19 9.359 9.205 0.154 1
1 135 . 7 1 1 A 19 19 VAL HA H 19 4.234 4.395 -0.161 1
1 143 . 7 1 1 A 19 19 VAL C C 19 175.738 175.778 -0.040 1
1 144 . 7 1 1 A 19 19 VAL CA C 19 62.060 62.048 0.012 1
1 145 . 7 1 1 A 19 19 VAL CB C 19 33.822 33.431 0.391 1
1 148 . 7 1 1 A 19 19 VAL N N 19 125.162 121.456 3.706 1
1 149 . 7 1 1 A 20 20 LYS H H 20 7.584 7.254 0.330 1
1 150 . 7 1 1 A 20 20 LYS HA H 20 4.346 4.490 -0.144 1
1 159 . 7 1 1 A 20 20 LYS C C 20 172.818 174.000 -1.182 1
1 160 . 7 1 1 A 20 20 LYS CA C 20 56.801 55.553 1.248 1
1 161 . 7 1 1 A 20 20 LYS CB C 20 36.624 35.591 1.033 1
1 165 . 7 1 1 A 20 20 LYS N N 20 121.024 121.078 -0.054 1
1 166 . 7 1 1 A 21 21 GLN H H 21 8.625 8.496 0.129 1
1 167 . 7 1 1 A 21 21 GLN HA H 21 6.003 5.370 0.633 1
1 174 . 7 1 1 A 21 21 GLN C C 21 174.914 175.012 -0.098 1
1 175 . 7 1 1 A 21 21 GLN CA C 21 54.207 54.661 -0.454 1
1 176 . 7 1 1 A 21 21 GLN CB C 21 33.452 33.259 0.193 1
1 178 . 7 1 1 A 21 21 GLN N N 21 122.108 124.332 -2.224 1
1 180 . 7 1 1 A 22 22 GLY H H 22 8.964 8.385 0.579 1
1 181 . 7 1 1 A 22 22 GLY HA2 H 22 4.665 4.417 0.248 1
1 182 . 7 1 1 A 22 22 GLY HA3 H 22 4.295 4.589 -0.294 1
1 183 . 7 1 1 A 22 22 GLY C C 22 170.879 171.598 -0.719 1
1 184 . 7 1 1 A 22 22 GLY CA C 22 45.683 46.108 -0.425 1
1 185 . 7 1 1 A 22 22 GLY N N 22 108.508 109.395 -0.887 1
1 186 . 7 1 1 A 23 23 TYR H H 23 9.145 8.723 0.422 1
1 187 . 7 1 1 A 23 23 TYR HA H 23 5.595 5.519 0.076 1
1 194 . 7 1 1 A 23 23 TYR C C 23 175.824 175.355 0.469 1
1 195 . 7 1 1 A 23 23 TYR CA C 23 58.019 56.731 1.288 1
1 196 . 7 1 1 A 23 23 TYR CB C 23 39.251 40.634 -1.383 1
1 201 . 7 1 1 A 23 23 TYR N N 23 120.809 120.030 0.779 1
1 202 . 7 1 1 A 24 24 LEU H H 24 8.935 9.538 -0.603 1
1 203 . 7 1 1 A 24 24 LEU HA H 24 4.716 5.036 -0.320 1
1 213 . 7 1 1 A 24 24 LEU C C 24 174.648 175.895 -1.247 1
1 214 . 7 1 1 A 24 24 LEU CA C 24 53.907 53.296 0.611 1
1 215 . 7 1 1 A 24 24 LEU CB C 24 46.078 45.034 1.044 1
1 219 . 7 1 1 A 24 24 LEU N N 24 122.887 124.727 -1.840 1
1 220 . 7 1 1 A 25 25 ALA H H 25 8.145 8.446 -0.301 1
1 221 . 7 1 1 A 25 25 ALA HA H 25 5.477 5.822 -0.345 1
1 225 . 7 1 1 A 25 25 ALA C C 25 175.751 175.416 0.335 1
1 226 . 7 1 1 A 25 25 ALA CA C 25 50.719 50.274 0.445 1
1 227 . 7 1 1 A 25 25 ALA CB C 25 21.074 21.462 -0.388 1
1 228 . 7 1 1 A 25 25 ALA N N 25 122.280 123.097 -0.817 1
1 229 . 7 1 1 A 26 26 LYS H H 26 9.167 8.983 0.184 1
1 230 . 7 1 1 A 26 26 LYS HA H 26 5.221 4.856 0.365 1
1 239 . 7 1 1 A 26 26 LYS C C 26 175.421 175.482 -0.061 1
1 240 . 7 1 1 A 26 26 LYS CA C 26 54.383 54.509 -0.126 1
1 241 . 7 1 1 A 26 26 LYS CB C 26 36.125 35.419 0.706 1
1 245 . 7 1 1 A 26 26 LYS N N 26 120.638 124.002 -3.364 1
1 246 . 7 1 1 A 27 27 GLN H H 27 7.866 7.916 -0.050 1
1 247 . 7 1 1 A 27 27 GLN HA H 27 3.525 4.022 -0.497 1
1 254 . 7 1 1 A 27 27 GLN C C 27 177.022 175.200 1.822 1
1 255 . 7 1 1 A 27 27 GLN CA C 27 55.778 54.842 0.936 1
1 256 . 7 1 1 A 27 27 GLN CB C 27 29.864 28.277 1.587 1
1 258 . 7 1 1 A 27 27 GLN N N 27 130.194 127.003 3.191 1
1 260 . 7 1 1 A 28 28 GLY H H 28 8.565 8.329 0.236 1
1 261 . 7 1 1 A 28 28 GLY HA2 H 28 4.125 4.075 0.050 1
1 262 . 7 1 1 A 28 28 GLY HA3 H 28 4.034 4.114 -0.080 1
1 263 . 7 1 1 A 28 28 GLY C C 28 174.030 172.080 1.950 1
1 264 . 7 1 1 A 28 28 GLY CA C 28 45.665 45.711 -0.046 1
1 265 . 7 1 1 A 28 28 GLY N N 28 115.528 112.817 2.711 1
1 266 . 7 1 1 A 29 29 HIS HA H 29 4.355 4.842 -0.487 1
1 271 . 7 1 1 A 29 29 HIS CA C 29 58.795 53.596 5.199 1
1 272 . 7 1 1 A 29 29 HIS CB C 29 31.283 32.053 -0.770 1
1 275 . 7 1 1 A 30 30 LYS HA H 30 4.096 4.319 -0.223 1
1 284 . 7 1 1 A 30 30 LYS CA C 30 57.290 56.562 0.728 1
1 285 . 7 1 1 A 30 30 LYS CB C 30 31.951 31.723 0.228 1
1 289 . 7 1 1 A 31 31 ARG HA H 31 3.975 4.191 -0.216 1
1 296 . 7 1 1 A 31 31 ARG CA C 31 55.973 55.948 0.025 1
1 297 . 7 1 1 A 31 31 ARG CB C 31 29.902 31.014 -1.112 1
1 300 . 7 1 1 A 32 32 LYS HA H 32 4.160 4.301 -0.141 1
1 309 . 7 1 1 A 32 32 LYS C C 32 175.678 175.582 0.096 1
1 310 . 7 1 1 A 32 32 LYS CA C 32 56.254 58.510 -2.256 1
1 311 . 7 1 1 A 32 32 LYS CB C 32 31.602 31.509 0.093 1
1 315 . 7 1 1 A 33 33 ASN H H 33 7.925 8.584 -0.659 1
1 316 . 7 1 1 A 33 33 ASN HA H 33 4.799 4.866 -0.067 1
1 321 . 7 1 1 A 33 33 ASN C C 33 174.005 175.606 -1.601 1
1 322 . 7 1 1 A 33 33 ASN CA C 33 52.407 53.230 -0.823 1
1 323 . 7 1 1 A 33 33 ASN CB C 33 39.879 39.859 0.020 1
1 324 . 7 1 1 A 33 33 ASN N N 33 116.990 120.011 -3.021 1
1 326 . 7 1 1 A 34 34 TRP H H 34 8.798 8.562 0.236 1
1 327 . 7 1 1 A 34 34 TRP HA H 34 4.755 4.811 -0.056 1
1 336 . 7 1 1 A 34 34 TRP C C 34 176.090 176.172 -0.082 1
1 337 . 7 1 1 A 34 34 TRP CA C 34 57.119 57.685 -0.566 1
1 338 . 7 1 1 A 34 34 TRP CB C 34 30.596 29.611 0.985 1
1 344 . 7 1 1 A 34 34 TRP N N 34 121.917 120.418 1.499 1
1 346 . 7 1 1 A 35 35 LYS H H 35 8.404 8.676 -0.272 1
1 347 . 7 1 1 A 35 35 LYS HA H 35 4.846 5.118 -0.272 1
1 354 . 7 1 1 A 35 35 LYS C C 35 176.088 175.188 0.900 1
1 355 . 7 1 1 A 35 35 LYS CA C 35 54.418 54.487 -0.069 1
1 356 . 7 1 1 A 35 35 LYS CB C 35 36.125 35.651 0.474 1
1 360 . 7 1 1 A 35 35 LYS N N 35 120.864 118.323 2.541 1
1 361 . 7 1 1 A 36 36 VAL H H 36 8.977 8.803 0.174 1
1 362 . 7 1 1 A 36 36 VAL HA H 36 4.274 4.380 -0.106 1
1 370 . 7 1 1 A 36 36 VAL C C 36 176.733 175.805 0.928 1
1 371 . 7 1 1 A 36 36 VAL CA C 36 64.319 62.501 1.818 1
1 372 . 7 1 1 A 36 36 VAL CB C 36 31.602 31.497 0.105 1
1 375 . 7 1 1 A 36 36 VAL N N 36 124.314 124.526 -0.212 1
1 376 . 7 1 1 A 37 37 ARG H H 37 9.498 10.288 -0.790 1
1 377 . 7 1 1 A 37 37 ARG HA H 37 5.053 5.183 -0.130 1
1 384 . 7 1 1 A 37 37 ARG C C 37 174.442 174.798 -0.356 1
1 385 . 7 1 1 A 37 37 ARG CA C 37 53.272 53.844 -0.572 1
1 386 . 7 1 1 A 37 37 ARG CB C 37 34.563 33.644 0.919 1
1 389 . 7 1 1 A 37 37 ARG N N 37 128.121 127.629 0.492 1
1 390 . 7 1 1 A 38 38 ARG H H 38 8.755 8.624 0.131 1
1 391 . 7 1 1 A 38 38 ARG HA H 38 4.626 4.240 0.386 1
1 398 . 7 1 1 A 38 38 ARG C C 38 175.514 174.908 0.606 1
1 399 . 7 1 1 A 38 38 ARG CA C 38 55.601 55.527 0.074 1
1 400 . 7 1 1 A 38 38 ARG CB C 38 32.219 30.622 1.597 1
1 403 . 7 1 1 A 38 38 ARG N N 38 121.442 122.863 -1.421 1
1 404 . 7 1 1 A 39 39 PHE H H 39 9.865 8.854 1.011 1
1 405 . 7 1 1 A 39 39 PHE HA H 39 5.424 5.067 0.357 1
1 413 . 7 1 1 A 39 39 PHE C C 39 175.423 174.797 0.626 1
1 414 . 7 1 1 A 39 39 PHE CA C 39 57.419 57.020 0.399 1
1 415 . 7 1 1 A 39 39 PHE CB C 39 42.623 40.986 1.637 1
1 421 . 7 1 1 A 39 39 PHE N N 39 130.027 126.427 3.600 1
1 422 . 7 1 1 A 40 40 VAL H H 40 9.300 9.791 -0.491 1
1 423 . 7 1 1 A 40 40 VAL HA H 40 4.846 5.325 -0.479 1
1 431 . 7 1 1 A 40 40 VAL C C 40 174.477 173.696 0.781 1
1 432 . 7 1 1 A 40 40 VAL CA C 40 62.343 59.815 2.528 1
1 433 . 7 1 1 A 40 40 VAL CB C 40 35.755 35.140 0.615 1
1 436 . 7 1 1 A 40 40 VAL N N 40 119.369 122.162 -2.793 1
1 437 . 7 1 1 A 41 41 LEU H H 41 9.557 9.950 -0.393 1
1 438 . 7 1 1 A 41 41 LEU HA H 41 5.292 5.552 -0.260 1
1 448 . 7 1 1 A 41 41 LEU C C 41 174.632 175.609 -0.977 1
1 449 . 7 1 1 A 41 41 LEU CA C 41 53.571 53.527 0.044 1
1 450 . 7 1 1 A 41 41 LEU CB C 41 45.337 44.931 0.406 1
1 454 . 7 1 1 A 41 41 LEU N N 41 132.121 129.153 2.968 1
1 455 . 7 1 1 A 42 42 ARG H H 42 9.396 8.943 0.453 1
1 456 . 7 1 1 A 42 42 ARG HA H 42 5.366 5.433 -0.067 1
1 464 . 7 1 1 A 42 42 ARG C C 42 173.997 174.775 -0.778 1
1 465 . 7 1 1 A 42 42 ARG CA C 42 54.631 54.173 0.458 1
1 466 . 7 1 1 A 42 42 ARG CB C 42 35.550 34.709 0.841 1
1 469 . 7 1 1 A 42 42 ARG N N 42 128.120 123.588 4.532 1
1 471 . 7 1 1 A 43 43 LYS H H 43 8.597 8.924 -0.327 1
1 472 . 7 1 1 A 43 43 LYS HA H 43 4.558 4.937 -0.379 1
1 481 . 7 1 1 A 43 43 LYS C C 43 174.648 175.268 -0.620 1
1 482 . 7 1 1 A 43 43 LYS CA C 43 53.378 54.918 -1.540 1
1 483 . 7 1 1 A 43 43 LYS CB C 43 37.303 35.833 1.470 1
1 487 . 7 1 1 A 43 43 LYS N N 43 114.484 117.740 -3.256 1
1 488 . 7 1 1 A 44 44 ASP H H 44 8.388 9.013 -0.625 1
1 489 . 7 1 1 A 44 44 ASP HA H 44 4.349 4.264 0.085 1
1 492 . 7 1 1 A 44 44 ASP C C 44 173.376 174.221 -0.845 1
1 493 . 7 1 1 A 44 44 ASP CA C 44 54.842 54.953 -0.111 1
1 494 . 7 1 1 A 44 44 ASP CB C 44 39.991 39.640 0.351 1
1 495 . 7 1 1 A 44 44 ASP N N 44 115.453 119.349 -3.896 1
1 496 . 7 1 1 A 45 45 PRO HA H 45 4.652 4.582 0.070 1
1 503 . 7 1 1 A 45 45 PRO C C 45 176.914 175.430 1.484 1
1 504 . 7 1 1 A 45 45 PRO CA C 45 63.490 62.640 0.850 1
1 505 . 7 1 1 A 45 45 PRO CB C 45 34.892 32.757 2.135 1
1 508 . 7 1 1 A 46 46 ALA H H 46 8.112 8.250 -0.138 1
1 509 . 7 1 1 A 46 46 ALA HA H 46 5.455 4.643 0.812 1
1 513 . 7 1 1 A 46 46 ALA C C 46 177.234 176.501 0.733 1
1 514 . 7 1 1 A 46 46 ALA CA C 46 51.560 50.671 0.889 1
1 515 . 7 1 1 A 46 46 ALA CB C 46 20.122 19.735 0.387 1
1 516 . 7 1 1 A 46 46 ALA N N 46 120.155 123.238 -3.083 1
1 517 . 7 1 1 A 47 47 PHE H H 47 8.717 8.972 -0.255 1
1 518 . 7 1 1 A 47 47 PHE HA H 47 4.795 5.196 -0.401 1
1 526 . 7 1 1 A 47 47 PHE C C 47 172.588 174.366 -1.778 1
1 527 . 7 1 1 A 47 47 PHE CA C 47 57.348 56.215 1.133 1
1 528 . 7 1 1 A 47 47 PHE CB C 47 47.123 44.324 2.799 1
1 534 . 7 1 1 A 47 47 PHE N N 47 129.946 120.259 9.687 1
1 535 . 7 1 1 A 48 48 LEU H H 48 7.883 8.119 -0.236 1
1 536 . 7 1 1 A 48 48 LEU HA H 48 5.198 5.124 0.074 1
1 546 . 7 1 1 A 48 48 LEU C C 48 173.569 174.342 -0.773 1
1 547 . 7 1 1 A 48 48 LEU CA C 48 53.290 54.239 -0.949 1
1 548 . 7 1 1 A 48 48 LEU CB C 48 45.502 45.645 -0.143 1
1 552 . 7 1 1 A 48 48 LEU N N 48 121.108 121.634 -0.526 1
1 553 . 7 1 1 A 49 49 HIS H H 49 8.606 8.927 -0.321 1
1 554 . 7 1 1 A 49 49 HIS HA H 49 5.035 4.891 0.144 1
1 559 . 7 1 1 A 49 49 HIS C C 49 173.993 173.555 0.438 1
1 560 . 7 1 1 A 49 49 HIS CA C 49 56.483 54.096 2.387 1
1 561 . 7 1 1 A 49 49 HIS CB C 49 35.919 33.114 2.805 1
1 564 . 7 1 1 A 49 49 HIS N N 49 121.199 125.670 -4.471 1
1 565 . 7 1 1 A 50 50 TYR H H 50 7.777 8.242 -0.465 1
1 566 . 7 1 1 A 50 50 TYR HA H 50 5.695 5.639 0.056 1
1 573 . 7 1 1 A 50 50 TYR C C 50 174.284 172.401 1.883 1
1 574 . 7 1 1 A 50 50 TYR CA C 50 53.430 55.171 -1.741 1
1 575 . 7 1 1 A 50 50 TYR CB C 50 38.552 41.244 -2.692 1
1 580 . 7 1 1 A 50 50 TYR N N 50 114.156 118.150 -3.994 1
1 581 . 7 1 1 A 51 51 TYR H H 51 9.323 9.617 -0.294 1
1 582 . 7 1 1 A 51 51 TYR HA H 51 4.600 5.171 -0.571 1
1 589 . 7 1 1 A 51 51 TYR C C 51 175.352 174.279 1.073 1
1 590 . 7 1 1 A 51 51 TYR CA C 51 57.330 56.778 0.552 1
1 591 . 7 1 1 A 51 51 TYR CB C 51 41.683 41.858 -0.175 1
1 596 . 7 1 1 A 51 51 TYR N N 51 119.100 120.249 -1.149 1
1 597 . 7 1 1 A 52 52 ASP H H 52 9.375 8.796 0.579 1
1 598 . 7 1 1 A 52 52 ASP HA H 52 5.064 5.189 -0.125 1
1 601 . 7 1 1 A 52 52 ASP C C 52 175.484 176.273 -0.789 1
1 602 . 7 1 1 A 52 52 ASP CA C 52 51.313 52.067 -0.754 1
1 603 . 7 1 1 A 52 52 ASP CB C 52 41.883 41.421 0.462 1
1 604 . 7 1 1 A 52 52 ASP N N 52 124.636 121.675 2.961 1
1 605 . 7 1 1 A 53 53 PRO HA H 53 4.678 4.455 0.223 1
1 612 . 7 1 1 A 53 53 PRO C C 53 176.781 177.714 -0.933 1
1 613 . 7 1 1 A 53 53 PRO CA C 53 64.054 65.031 -0.977 1
1 614 . 7 1 1 A 53 53 PRO CB C 53 32.589 32.209 0.380 1
1 617 . 7 1 1 A 54 54 SER H H 54 8.685 8.299 0.386 1
1 618 . 7 1 1 A 54 54 SER HA H 54 4.483 4.192 0.291 1
1 621 . 7 1 1 A 54 54 SER C C 54 174.006 174.644 -0.638 1
1 622 . 7 1 1 A 54 54 SER CA C 54 59.378 61.594 -2.216 1
1 623 . 7 1 1 A 54 54 SER CB C 54 64.132 63.068 1.064 1
1 624 . 7 1 1 A 54 54 SER N N 54 113.769 111.992 1.777 1
1 625 . 7 1 1 A 55 55 LYS H H 55 7.706 7.864 -0.158 1
1 626 . 7 1 1 A 55 55 LYS HA H 55 4.580 4.693 -0.113 1
1 635 . 7 1 1 A 55 55 LYS C C 55 175.969 175.177 0.792 1
1 636 . 7 1 1 A 55 55 LYS CA C 55 55.160 54.924 0.236 1
1 637 . 7 1 1 A 55 55 LYS CB C 55 34.069 33.947 0.122 1
1 641 . 7 1 1 A 55 55 LYS N N 55 122.222 120.460 1.762 1
1 642 . 7 1 1 A 56 56 GLU H H 56 8.666 9.167 -0.501 1
1 643 . 7 1 1 A 56 56 GLU HA H 56 4.174 5.151 -0.977 1
1 648 . 7 1 1 A 56 56 GLU C C 56 177.084 174.517 2.567 1
1 649 . 7 1 1 A 56 56 GLU CA C 56 57.099 55.573 1.526 1
1 650 . 7 1 1 A 56 56 GLU CB C 56 29.694 31.933 -2.239 1
1 652 . 7 1 1 A 56 56 GLU N N 56 122.015 117.642 4.373 1
1 653 . 7 1 1 A 57 57 GLU H H 57 8.303 8.769 -0.466 1
1 654 . 7 1 1 A 57 57 GLU HA H 57 4.214 4.786 -0.572 1
1 659 . 7 1 1 A 57 57 GLU CA C 57 56.960 55.304 1.656 1
1 660 . 7 1 1 A 57 57 GLU CB C 57 30.264 33.757 -3.493 1
1 662 . 7 1 1 A 57 57 GLU N N 57 119.884 124.468 -4.584 1
1 663 . 7 1 1 A 58 58 ASN HA H 58 4.768 4.969 -0.201 1
1 668 . 7 1 1 A 58 58 ASN C C 58 174.902 172.616 2.286 1
1 669 . 7 1 1 A 58 58 ASN CA C 58 52.740 53.255 -0.515 1
1 670 . 7 1 1 A 58 58 ASN CB C 58 38.116 39.306 -1.190 1
1 672 . 7 1 1 A 59 59 ARG H H 59 7.805 7.686 0.119 1
1 673 . 7 1 1 A 59 59 ARG HA H 59 4.762 4.881 -0.119 1
1 680 . 7 1 1 A 59 59 ARG CA C 59 53.151 52.790 0.361 1
1 681 . 7 1 1 A 59 59 ARG CB C 59 31.519 31.915 -0.396 1
1 684 . 7 1 1 A 59 59 ARG N N 59 121.060 118.404 2.656 1
1 685 . 7 1 1 A 60 60 PRO HA H 60 3.357 3.981 -0.624 1
1 692 . 7 1 1 A 60 60 PRO C C 60 176.817 176.290 0.527 1
1 693 . 7 1 1 A 60 60 PRO CA C 60 63.031 61.787 1.244 1
1 694 . 7 1 1 A 60 60 PRO CB C 60 31.273 32.471 -1.198 1
1 697 . 7 1 1 A 61 61 VAL H H 61 8.627 9.017 -0.390 1
1 698 . 7 1 1 A 61 61 VAL HA H 61 3.966 4.067 -0.101 1
1 706 . 7 1 1 A 61 61 VAL C C 61 176.503 175.794 0.709 1
1 707 . 7 1 1 A 61 61 VAL CA C 61 63.154 63.198 -0.044 1
1 708 . 7 1 1 A 61 61 VAL CB C 61 32.048 32.613 -0.565 1
1 711 . 7 1 1 A 61 61 VAL N N 61 119.185 119.025 0.160 1
1 712 . 7 1 1 A 62 62 GLY H H 62 6.715 6.325 0.390 1
1 713 . 7 1 1 A 62 62 GLY HA2 H 62 3.940 3.811 0.129 1
1 714 . 7 1 1 A 62 62 GLY HA3 H 62 3.538 3.880 -0.342 1
1 715 . 7 1 1 A 62 62 GLY C C 62 169.983 171.474 -1.491 1
1 716 . 7 1 1 A 62 62 GLY CA C 62 44.465 45.603 -1.138 1
1 717 . 7 1 1 A 62 62 GLY N N 62 105.813 106.224 -0.411 1
1 718 . 7 1 1 A 63 63 GLY H H 63 8.004 8.230 -0.226 1
1 719 . 7 1 1 A 63 63 GLY HA2 H 63 4.095 3.219 0.876 1
1 720 . 7 1 1 A 63 63 GLY HA3 H 63 3.813 3.550 0.263 1
1 721 . 7 1 1 A 63 63 GLY C C 63 171.870 172.223 -0.353 1
1 722 . 7 1 1 A 63 63 GLY CA C 63 47.148 44.640 2.508 1
1 723 . 7 1 1 A 63 63 GLY N N 63 105.089 107.495 -2.406 1
1 724 . 7 1 1 A 64 64 PHE H H 64 7.967 7.624 0.343 1
1 725 . 7 1 1 A 64 64 PHE HA H 64 4.934 5.556 -0.622 1
1 733 . 7 1 1 A 64 64 PHE C C 64 173.140 174.762 -1.622 1
1 734 . 7 1 1 A 64 64 PHE CA C 64 55.248 55.295 -0.047 1
1 735 . 7 1 1 A 64 64 PHE CB C 64 40.238 42.180 -1.942 1
1 741 . 7 1 1 A 64 64 PHE N N 64 113.387 121.879 -8.492 1
1 742 . 7 1 1 A 65 65 SER H H 65 8.518 9.148 -0.630 1
1 743 . 7 1 1 A 65 65 SER HA H 65 3.264 4.826 -1.562 1
1 746 . 7 1 1 A 65 65 SER C C 65 176.417 174.315 2.102 1
1 747 . 7 1 1 A 65 65 SER CA C 65 56.819 57.868 -1.049 1
1 748 . 7 1 1 A 65 65 SER CB C 65 63.391 64.910 -1.519 1
1 749 . 7 1 1 A 65 65 SER N N 65 114.674 115.817 -1.143 1
1 750 . 7 1 1 A 66 66 LEU H H 66 7.404 8.306 -0.902 1
1 751 . 7 1 1 A 66 66 LEU HA H 66 4.470 4.438 0.032 1
1 761 . 7 1 1 A 66 66 LEU C C 66 177.993 178.377 -0.384 1
1 762 . 7 1 1 A 66 66 LEU CA C 66 54.242 56.147 -1.905 1
1 763 . 7 1 1 A 66 66 LEU CB C 66 42.787 42.857 -0.070 1
1 767 . 7 1 1 A 66 66 LEU N N 66 123.988 121.603 2.385 1
1 768 . 7 1 1 A 67 67 ARG H H 67 7.865 8.186 -0.321 1
1 769 . 7 1 1 A 67 67 ARG HA H 67 4.175 4.104 0.071 1
1 776 . 7 1 1 A 67 67 ARG C C 67 178.562 177.141 1.421 1
1 777 . 7 1 1 A 67 67 ARG CA C 67 58.143 58.310 -0.167 1
1 778 . 7 1 1 A 67 67 ARG CB C 67 29.052 29.831 -0.779 1
1 781 . 7 1 1 A 67 67 ARG N N 67 122.494 118.362 4.132 1
1 782 . 7 1 1 A 68 68 GLY H H 68 9.398 7.916 1.482 1
1 783 . 7 1 1 A 68 68 GLY HA2 H 68 4.066 4.037 0.029 1
1 784 . 7 1 1 A 68 68 GLY HA3 H 68 3.908 4.045 -0.137 1
1 785 . 7 1 1 A 68 68 GLY C C 68 173.982 173.006 0.976 1
1 786 . 7 1 1 A 68 68 GLY CA C 68 46.230 46.005 0.225 1
1 787 . 7 1 1 A 68 68 GLY N N 68 117.548 107.174 10.374 1
1 788 . 7 1 1 A 69 69 SER H H 69 7.829 7.653 0.176 1
1 789 . 7 1 1 A 69 69 SER HA H 69 4.807 5.211 -0.404 1
1 792 . 7 1 1 A 69 69 SER C C 69 172.854 172.643 0.211 1
1 793 . 7 1 1 A 69 69 SER CA C 69 59.290 57.496 1.794 1
1 794 . 7 1 1 A 69 69 SER CB C 69 65.366 68.156 -2.790 1
1 795 . 7 1 1 A 69 69 SER N N 69 115.188 114.183 1.005 1
1 796 . 7 1 1 A 70 70 LEU H H 70 8.805 8.804 0.001 1
1 797 . 7 1 1 A 70 70 LEU HA H 70 4.846 4.875 -0.029 1
1 807 . 7 1 1 A 70 70 LEU C C 70 175.775 174.267 1.508 1
1 808 . 7 1 1 A 70 70 LEU CA C 70 53.907 53.648 0.259 1
1 809 . 7 1 1 A 70 70 LEU CB C 70 45.337 44.060 1.277 1
1 813 . 7 1 1 A 70 70 LEU N N 70 121.265 122.505 -1.240 1
1 814 . 7 1 1 A 71 71 VAL H H 71 8.644 8.717 -0.073 1
1 815 . 7 1 1 A 71 71 VAL HA H 71 5.555 5.179 0.376 1
1 823 . 7 1 1 A 71 71 VAL C C 71 173.636 173.267 0.369 1
1 824 . 7 1 1 A 71 71 VAL CA C 71 58.760 59.901 -1.141 1
1 825 . 7 1 1 A 71 71 VAL CB C 71 34.891 35.694 -0.803 1
1 828 . 7 1 1 A 71 71 VAL N N 71 122.315 121.538 0.777 1
1 829 . 7 1 1 A 72 72 SER H H 72 8.750 8.951 -0.201 1
1 830 . 7 1 1 A 72 72 SER HA H 72 4.742 4.979 -0.237 1
1 833 . 7 1 1 A 72 72 SER C C 72 173.058 172.713 0.345 1
1 834 . 7 1 1 A 72 72 SER CA C 72 57.190 57.700 -0.510 1
1 835 . 7 1 1 A 72 72 SER CB C 72 65.612 67.521 -1.909 1
1 836 . 7 1 1 A 72 72 SER N N 72 118.611 120.707 -2.096 1
1 837 . 7 1 1 A 73 73 ALA H H 73 9.009 8.525 0.484 1
1 838 . 7 1 1 A 73 73 ALA HA H 73 4.406 4.663 -0.257 1
1 842 . 7 1 1 A 73 73 ALA C C 73 176.708 177.012 -0.304 1
1 843 . 7 1 1 A 73 73 ALA CA C 73 52.672 50.995 1.677 1
1 844 . 7 1 1 A 73 73 ALA CB C 73 18.812 20.556 -1.744 1
1 845 . 7 1 1 A 73 73 ALA N N 73 125.694 124.927 0.767 1
1 846 . 7 1 1 A 74 74 LEU H H 74 7.800 8.294 -0.494 1
1 847 . 7 1 1 A 74 74 LEU HA H 74 4.716 4.279 0.437 1
1 857 . 7 1 1 A 74 74 LEU C C 74 176.551 177.088 -0.537 1
1 858 . 7 1 1 A 74 74 LEU CA C 74 53.784 56.574 -2.790 1
1 859 . 7 1 1 A 74 74 LEU CB C 74 43.446 42.478 0.968 1
1 863 . 7 1 1 A 74 74 LEU N N 74 122.271 120.019 2.252 1
1 864 . 7 1 1 A 75 75 GLU H H 75 8.855 7.791 1.064 1
1 865 . 7 1 1 A 75 75 GLU HA H 75 4.336 4.062 0.274 1
1 870 . 7 1 1 A 75 75 GLU C C 75 176.465 176.480 -0.015 1
1 871 . 7 1 1 A 75 75 GLU CA C 75 56.507 57.158 -0.651 1
1 872 . 7 1 1 A 75 75 GLU CB C 75 30.245 27.162 3.083 1
1 874 . 7 1 1 A 75 75 GLU N N 75 122.678 117.767 4.911 1
1 875 . 7 1 1 A 76 76 ASP H H 76 8.542 8.525 0.017 1
1 876 . 7 1 1 A 76 76 ASP HA H 76 4.665 5.005 -0.340 1
1 879 . 7 1 1 A 76 76 ASP C C 76 176.087 176.248 -0.161 1
1 880 . 7 1 1 A 76 76 ASP CA C 76 55.107 54.734 0.373 1
1 881 . 7 1 1 A 76 76 ASP CB C 76 41.431 42.399 -0.968 1
1 882 . 7 1 1 A 76 76 ASP N N 76 121.488 120.098 1.390 1
1 883 . 7 1 1 A 77 77 ASN H H 77 8.322 7.585 0.737 1
1 884 . 7 1 1 A 77 77 ASN HA H 77 4.729 4.858 -0.129 1
1 889 . 7 1 1 A 77 77 ASN C C 77 175.566 174.813 0.753 1
1 890 . 7 1 1 A 77 77 ASN CA C 77 53.131 54.419 -1.288 1
1 891 . 7 1 1 A 77 77 ASN CB C 77 38.617 41.082 -2.465 1
1 892 . 7 1 1 A 77 77 ASN N N 77 118.676 115.938 2.738 1
1 894 . 7 1 1 A 78 78 GLY H H 78 8.311 7.377 0.934 1
1 895 . 7 1 1 A 78 78 GLY HA2 H 78 3.897 4.029 -0.132 1
1 896 . 7 1 1 A 78 78 GLY HA3 H 78 3.897 4.033 -0.136 1
1 897 . 7 1 1 A 78 78 GLY C C 78 173.376 172.431 0.945 1
1 898 . 7 1 1 A 78 78 GLY CA C 78 45.224 45.680 -0.456 1
1 899 . 7 1 1 A 78 78 GLY N N 78 108.939 104.098 4.841 1
1 900 . 7 1 1 A 79 79 VAL H H 79 7.882 8.534 -0.652 1
1 901 . 7 1 1 A 79 79 VAL HA H 79 4.345 4.048 0.297 1
1 909 . 7 1 1 A 79 79 VAL CA C 79 59.995 61.361 -1.366 1
1 910 . 7 1 1 A 79 79 VAL CB C 79 32.589 32.072 0.517 1
1 913 . 7 1 1 A 79 79 VAL N N 79 121.135 122.417 -1.282 1
1 914 . 7 1 1 A 80 80 PRO HA H 80 4.461 4.499 -0.038 1
1 921 . 7 1 1 A 80 80 PRO C C 80 176.979 176.352 0.627 1
1 922 . 7 1 1 A 80 80 PRO CA C 80 63.101 65.672 -2.571 1
1 923 . 7 1 1 A 80 80 PRO CB C 80 32.177 31.752 0.425 1
1 926 . 7 1 1 A 81 81 THR H H 81 8.281 7.698 0.583 1
1 927 . 7 1 1 A 81 81 THR HA H 81 4.095 4.533 -0.438 1
1 932 . 7 1 1 A 81 81 THR C C 81 175.270 174.957 0.313 1
1 933 . 7 1 1 A 81 81 THR CA C 81 62.872 61.460 1.412 1
1 934 . 7 1 1 A 81 81 THR CB C 81 69.642 71.544 -1.902 1
1 936 . 7 1 1 A 81 81 THR N N 81 114.684 110.027 4.657 1
1 937 . 7 1 1 A 82 82 GLY H H 82 8.338 8.853 -0.515 1
1 938 . 7 1 1 A 82 82 GLY HA2 H 82 4.095 3.810 0.285 1
1 939 . 7 1 1 A 82 82 GLY HA3 H 82 3.668 3.829 -0.161 1
1 940 . 7 1 1 A 82 82 GLY C C 82 174.139 174.412 -0.273 1
1 941 . 7 1 1 A 82 82 GLY CA C 82 45.083 47.031 -1.948 1
1 942 . 7 1 1 A 82 82 GLY N N 82 111.289 115.492 -4.203 1
1 943 . 7 1 1 A 83 83 VAL H H 83 7.668 7.922 -0.254 1
1 944 . 7 1 1 A 83 83 VAL HA H 83 3.985 4.358 -0.373 1
1 952 . 7 1 1 A 83 83 VAL C C 83 176.054 175.974 0.080 1
1 953 . 7 1 1 A 83 83 VAL CA C 83 62.431 61.144 1.287 1
1 954 . 7 1 1 A 83 83 VAL CB C 83 32.260 33.962 -1.702 1
1 957 . 7 1 1 A 83 83 VAL N N 83 120.003 119.071 0.932 1
1 958 . 7 1 1 A 84 84 LYS H H 84 8.645 8.832 -0.187 1
1 959 . 7 1 1 A 84 84 LYS HA H 84 4.276 3.922 0.354 1
1 968 . 7 1 1 A 84 84 LYS C C 84 176.832 179.149 -2.317 1
1 969 . 7 1 1 A 84 84 LYS CA C 84 56.272 59.523 -3.251 1
1 970 . 7 1 1 A 84 84 LYS CB C 84 32.876 32.165 0.711 1
1 974 . 7 1 1 A 84 84 LYS N N 84 126.447 126.962 -0.515 1
1 975 . 7 1 1 A 85 85 GLY H H 85 8.410 8.429 -0.019 1
1 976 . 7 1 1 A 85 85 GLY HA2 H 85 4.066 4.108 -0.042 1
1 977 . 7 1 1 A 85 85 GLY HA3 H 85 3.781 4.190 -0.409 1
1 978 . 7 1 1 A 85 85 GLY C C 85 173.969 173.553 0.416 1
1 979 . 7 1 1 A 85 85 GLY CA C 85 45.146 44.478 0.668 1
1 980 . 7 1 1 A 85 85 GLY N N 85 109.957 107.506 2.451 1
1 981 . 7 1 1 A 86 86 ASN H H 86 8.298 8.822 -0.524 1
1 982 . 7 1 1 A 86 86 ASN HA H 86 4.665 5.410 -0.745 1
1 987 . 7 1 1 A 86 86 ASN C C 86 174.987 174.266 0.721 1
1 988 . 7 1 1 A 86 86 ASN CA C 86 52.989 52.350 0.639 1
1 989 . 7 1 1 A 86 86 ASN CB C 86 38.376 38.897 -0.521 1
1 990 . 7 1 1 A 86 86 ASN N N 86 118.457 117.815 0.642 1
1 992 . 7 1 1 A 87 87 VAL H H 87 7.660 8.430 -0.770 1
1 993 . 7 1 1 A 87 87 VAL HA H 87 3.946 3.903 0.043 1
1 1001 . 7 1 1 A 87 87 VAL C C 87 174.902 175.711 -0.809 1
1 1002 . 7 1 1 A 87 87 VAL CA C 87 62.307 61.480 0.827 1
1 1003 . 7 1 1 A 87 87 VAL CB C 87 32.548 32.763 -0.215 1
1 1006 . 7 1 1 A 87 87 VAL N N 87 120.557 120.055 0.502 1
1 1007 . 7 1 1 A 88 88 GLN H H 88 8.115 8.312 -0.197 1
1 1008 . 7 1 1 A 88 88 GLN HA H 88 4.302 4.579 -0.277 1
1 1015 . 7 1 1 A 88 88 GLN C C 88 175.637 176.526 -0.889 1
1 1016 . 7 1 1 A 88 88 GLN CA C 88 55.336 55.907 -0.571 1
1 1017 . 7 1 1 A 88 88 GLN CB C 88 30.574 30.562 0.012 1
1 1019 . 7 1 1 A 88 88 GLN N N 88 122.280 119.389 2.891 1
1 1021 . 7 1 1 A 89 89 GLY H H 89 8.544 8.158 0.386 1
1 1022 . 7 1 1 A 89 89 GLY HA2 H 89 3.885 3.971 -0.086 1
1 1023 . 7 1 1 A 89 89 GLY HA3 H 89 3.885 3.991 -0.106 1
1 1024 . 7 1 1 A 89 89 GLY C C 89 172.861 175.049 -2.188 1
1 1025 . 7 1 1 A 89 89 GLY CA C 89 44.889 45.065 -0.176 1
1 1026 . 7 1 1 A 89 89 GLY N N 89 110.135 109.023 1.112 1
1 1027 . 7 1 1 A 90 90 ASN H H 90 8.451 8.916 -0.465 1
1 1028 . 7 1 1 A 90 90 ASN HA H 90 4.222 4.364 -0.142 1
1 1033 . 7 1 1 A 90 90 ASN C C 90 174.926 175.837 -0.911 1
1 1034 . 7 1 1 A 90 90 ASN CA C 90 54.613 56.026 -1.413 1
1 1035 . 7 1 1 A 90 90 ASN CB C 90 37.852 38.133 -0.281 1
1 1036 . 7 1 1 A 90 90 ASN N N 90 114.322 117.551 -3.229 1
1 1038 . 7 1 1 A 91 91 LEU H H 91 8.933 7.961 0.972 1
1 1039 . 7 1 1 A 91 91 LEU HA H 91 5.367 4.331 1.036 1
1 1049 . 7 1 1 A 91 91 LEU C C 91 178.732 175.779 2.953 1
1 1050 . 7 1 1 A 91 91 LEU CA C 91 55.160 57.116 -1.956 1
1 1051 . 7 1 1 A 91 91 LEU CB C 91 45.461 40.808 4.653 1
1 1055 . 7 1 1 A 91 91 LEU N N 91 120.057 118.131 1.926 1
1 1056 . 7 1 1 A 92 92 PHE H H 92 9.901 8.112 1.789 1
1 1057 . 7 1 1 A 92 92 PHE HA H 92 5.105 5.239 -0.134 1
1 1065 . 7 1 1 A 92 92 PHE C C 92 170.140 172.878 -2.738 1
1 1066 . 7 1 1 A 92 92 PHE CA C 92 56.236 56.435 -0.199 1
1 1067 . 7 1 1 A 92 92 PHE CB C 92 42.664 40.741 1.923 1
1 1073 . 7 1 1 A 92 92 PHE N N 92 119.740 115.891 3.849 1
1 1074 . 7 1 1 A 93 93 LYS H H 93 9.154 8.943 0.211 1
1 1075 . 7 1 1 A 93 93 LYS HA H 93 5.584 5.388 0.196 1
1 1083 . 7 1 1 A 93 93 LYS C C 93 174.830 175.104 -0.274 1
1 1084 . 7 1 1 A 93 93 LYS CA C 93 53.148 54.430 -1.282 1
1 1085 . 7 1 1 A 93 93 LYS CB C 93 36.660 35.018 1.642 1
1 1089 . 7 1 1 A 93 93 LYS N N 93 117.710 118.939 -1.229 1
1 1090 . 7 1 1 A 94 94 VAL H H 94 8.507 8.802 -0.295 1
1 1091 . 7 1 1 A 94 94 VAL HA H 94 4.872 5.024 -0.152 1
1 1099 . 7 1 1 A 94 94 VAL C C 94 174.408 174.925 -0.517 1
1 1100 . 7 1 1 A 94 94 VAL CA C 94 60.525 61.659 -1.134 1
1 1101 . 7 1 1 A 94 94 VAL CB C 94 34.862 34.482 0.380 1
1 1104 . 7 1 1 A 94 94 VAL N N 94 121.741 120.018 1.723 1
1 1105 . 7 1 1 A 95 95 ILE H H 95 8.959 8.971 -0.012 1
1 1106 . 7 1 1 A 95 95 ILE HA H 95 4.794 4.605 0.189 1
1 1116 . 7 1 1 A 95 95 ILE C C 95 177.642 176.280 1.362 1
1 1117 . 7 1 1 A 95 95 ILE CA C 95 59.713 60.633 -0.920 1
1 1118 . 7 1 1 A 95 95 ILE CB C 95 40.032 37.771 2.261 1
1 1122 . 7 1 1 A 95 95 ILE N N 95 126.794 128.466 -1.672 1
1 1123 . 7 1 1 A 96 96 THR H H 96 8.765 8.797 -0.032 1
1 1124 . 7 1 1 A 96 96 THR HA H 96 4.584 4.896 -0.312 1
1 1129 . 7 1 1 A 96 96 THR C C 96 177.023 175.635 1.388 1
1 1130 . 7 1 1 A 96 96 THR CA C 96 61.372 60.626 0.746 1
1 1131 . 7 1 1 A 96 96 THR CB C 96 70.794 71.882 -1.088 1
1 1133 . 7 1 1 A 96 96 THR N N 96 117.225 120.037 -2.812 1
1 1134 . 7 1 1 A 97 97 LYS H H 97 8.736 8.739 -0.003 1
1 1135 . 7 1 1 A 97 97 LYS HA H 97 4.101 4.032 0.069 1
1 1144 . 7 1 1 A 97 97 LYS C C 97 176.490 177.546 -1.056 1
1 1145 . 7 1 1 A 97 97 LYS CA C 97 58.583 59.546 -0.963 1
1 1146 . 7 1 1 A 97 97 LYS CB C 97 31.848 32.412 -0.564 1
1 1150 . 7 1 1 A 97 97 LYS N N 97 120.457 122.724 -2.267 1
1 1151 . 7 1 1 A 98 98 ASP H H 98 7.762 7.732 0.030 1
1 1152 . 7 1 1 A 98 98 ASP HA H 98 4.633 4.774 -0.141 1
1 1155 . 7 1 1 A 98 98 ASP C C 98 175.270 174.744 0.526 1
1 1156 . 7 1 1 A 98 98 ASP CA C 98 53.272 53.975 -0.703 1
1 1157 . 7 1 1 A 98 98 ASP CB C 98 39.909 40.974 -1.065 1
1 1158 . 7 1 1 A 98 98 ASP N N 98 116.281 116.330 -0.049 1
1 1159 . 7 1 1 A 99 99 ASP H H 99 8.340 8.843 -0.503 1
1 1160 . 7 1 1 A 99 99 ASP HA H 99 4.245 4.615 -0.370 1
1 1163 . 7 1 1 A 99 99 ASP C C 99 175.315 175.644 -0.329 1
1 1164 . 7 1 1 A 99 99 ASP CA C 99 55.989 55.532 0.457 1
1 1165 . 7 1 1 A 99 99 ASP CB C 99 39.827 38.880 0.947 1
1 1166 . 7 1 1 A 99 99 ASP N N 99 116.687 116.437 0.250 1
1 1167 . 7 1 1 A 100 100 THR H H 100 7.511 7.800 -0.289 1
1 1168 . 7 1 1 A 100 100 THR HA H 100 4.185 3.864 0.321 1
1 1173 . 7 1 1 A 100 100 THR C C 100 173.376 174.349 -0.973 1
1 1174 . 7 1 1 A 100 100 THR CA C 100 63.489 65.584 -2.095 1
1 1175 . 7 1 1 A 100 100 THR CB C 100 67.909 69.222 -1.313 1
1 1177 . 7 1 1 A 100 100 THR N N 100 116.525 111.409 5.116 1
1 1178 . 7 1 1 A 101 101 HIS H H 101 8.753 8.145 0.608 1
1 1179 . 7 1 1 A 101 101 HIS HA H 101 4.898 4.575 0.323 1
1 1184 . 7 1 1 A 101 101 HIS C C 101 174.345 173.898 0.447 1
1 1185 . 7 1 1 A 101 101 HIS CA C 101 55.072 56.196 -1.124 1
1 1186 . 7 1 1 A 101 101 HIS CB C 101 32.835 27.964 4.871 1
1 1189 . 7 1 1 A 101 101 HIS N N 101 125.953 116.573 9.380 1
1 1190 . 7 1 1 A 102 102 TYR H H 102 9.023 9.094 -0.071 1
1 1191 . 7 1 1 A 102 102 TYR HA H 102 4.545 4.899 -0.354 1
1 1198 . 7 1 1 A 102 102 TYR C C 102 174.126 175.243 -1.117 1
1 1199 . 7 1 1 A 102 102 TYR CA C 102 57.260 56.638 0.622 1
1 1200 . 7 1 1 A 102 102 TYR CB C 102 40.381 39.321 1.060 1
1 1205 . 7 1 1 A 102 102 TYR N N 102 121.975 122.258 -0.283 1
1 1206 . 7 1 1 A 103 103 TYR H H 103 8.899 9.042 -0.143 1
1 1207 . 7 1 1 A 103 103 TYR HA H 103 4.729 4.954 -0.225 1
1 1214 . 7 1 1 A 103 103 TYR C C 103 174.139 175.468 -1.329 1
1 1215 . 7 1 1 A 103 103 TYR CA C 103 58.036 57.752 0.284 1
1 1216 . 7 1 1 A 103 103 TYR CB C 103 40.485 39.636 0.849 1
1 1221 . 7 1 1 A 103 103 TYR N N 103 122.012 123.051 -1.039 1
1 1222 . 7 1 1 A 104 104 ILE H H 104 8.605 8.844 -0.239 1
1 1223 . 7 1 1 A 104 104 ILE HA H 104 4.859 5.124 -0.265 1
1 1233 . 7 1 1 A 104 104 ILE C C 104 172.769 173.982 -1.213 1
1 1234 . 7 1 1 A 104 104 ILE CA C 104 59.554 59.471 0.083 1
1 1235 . 7 1 1 A 104 104 ILE CB C 104 40.631 41.778 -1.147 1
1 1239 . 7 1 1 A 104 104 ILE N N 104 123.443 123.585 -0.142 1
1 1240 . 7 1 1 A 105 105 GLN H H 105 9.369 8.642 0.727 1
1 1241 . 7 1 1 A 105 105 GLN HA H 105 4.895 4.991 -0.096 1
1 1248 . 7 1 1 A 105 105 GLN C C 105 175.642 174.946 0.696 1
1 1249 . 7 1 1 A 105 105 GLN CA C 105 54.965 53.881 1.084 1
1 1250 . 7 1 1 A 105 105 GLN CB C 105 32.856 32.143 0.713 1
1 1252 . 7 1 1 A 105 105 GLN N N 105 125.079 123.960 1.119 1
1 1254 . 7 1 1 A 106 106 ALA H H 106 8.513 8.424 0.089 1
1 1255 . 7 1 1 A 106 106 ALA HA H 106 4.962 4.830 0.132 1
1 1259 . 7 1 1 A 106 106 ALA C C 106 175.854 177.886 -2.032 1
1 1260 . 7 1 1 A 106 106 ALA CA C 106 50.272 50.240 0.032 1
1 1261 . 7 1 1 A 106 106 ALA CB C 106 21.197 21.958 -0.761 1
1 1262 . 7 1 1 A 106 106 ALA N N 106 129.303 128.086 1.217 1
1 1263 . 7 1 1 A 107 107 SER H H 107 9.468 8.755 0.713 1
1 1264 . 7 1 1 A 107 107 SER HA H 107 4.447 4.424 0.023 1
1 1267 . 7 1 1 A 107 107 SER C C 107 173.785 174.683 -0.898 1
1 1268 . 7 1 1 A 107 107 SER CA C 107 60.048 62.056 -2.008 1
1 1269 . 7 1 1 A 107 107 SER CB C 107 64.643 63.529 1.114 1
1 1270 . 7 1 1 A 107 107 SER N N 107 112.962 116.350 -3.388 1
1 1271 . 7 1 1 A 108 108 SER H H 108 7.555 7.905 -0.350 1
1 1272 . 7 1 1 A 108 108 SER HA H 108 4.665 4.974 -0.309 1
1 1275 . 7 1 1 A 108 108 SER C C 108 174.381 173.996 0.385 1
1 1276 . 7 1 1 A 108 108 SER CA C 108 56.907 57.383 -0.476 1
1 1277 . 7 1 1 A 108 108 SER CB C 108 66.370 66.599 -0.229 1
1 1278 . 7 1 1 A 108 108 SER N N 108 112.243 113.485 -1.242 1
1 1279 . 7 1 1 A 109 109 LYS H H 109 8.978 9.130 -0.152 1
1 1280 . 7 1 1 A 109 109 LYS HA H 109 4.777 4.051 0.726 1
1 1287 . 7 1 1 A 109 109 LYS C C 109 179.992 178.951 1.041 1
1 1288 . 7 1 1 A 109 109 LYS CA C 109 59.766 59.221 0.545 1
1 1289 . 7 1 1 A 109 109 LYS CB C 109 32.342 32.082 0.260 1
1 1293 . 7 1 1 A 109 109 LYS N N 109 123.170 124.363 -1.193 1
1 1294 . 7 1 1 A 110 110 ALA H H 110 8.608 8.208 0.400 1
1 1295 . 7 1 1 A 110 110 ALA HA H 110 4.178 4.137 0.041 1
1 1299 . 7 1 1 A 110 110 ALA C C 110 179.895 179.450 0.445 1
1 1300 . 7 1 1 A 110 110 ALA CA C 110 54.871 55.256 -0.385 1
1 1301 . 7 1 1 A 110 110 ALA CB C 110 18.065 19.038 -0.973 1
1 1302 . 7 1 1 A 110 110 ALA N N 110 123.750 122.935 0.815 1
1 1303 . 7 1 1 A 111 111 GLU H H 111 8.185 8.241 -0.056 1
1 1304 . 7 1 1 A 111 111 GLU HA H 111 4.180 4.036 0.144 1
1 1309 . 7 1 1 A 111 111 GLU C C 111 178.587 178.908 -0.321 1
1 1310 . 7 1 1 A 111 111 GLU CA C 111 59.466 59.817 -0.351 1
1 1311 . 7 1 1 A 111 111 GLU CB C 111 31.067 29.519 1.548 1
1 1313 . 7 1 1 A 111 111 GLU N N 111 119.757 118.726 1.031 1
1 1314 . 7 1 1 A 112 112 ARG H H 112 8.008 7.871 0.137 1
1 1315 . 7 1 1 A 112 112 ARG HA H 112 3.642 4.151 -0.509 1
1 1322 . 7 1 1 A 112 112 ARG C C 112 176.481 178.346 -1.865 1
1 1323 . 7 1 1 A 112 112 ARG CA C 112 60.419 59.498 0.921 1
1 1324 . 7 1 1 A 112 112 ARG CB C 112 29.957 30.203 -0.246 1
1 1327 . 7 1 1 A 112 112 ARG N N 112 118.430 119.971 -1.541 1
1 1328 . 7 1 1 A 113 113 ALA H H 113 7.985 8.191 -0.206 1
1 1329 . 7 1 1 A 113 113 ALA HA H 113 3.925 4.043 -0.118 1
1 1333 . 7 1 1 A 113 113 ALA C C 113 180.117 180.047 0.070 1
1 1334 . 7 1 1 A 113 113 ALA CA C 113 55.372 55.157 0.215 1
1 1335 . 7 1 1 A 113 113 ALA CB C 113 17.825 18.311 -0.486 1
1 1336 . 7 1 1 A 113 113 ALA N N 113 119.980 120.565 -0.585 1
1 1337 . 7 1 1 A 114 114 GLU H H 114 8.093 8.290 -0.197 1
1 1338 . 7 1 1 A 114 114 GLU HA H 114 3.936 3.990 -0.054 1
1 1343 . 7 1 1 A 114 114 GLU C C 114 180.586 179.078 1.508 1
1 1344 . 7 1 1 A 114 114 GLU CA C 114 59.148 58.927 0.221 1
1 1345 . 7 1 1 A 114 114 GLU CB C 114 30.080 29.884 0.196 1
1 1347 . 7 1 1 A 114 114 GLU N N 114 117.168 117.838 -0.670 1
1 1348 . 7 1 1 A 115 115 TRP H H 115 7.980 8.999 -1.019 1
1 1349 . 7 1 1 A 115 115 TRP HA H 115 3.775 4.319 -0.544 1
1 1358 . 7 1 1 A 115 115 TRP C C 115 177.714 178.664 -0.950 1
1 1359 . 7 1 1 A 115 115 TRP CA C 115 62.696 60.186 2.510 1
1 1360 . 7 1 1 A 115 115 TRP CB C 115 29.052 28.823 0.229 1
1 1366 . 7 1 1 A 115 115 TRP N N 115 120.974 120.699 0.275 1
1 1368 . 7 1 1 A 116 116 ILE H H 116 8.297 8.491 -0.194 1
1 1369 . 7 1 1 A 116 116 ILE HA H 116 3.270 3.646 -0.376 1
1 1379 . 7 1 1 A 116 116 ILE C C 116 177.568 177.866 -0.298 1
1 1380 . 7 1 1 A 116 116 ILE CA C 116 66.643 64.299 2.344 1
1 1381 . 7 1 1 A 116 116 ILE CB C 116 37.606 37.493 0.113 1
1 1385 . 7 1 1 A 116 116 ILE N N 116 118.408 121.185 -2.777 1
1 1386 . 7 1 1 A 117 117 GLU H H 117 8.026 8.505 -0.479 1
1 1387 . 7 1 1 A 117 117 GLU HA H 117 3.880 3.978 -0.098 1
1 1392 . 7 1 1 A 117 117 GLU C C 117 178.476 178.888 -0.412 1
1 1393 . 7 1 1 A 117 117 GLU CA C 117 59.219 59.779 -0.560 1
1 1394 . 7 1 1 A 117 117 GLU CB C 117 29.381 29.425 -0.044 1
1 1396 . 7 1 1 A 117 117 GLU N N 117 117.096 120.321 -3.225 1
1 1397 . 7 1 1 A 118 118 ALA H H 118 7.555 7.821 -0.266 1
1 1398 . 7 1 1 A 118 118 ALA HA H 118 3.952 4.046 -0.094 1
1 1402 . 7 1 1 A 118 118 ALA C C 118 179.862 179.910 -0.048 1
1 1403 . 7 1 1 A 118 118 ALA CA C 118 54.772 55.112 -0.340 1
1 1404 . 7 1 1 A 118 118 ALA CB C 118 18.277 18.469 -0.192 1
1 1405 . 7 1 1 A 118 118 ALA N N 118 119.817 121.838 -2.021 1
1 1406 . 7 1 1 A 119 119 ILE H H 119 8.167 7.988 0.179 1
1 1407 . 7 1 1 A 119 119 ILE HA H 119 3.558 3.756 -0.198 1
1 1417 . 7 1 1 A 119 119 ILE C C 119 178.564 177.914 0.650 1
1 1418 . 7 1 1 A 119 119 ILE CA C 119 65.766 65.208 0.558 1
1 1419 . 7 1 1 A 119 119 ILE CB C 119 38.840 38.105 0.735 1
1 1423 . 7 1 1 A 119 119 ILE N N 119 116.280 117.824 -1.544 1
1 1424 . 7 1 1 A 120 120 LYS H H 120 8.790 8.203 0.587 1
1 1425 . 7 1 1 A 120 120 LYS HA H 120 3.965 4.298 -0.333 1
1 1434 . 7 1 1 A 120 120 LYS C C 120 179.673 179.342 0.331 1
1 1435 . 7 1 1 A 120 120 LYS CA C 120 60.031 60.362 -0.331 1
1 1436 . 7 1 1 A 120 120 LYS CB C 120 32.547 32.214 0.333 1
1 1440 . 7 1 1 A 120 120 LYS N N 120 119.650 118.681 0.969 1
1 1441 . 7 1 1 A 121 121 LYS H H 121 7.594 8.188 -0.594 1
1 1442 . 7 1 1 A 121 121 LYS HA H 121 4.095 3.946 0.149 1
1 1451 . 7 1 1 A 121 121 LYS C C 121 177.962 179.129 -1.167 1
1 1452 . 7 1 1 A 121 121 LYS CA C 121 58.848 59.316 -0.468 1
1 1453 . 7 1 1 A 121 121 LYS CB C 121 32.547 32.269 0.278 1
1 1457 . 7 1 1 A 121 121 LYS N N 121 117.197 119.724 -2.527 1
1 1458 . 7 1 1 A 122 122 LEU H H 122 7.586 7.843 -0.257 1
1 1459 . 7 1 1 A 122 122 LEU HA H 122 4.535 3.976 0.559 1
1 1469 . 7 1 1 A 122 122 LEU C C 122 177.902 178.065 -0.163 1
1 1470 . 7 1 1 A 122 122 LEU CA C 122 55.071 57.945 -2.874 1
1 1471 . 7 1 1 A 122 122 LEU CB C 122 42.888 41.812 1.076 1
1 1475 . 7 1 1 A 122 122 LEU N N 122 116.861 120.051 -3.190 1
1 1476 . 7 1 1 A 123 123 THR H H 123 7.636 7.766 -0.130 1
1 1477 . 7 1 1 A 123 123 THR HA H 123 4.445 4.302 0.143 1
1 1482 . 7 1 1 A 123 123 THR C C 123 175.714 173.737 1.977 1
1 1483 . 7 1 1 A 123 123 THR CA C 123 62.643 61.682 0.961 1
1 1484 . 7 1 1 A 123 123 THR CB C 123 70.259 68.089 2.170 1
1 1486 . 7 1 1 A 123 123 THR N N 123 108.963 107.918 1.045 1
1 1487 . 7 1 1 A 124 124 SER H H 124 7.912 8.545 -0.633 1
1 1488 . 7 1 1 A 124 124 SER HA H 124 4.626 4.703 -0.077 1
1 1491 . 7 1 1 A 124 124 SER C C 124 174.405 173.564 0.841 1
1 1492 . 7 1 1 A 124 124 SER CA C 124 58.390 57.157 1.233 1
1 1493 . 7 1 1 A 124 124 SER CB C 124 64.255 65.624 -1.369 1
1 1494 . 7 1 1 A 124 124 SER N N 124 116.876 116.866 0.010 1
1 1495 . 7 1 1 A 125 125 GLY H H 125 8.307 8.684 -0.377 1
1 1496 . 7 1 1 A 125 125 GLY HA2 H 125 4.166 4.099 0.067 1
1 1497 . 7 1 1 A 125 125 GLY HA3 H 125 4.166 4.102 0.064 1
1 1498 . 7 1 1 A 125 125 GLY C C 125 171.921 173.147 -1.226 1
1 1499 . 7 1 1 A 125 125 GLY CA C 125 44.748 44.182 0.566 1
1 1500 . 7 1 1 A 125 125 GLY N N 125 110.006 112.146 -2.140 1
1 1501 . 7 1 1 A 126 126 PRO HA H 126 4.510 4.736 -0.226 1
1 1508 . 7 1 1 A 126 126 PRO C C 126 177.471 175.528 1.943 1
1 1509 . 7 1 1 A 126 126 PRO CA C 126 63.419 62.623 0.796 1
1 1510 . 7 1 1 A 126 126 PRO CB C 126 32.106 31.954 0.152 1
1 1513 . 7 1 1 A 127 127 SER H H 127 8.607 8.715 -0.108 1
1 1514 . 7 1 1 A 127 127 SER C C 127 174.628 172.447 2.181 1
1 1515 . 7 1 1 A 127 127 SER CA C 127 58.513 56.971 1.542 1
1 1516 . 7 1 1 A 127 127 SER CB C 127 63.679 64.738 -1.059 1
1 1517 . 7 1 1 A 127 127 SER N N 127 116.390 118.923 -2.533 1
1 1518 . 7 1 1 A 128 128 SER H H 128 8.272 8.529 -0.257 1
1 1519 . 7 1 1 A 128 128 SER HA H 128 4.496 4.662 -0.166 1
1 1520 . 7 1 1 A 128 128 SER C C 128 173.921 173.956 -0.035 1
1 1521 . 7 1 1 A 128 128 SER CA C 128 58.442 57.487 0.955 1
1 1522 . 7 1 1 A 128 128 SER CB C 128 64.173 67.599 -3.426 1
1 1523 . 7 1 1 A 128 128 SER N N 128 117.506 116.782 0.724 1
1 1 . 8 1 1 A 7 7 GLY HA2 H 7 3.978 4.204 -0.226 1
1 2 . 8 1 1 A 7 7 GLY HA3 H 7 3.978 4.210 -0.232 1
1 3 . 8 1 1 A 7 7 GLY C C 7 174.274 174.034 0.240 1
1 4 . 8 1 1 A 7 7 GLY CA C 7 45.383 45.390 -0.007 1
1 5 . 8 1 1 A 8 8 SER H H 8 8.211 8.861 -0.650 1
1 6 . 8 1 1 A 8 8 SER HA H 8 4.425 4.602 -0.177 1
1 9 . 8 1 1 A 8 8 SER C C 8 174.635 175.114 -0.479 1
1 10 . 8 1 1 A 8 8 SER CA C 8 58.425 59.934 -1.509 1
1 11 . 8 1 1 A 8 8 SER CB C 8 63.885 64.310 -0.425 1
1 12 . 8 1 1 A 8 8 SER N N 8 115.732 116.875 -1.143 1
1 13 . 8 1 1 A 9 9 LEU H H 9 8.316 7.596 0.720 1
1 14 . 8 1 1 A 9 9 LEU HA H 9 4.334 4.514 -0.180 1
1 24 . 8 1 1 A 9 9 LEU C C 9 177.447 175.910 1.537 1
1 25 . 8 1 1 A 9 9 LEU CA C 9 55.407 56.211 -0.804 1
1 26 . 8 1 1 A 9 9 LEU CB C 9 42.171 44.291 -2.120 1
1 30 . 8 1 1 A 9 9 LEU N N 9 123.943 118.149 5.794 1
1 31 . 8 1 1 A 10 10 SER H H 10 8.304 8.046 0.258 1
1 32 . 8 1 1 A 10 10 SER HA H 10 4.424 4.733 -0.309 1
1 35 . 8 1 1 A 10 10 SER C C 10 175.025 173.769 1.256 1
1 36 . 8 1 1 A 10 10 SER CA C 10 58.425 57.207 1.218 1
1 37 . 8 1 1 A 10 10 SER CB C 10 63.638 64.951 -1.313 1
1 38 . 8 1 1 A 10 10 SER N N 10 116.718 113.039 3.679 1
1 39 . 8 1 1 A 11 11 THR H H 11 8.003 8.397 -0.394 1
1 40 . 8 1 1 A 11 11 THR HA H 11 4.196 4.362 -0.166 1
1 45 . 8 1 1 A 11 11 THR C C 11 176.296 173.510 2.786 1
1 46 . 8 1 1 A 11 11 THR CA C 11 62.483 63.179 -0.696 1
1 47 . 8 1 1 A 11 11 THR CB C 11 69.266 67.746 1.520 1
1 49 . 8 1 1 A 11 11 THR N N 11 114.902 118.512 -3.610 1
1 50 . 8 1 1 A 12 12 VAL H H 12 8.095 8.278 -0.183 1
1 51 . 8 1 1 A 12 12 VAL HA H 12 3.826 4.309 -0.483 1
1 59 . 8 1 1 A 12 12 VAL C C 12 178.501 177.015 1.486 1
1 60 . 8 1 1 A 12 12 VAL CA C 12 64.760 63.715 1.045 1
1 61 . 8 1 1 A 12 12 VAL CB C 12 32.013 33.735 -1.722 1
1 64 . 8 1 1 A 12 12 VAL N N 12 122.111 125.304 -3.193 1
1 65 . 8 1 1 A 13 13 GLU H H 13 8.151 8.671 -0.520 1
1 66 . 8 1 1 A 13 13 GLU HA H 13 3.244 4.422 -1.178 1
1 71 . 8 1 1 A 13 13 GLU C C 13 175.702 177.920 -2.218 1
1 72 . 8 1 1 A 13 13 GLU CA C 13 58.354 58.979 -0.625 1
1 73 . 8 1 1 A 13 13 GLU CB C 13 28.843 29.377 -0.534 1
1 75 . 8 1 1 A 13 13 GLU N N 13 120.316 122.572 -2.256 1
1 76 . 8 1 1 A 14 14 LEU H H 14 7.067 7.733 -0.666 1
1 77 . 8 1 1 A 14 14 LEU HA H 14 4.157 4.245 -0.088 1
1 87 . 8 1 1 A 14 14 LEU C C 14 176.863 176.886 -0.023 1
1 88 . 8 1 1 A 14 14 LEU CA C 14 53.324 55.295 -1.971 1
1 89 . 8 1 1 A 14 14 LEU CB C 14 41.636 41.453 0.183 1
1 93 . 8 1 1 A 14 14 LEU N N 14 117.035 119.196 -2.161 1
1 94 . 8 1 1 A 15 15 SER H H 15 7.645 8.131 -0.486 1
1 95 . 8 1 1 A 15 15 SER HA H 15 4.305 4.596 -0.291 1
1 98 . 8 1 1 A 15 15 SER C C 15 175.340 173.319 2.021 1
1 99 . 8 1 1 A 15 15 SER CA C 15 59.783 57.946 1.837 1
1 100 . 8 1 1 A 15 15 SER CB C 15 64.625 61.243 3.382 1
1 101 . 8 1 1 A 15 15 SER N N 15 114.216 113.872 0.344 1
1 102 . 8 1 1 A 16 16 GLY H H 16 8.506 8.205 0.301 1
1 103 . 8 1 1 A 16 16 GLY HA2 H 16 4.237 4.301 -0.064 1
1 104 . 8 1 1 A 16 16 GLY HA3 H 16 3.927 4.321 -0.394 1
1 105 . 8 1 1 A 16 16 GLY C C 16 173.661 172.140 1.521 1
1 106 . 8 1 1 A 16 16 GLY CA C 16 44.995 43.955 1.040 1
1 107 . 8 1 1 A 16 16 GLY N N 16 111.838 110.305 1.533 1
1 108 . 8 1 1 A 17 17 THR H H 17 8.482 9.186 -0.704 1
1 109 . 8 1 1 A 17 17 THR HA H 17 4.319 4.396 -0.077 1
1 114 . 8 1 1 A 17 17 THR C C 17 174.758 174.542 0.216 1
1 115 . 8 1 1 A 17 17 THR CA C 17 62.272 63.644 -1.372 1
1 116 . 8 1 1 A 17 17 THR CB C 17 70.706 68.924 1.782 1
1 118 . 8 1 1 A 17 17 THR N N 17 116.679 115.968 0.711 1
1 119 . 8 1 1 A 18 18 VAL H H 18 8.948 8.734 0.214 1
1 120 . 8 1 1 A 18 18 VAL HA H 18 3.950 4.377 -0.427 1
1 128 . 8 1 1 A 18 18 VAL C C 18 176.669 177.100 -0.431 1
1 129 . 8 1 1 A 18 18 VAL CA C 18 64.813 63.599 1.214 1
1 130 . 8 1 1 A 18 18 VAL CB C 18 31.807 31.791 0.016 1
1 133 . 8 1 1 A 18 18 VAL N N 18 127.156 127.622 -0.466 1
1 134 . 8 1 1 A 19 19 VAL H H 19 9.359 9.437 -0.078 1
1 135 . 8 1 1 A 19 19 VAL HA H 19 4.234 4.388 -0.154 1
1 143 . 8 1 1 A 19 19 VAL C C 19 175.738 175.542 0.196 1
1 144 . 8 1 1 A 19 19 VAL CA C 19 62.060 61.971 0.089 1
1 145 . 8 1 1 A 19 19 VAL CB C 19 33.822 33.292 0.530 1
1 148 . 8 1 1 A 19 19 VAL N N 19 125.162 121.969 3.193 1
1 149 . 8 1 1 A 20 20 LYS H H 20 7.584 7.204 0.380 1
1 150 . 8 1 1 A 20 20 LYS HA H 20 4.346 4.451 -0.105 1
1 159 . 8 1 1 A 20 20 LYS C C 20 172.818 174.016 -1.198 1
1 160 . 8 1 1 A 20 20 LYS CA C 20 56.801 55.755 1.046 1
1 161 . 8 1 1 A 20 20 LYS CB C 20 36.624 35.678 0.946 1
1 165 . 8 1 1 A 20 20 LYS N N 20 121.024 121.233 -0.209 1
1 166 . 8 1 1 A 21 21 GLN H H 21 8.625 8.481 0.144 1
1 167 . 8 1 1 A 21 21 GLN HA H 21 6.003 5.365 0.638 1
1 174 . 8 1 1 A 21 21 GLN C C 21 174.914 174.989 -0.075 1
1 175 . 8 1 1 A 21 21 GLN CA C 21 54.207 54.538 -0.331 1
1 176 . 8 1 1 A 21 21 GLN CB C 21 33.452 33.258 0.194 1
1 178 . 8 1 1 A 21 21 GLN N N 21 122.108 124.055 -1.947 1
1 180 . 8 1 1 A 22 22 GLY H H 22 8.964 8.301 0.663 1
1 181 . 8 1 1 A 22 22 GLY HA2 H 22 4.665 4.456 0.209 1
1 182 . 8 1 1 A 22 22 GLY HA3 H 22 4.295 4.610 -0.315 1
1 183 . 8 1 1 A 22 22 GLY C C 22 170.879 171.634 -0.755 1
1 184 . 8 1 1 A 22 22 GLY CA C 22 45.683 45.804 -0.121 1
1 185 . 8 1 1 A 22 22 GLY N N 22 108.508 109.042 -0.534 1
1 186 . 8 1 1 A 23 23 TYR H H 23 9.145 8.694 0.451 1
1 187 . 8 1 1 A 23 23 TYR HA H 23 5.595 5.527 0.068 1
1 194 . 8 1 1 A 23 23 TYR C C 23 175.824 175.495 0.329 1
1 195 . 8 1 1 A 23 23 TYR CA C 23 58.019 56.963 1.056 1
1 196 . 8 1 1 A 23 23 TYR CB C 23 39.251 40.391 -1.140 1
1 201 . 8 1 1 A 23 23 TYR N N 23 120.809 119.598 1.211 1
1 202 . 8 1 1 A 24 24 LEU H H 24 8.935 9.521 -0.586 1
1 203 . 8 1 1 A 24 24 LEU HA H 24 4.716 5.216 -0.500 1
1 213 . 8 1 1 A 24 24 LEU C C 24 174.648 175.943 -1.295 1
1 214 . 8 1 1 A 24 24 LEU CA C 24 53.907 53.314 0.593 1
1 215 . 8 1 1 A 24 24 LEU CB C 24 46.078 45.053 1.025 1
1 219 . 8 1 1 A 24 24 LEU N N 24 122.887 124.725 -1.838 1
1 220 . 8 1 1 A 25 25 ALA H H 25 8.145 8.498 -0.353 1
1 221 . 8 1 1 A 25 25 ALA HA H 25 5.477 5.441 0.036 1
1 225 . 8 1 1 A 25 25 ALA C C 25 175.751 176.250 -0.499 1
1 226 . 8 1 1 A 25 25 ALA CA C 25 50.719 50.518 0.201 1
1 227 . 8 1 1 A 25 25 ALA CB C 25 21.074 20.856 0.218 1
1 228 . 8 1 1 A 25 25 ALA N N 25 122.280 123.017 -0.737 1
1 229 . 8 1 1 A 26 26 LYS H H 26 9.167 8.514 0.653 1
1 230 . 8 1 1 A 26 26 LYS HA H 26 5.221 4.399 0.822 1
1 239 . 8 1 1 A 26 26 LYS C C 26 175.421 175.148 0.273 1
1 240 . 8 1 1 A 26 26 LYS CA C 26 54.383 55.968 -1.585 1
1 241 . 8 1 1 A 26 26 LYS CB C 26 36.125 33.349 2.776 1
1 245 . 8 1 1 A 26 26 LYS N N 26 120.638 126.032 -5.394 1
1 246 . 8 1 1 A 27 27 GLN H H 27 7.866 8.144 -0.278 1
1 247 . 8 1 1 A 27 27 GLN HA H 27 3.525 4.942 -1.417 1
1 254 . 8 1 1 A 27 27 GLN C C 27 177.022 174.365 2.657 1
1 255 . 8 1 1 A 27 27 GLN CA C 27 55.778 53.699 2.079 1
1 256 . 8 1 1 A 27 27 GLN CB C 27 29.864 31.136 -1.272 1
1 258 . 8 1 1 A 27 27 GLN N N 27 130.194 125.392 4.802 1
1 260 . 8 1 1 A 28 28 GLY H H 28 8.565 8.314 0.251 1
1 261 . 8 1 1 A 28 28 GLY HA2 H 28 4.125 4.059 0.066 1
1 262 . 8 1 1 A 28 28 GLY HA3 H 28 4.034 4.095 -0.061 1
1 263 . 8 1 1 A 28 28 GLY C C 28 174.030 172.618 1.412 1
1 264 . 8 1 1 A 28 28 GLY CA C 28 45.665 45.308 0.357 1
1 265 . 8 1 1 A 28 28 GLY N N 28 115.528 111.864 3.664 1
1 266 . 8 1 1 A 29 29 HIS HA H 29 4.355 4.826 -0.471 1
1 271 . 8 1 1 A 29 29 HIS CA C 29 58.795 56.237 2.558 1
1 272 . 8 1 1 A 29 29 HIS CB C 29 31.283 32.192 -0.909 1
1 275 . 8 1 1 A 30 30 LYS HA H 30 4.096 4.359 -0.263 1
1 284 . 8 1 1 A 30 30 LYS CA C 30 57.290 55.470 1.820 1
1 285 . 8 1 1 A 30 30 LYS CB C 30 31.951 31.391 0.560 1
1 289 . 8 1 1 A 31 31 ARG HA H 31 3.975 4.500 -0.525 1
1 296 . 8 1 1 A 31 31 ARG CA C 31 55.973 56.102 -0.129 1
1 297 . 8 1 1 A 31 31 ARG CB C 31 29.902 32.262 -2.360 1
1 300 . 8 1 1 A 32 32 LYS HA H 32 4.160 4.296 -0.136 1
1 309 . 8 1 1 A 32 32 LYS C C 32 175.678 175.581 0.097 1
1 310 . 8 1 1 A 32 32 LYS CA C 32 56.254 58.053 -1.799 1
1 311 . 8 1 1 A 32 32 LYS CB C 32 31.602 32.304 -0.702 1
1 315 . 8 1 1 A 33 33 ASN H H 33 7.925 8.439 -0.514 1
1 316 . 8 1 1 A 33 33 ASN HA H 33 4.799 4.308 0.491 1
1 321 . 8 1 1 A 33 33 ASN C C 33 174.005 174.526 -0.521 1
1 322 . 8 1 1 A 33 33 ASN CA C 33 52.407 55.876 -3.469 1
1 323 . 8 1 1 A 33 33 ASN CB C 33 39.879 36.587 3.292 1
1 324 . 8 1 1 A 33 33 ASN N N 33 116.990 116.017 0.973 1
1 326 . 8 1 1 A 34 34 TRP H H 34 8.798 8.595 0.203 1
1 327 . 8 1 1 A 34 34 TRP HA H 34 4.755 5.185 -0.430 1
1 336 . 8 1 1 A 34 34 TRP C C 34 176.090 176.180 -0.090 1
1 337 . 8 1 1 A 34 34 TRP CA C 34 57.119 56.813 0.306 1
1 338 . 8 1 1 A 34 34 TRP CB C 34 30.596 29.802 0.794 1
1 344 . 8 1 1 A 34 34 TRP N N 34 121.917 118.323 3.594 1
1 346 . 8 1 1 A 35 35 LYS H H 35 8.404 8.674 -0.270 1
1 347 . 8 1 1 A 35 35 LYS HA H 35 4.846 4.880 -0.034 1
1 354 . 8 1 1 A 35 35 LYS C C 35 176.088 176.043 0.045 1
1 355 . 8 1 1 A 35 35 LYS CA C 35 54.418 55.049 -0.631 1
1 356 . 8 1 1 A 35 35 LYS CB C 35 36.125 35.097 1.028 1
1 360 . 8 1 1 A 35 35 LYS N N 35 120.864 124.432 -3.568 1
1 361 . 8 1 1 A 36 36 VAL H H 36 8.977 8.872 0.105 1
1 362 . 8 1 1 A 36 36 VAL HA H 36 4.274 4.367 -0.093 1
1 370 . 8 1 1 A 36 36 VAL C C 36 176.733 176.385 0.348 1
1 371 . 8 1 1 A 36 36 VAL CA C 36 64.319 63.642 0.677 1
1 372 . 8 1 1 A 36 36 VAL CB C 36 31.602 31.987 -0.385 1
1 375 . 8 1 1 A 36 36 VAL N N 36 124.314 124.851 -0.537 1
1 376 . 8 1 1 A 37 37 ARG H H 37 9.498 10.305 -0.807 1
1 377 . 8 1 1 A 37 37 ARG HA H 37 5.053 4.998 0.055 1
1 384 . 8 1 1 A 37 37 ARG C C 37 174.442 174.588 -0.146 1
1 385 . 8 1 1 A 37 37 ARG CA C 37 53.272 54.038 -0.766 1
1 386 . 8 1 1 A 37 37 ARG CB C 37 34.563 34.199 0.364 1
1 389 . 8 1 1 A 37 37 ARG N N 37 128.121 126.891 1.230 1
1 390 . 8 1 1 A 38 38 ARG H H 38 8.755 8.392 0.363 1
1 391 . 8 1 1 A 38 38 ARG HA H 38 4.626 4.193 0.433 1
1 398 . 8 1 1 A 38 38 ARG C C 38 175.514 174.823 0.691 1
1 399 . 8 1 1 A 38 38 ARG CA C 38 55.601 55.540 0.061 1
1 400 . 8 1 1 A 38 38 ARG CB C 38 32.219 30.710 1.509 1
1 403 . 8 1 1 A 38 38 ARG N N 38 121.442 123.476 -2.034 1
1 404 . 8 1 1 A 39 39 PHE H H 39 9.865 8.930 0.935 1
1 405 . 8 1 1 A 39 39 PHE HA H 39 5.424 5.117 0.307 1
1 413 . 8 1 1 A 39 39 PHE C C 39 175.423 174.683 0.740 1
1 414 . 8 1 1 A 39 39 PHE CA C 39 57.419 57.333 0.086 1
1 415 . 8 1 1 A 39 39 PHE CB C 39 42.623 40.604 2.019 1
1 421 . 8 1 1 A 39 39 PHE N N 39 130.027 126.505 3.522 1
1 422 . 8 1 1 A 40 40 VAL H H 40 9.300 9.903 -0.603 1
1 423 . 8 1 1 A 40 40 VAL HA H 40 4.846 5.323 -0.477 1
1 431 . 8 1 1 A 40 40 VAL C C 40 174.477 173.619 0.858 1
1 432 . 8 1 1 A 40 40 VAL CA C 40 62.343 59.752 2.591 1
1 433 . 8 1 1 A 40 40 VAL CB C 40 35.755 34.718 1.037 1
1 436 . 8 1 1 A 40 40 VAL N N 40 119.369 123.193 -3.824 1
1 437 . 8 1 1 A 41 41 LEU H H 41 9.557 9.791 -0.234 1
1 438 . 8 1 1 A 41 41 LEU HA H 41 5.292 5.467 -0.175 1
1 448 . 8 1 1 A 41 41 LEU C C 41 174.632 175.252 -0.620 1
1 449 . 8 1 1 A 41 41 LEU CA C 41 53.571 53.606 -0.035 1
1 450 . 8 1 1 A 41 41 LEU CB C 41 45.337 45.149 0.188 1
1 454 . 8 1 1 A 41 41 LEU N N 41 132.121 129.248 2.873 1
1 455 . 8 1 1 A 42 42 ARG H H 42 9.396 9.116 0.280 1
1 456 . 8 1 1 A 42 42 ARG HA H 42 5.366 5.128 0.238 1
1 464 . 8 1 1 A 42 42 ARG C C 42 173.997 175.004 -1.007 1
1 465 . 8 1 1 A 42 42 ARG CA C 42 54.631 54.083 0.548 1
1 466 . 8 1 1 A 42 42 ARG CB C 42 35.550 34.128 1.422 1
1 469 . 8 1 1 A 42 42 ARG N N 42 128.120 124.961 3.159 1
1 471 . 8 1 1 A 43 43 LYS H H 43 8.597 8.574 0.023 1
1 472 . 8 1 1 A 43 43 LYS HA H 43 4.558 4.908 -0.350 1
1 481 . 8 1 1 A 43 43 LYS C C 43 174.648 174.892 -0.244 1
1 482 . 8 1 1 A 43 43 LYS CA C 43 53.378 54.770 -1.392 1
1 483 . 8 1 1 A 43 43 LYS CB C 43 37.303 35.997 1.306 1
1 487 . 8 1 1 A 43 43 LYS N N 43 114.484 118.107 -3.623 1
1 488 . 8 1 1 A 44 44 ASP H H 44 8.388 8.691 -0.303 1
1 489 . 8 1 1 A 44 44 ASP HA H 44 4.349 4.061 0.288 1
1 492 . 8 1 1 A 44 44 ASP C C 44 173.376 174.441 -1.065 1
1 493 . 8 1 1 A 44 44 ASP CA C 44 54.842 54.713 0.129 1
1 494 . 8 1 1 A 44 44 ASP CB C 44 39.991 39.428 0.563 1
1 495 . 8 1 1 A 44 44 ASP N N 44 115.453 117.885 -2.432 1
1 496 . 8 1 1 A 45 45 PRO HA H 45 4.652 4.401 0.251 1
1 503 . 8 1 1 A 45 45 PRO C C 45 176.914 175.319 1.595 1
1 504 . 8 1 1 A 45 45 PRO CA C 45 63.490 62.417 1.073 1
1 505 . 8 1 1 A 45 45 PRO CB C 45 34.892 32.390 2.502 1
1 508 . 8 1 1 A 46 46 ALA H H 46 8.112 7.952 0.160 1
1 509 . 8 1 1 A 46 46 ALA HA H 46 5.455 4.481 0.974 1
1 513 . 8 1 1 A 46 46 ALA C C 46 177.234 176.161 1.073 1
1 514 . 8 1 1 A 46 46 ALA CA C 46 51.560 50.762 0.798 1
1 515 . 8 1 1 A 46 46 ALA CB C 46 20.122 19.546 0.576 1
1 516 . 8 1 1 A 46 46 ALA N N 46 120.155 123.072 -2.917 1
1 517 . 8 1 1 A 47 47 PHE H H 47 8.717 8.872 -0.155 1
1 518 . 8 1 1 A 47 47 PHE HA H 47 4.795 5.074 -0.279 1
1 526 . 8 1 1 A 47 47 PHE C C 47 172.588 174.274 -1.686 1
1 527 . 8 1 1 A 47 47 PHE CA C 47 57.348 56.124 1.224 1
1 528 . 8 1 1 A 47 47 PHE CB C 47 47.123 43.915 3.208 1
1 534 . 8 1 1 A 47 47 PHE N N 47 129.946 120.683 9.263 1
1 535 . 8 1 1 A 48 48 LEU H H 48 7.883 8.080 -0.197 1
1 536 . 8 1 1 A 48 48 LEU HA H 48 5.198 5.170 0.028 1
1 546 . 8 1 1 A 48 48 LEU C C 48 173.569 174.395 -0.826 1
1 547 . 8 1 1 A 48 48 LEU CA C 48 53.290 53.649 -0.359 1
1 548 . 8 1 1 A 48 48 LEU CB C 48 45.502 45.251 0.251 1
1 552 . 8 1 1 A 48 48 LEU N N 48 121.108 122.658 -1.550 1
1 553 . 8 1 1 A 49 49 HIS H H 49 8.606 8.940 -0.334 1
1 554 . 8 1 1 A 49 49 HIS HA H 49 5.035 5.003 0.032 1
1 559 . 8 1 1 A 49 49 HIS C C 49 173.993 173.738 0.255 1
1 560 . 8 1 1 A 49 49 HIS CA C 49 56.483 54.123 2.360 1
1 561 . 8 1 1 A 49 49 HIS CB C 49 35.919 33.442 2.477 1
1 564 . 8 1 1 A 49 49 HIS N N 49 121.199 125.860 -4.661 1
1 565 . 8 1 1 A 50 50 TYR H H 50 7.777 8.307 -0.530 1
1 566 . 8 1 1 A 50 50 TYR HA H 50 5.695 5.530 0.165 1
1 573 . 8 1 1 A 50 50 TYR C C 50 174.284 172.131 2.153 1
1 574 . 8 1 1 A 50 50 TYR CA C 50 53.430 55.372 -1.942 1
1 575 . 8 1 1 A 50 50 TYR CB C 50 38.552 41.393 -2.841 1
1 580 . 8 1 1 A 50 50 TYR N N 50 114.156 117.403 -3.247 1
1 581 . 8 1 1 A 51 51 TYR H H 51 9.323 9.365 -0.042 1
1 582 . 8 1 1 A 51 51 TYR HA H 51 4.600 4.973 -0.373 1
1 589 . 8 1 1 A 51 51 TYR C C 51 175.352 174.354 0.998 1
1 590 . 8 1 1 A 51 51 TYR CA C 51 57.330 55.952 1.378 1
1 591 . 8 1 1 A 51 51 TYR CB C 51 41.683 41.645 0.038 1
1 596 . 8 1 1 A 51 51 TYR N N 51 119.100 120.095 -0.995 1
1 597 . 8 1 1 A 52 52 ASP H H 52 9.375 8.645 0.730 1
1 598 . 8 1 1 A 52 52 ASP HA H 52 5.064 4.865 0.199 1
1 601 . 8 1 1 A 52 52 ASP C C 52 175.484 175.644 -0.160 1
1 602 . 8 1 1 A 52 52 ASP CA C 52 51.313 51.298 0.015 1
1 603 . 8 1 1 A 52 52 ASP CB C 52 41.883 42.059 -0.176 1
1 604 . 8 1 1 A 52 52 ASP N N 52 124.636 124.110 0.526 1
1 605 . 8 1 1 A 53 53 PRO HA H 53 4.678 4.639 0.039 1
1 612 . 8 1 1 A 53 53 PRO C C 53 176.781 177.437 -0.656 1
1 613 . 8 1 1 A 53 53 PRO CA C 53 64.054 63.930 0.124 1
1 614 . 8 1 1 A 53 53 PRO CB C 53 32.589 32.084 0.505 1
1 617 . 8 1 1 A 54 54 SER H H 54 8.685 8.966 -0.281 1
1 618 . 8 1 1 A 54 54 SER HA H 54 4.483 4.636 -0.153 1
1 621 . 8 1 1 A 54 54 SER C C 54 174.006 174.173 -0.167 1
1 622 . 8 1 1 A 54 54 SER CA C 54 59.378 58.931 0.447 1
1 623 . 8 1 1 A 54 54 SER CB C 54 64.132 64.187 -0.055 1
1 624 . 8 1 1 A 54 54 SER N N 54 113.769 113.047 0.722 1
1 625 . 8 1 1 A 55 55 LYS H H 55 7.706 7.340 0.366 1
1 626 . 8 1 1 A 55 55 LYS HA H 55 4.580 4.874 -0.294 1
1 635 . 8 1 1 A 55 55 LYS C C 55 175.969 175.240 0.729 1
1 636 . 8 1 1 A 55 55 LYS CA C 55 55.160 55.154 0.006 1
1 637 . 8 1 1 A 55 55 LYS CB C 55 34.069 34.709 -0.640 1
1 641 . 8 1 1 A 55 55 LYS N N 55 122.222 122.185 0.037 1
1 642 . 8 1 1 A 56 56 GLU H H 56 8.666 8.685 -0.019 1
1 643 . 8 1 1 A 56 56 GLU HA H 56 4.174 4.644 -0.470 1
1 648 . 8 1 1 A 56 56 GLU C C 56 177.084 174.982 2.102 1
1 649 . 8 1 1 A 56 56 GLU CA C 56 57.099 55.716 1.383 1
1 650 . 8 1 1 A 56 56 GLU CB C 56 29.694 28.750 0.944 1
1 652 . 8 1 1 A 56 56 GLU N N 56 122.015 125.385 -3.370 1
1 653 . 8 1 1 A 57 57 GLU H H 57 8.303 8.348 -0.045 1
1 654 . 8 1 1 A 57 57 GLU HA H 57 4.214 4.991 -0.777 1
1 659 . 8 1 1 A 57 57 GLU CA C 57 56.960 54.794 2.166 1
1 660 . 8 1 1 A 57 57 GLU CB C 57 30.264 33.527 -3.263 1
1 662 . 8 1 1 A 57 57 GLU N N 57 119.884 123.365 -3.481 1
1 663 . 8 1 1 A 58 58 ASN HA H 58 4.768 4.861 -0.093 1
1 668 . 8 1 1 A 58 58 ASN C C 58 174.902 173.780 1.122 1
1 669 . 8 1 1 A 58 58 ASN CA C 58 52.740 52.875 -0.135 1
1 670 . 8 1 1 A 58 58 ASN CB C 58 38.116 36.368 1.748 1
1 672 . 8 1 1 A 59 59 ARG H H 59 7.805 8.179 -0.374 1
1 673 . 8 1 1 A 59 59 ARG HA H 59 4.762 4.650 0.112 1
1 680 . 8 1 1 A 59 59 ARG CA C 59 53.151 54.651 -1.500 1
1 681 . 8 1 1 A 59 59 ARG CB C 59 31.519 34.249 -2.730 1
1 684 . 8 1 1 A 59 59 ARG N N 59 121.060 121.761 -0.701 1
1 685 . 8 1 1 A 60 60 PRO HA H 60 3.357 4.179 -0.822 1
1 692 . 8 1 1 A 60 60 PRO C C 60 176.817 176.230 0.587 1
1 693 . 8 1 1 A 60 60 PRO CA C 60 63.031 61.963 1.068 1
1 694 . 8 1 1 A 60 60 PRO CB C 60 31.273 32.899 -1.626 1
1 697 . 8 1 1 A 61 61 VAL H H 61 8.627 8.779 -0.152 1
1 698 . 8 1 1 A 61 61 VAL HA H 61 3.966 4.054 -0.088 1
1 706 . 8 1 1 A 61 61 VAL C C 61 176.503 175.862 0.641 1
1 707 . 8 1 1 A 61 61 VAL CA C 61 63.154 63.137 0.017 1
1 708 . 8 1 1 A 61 61 VAL CB C 61 32.048 32.650 -0.602 1
1 711 . 8 1 1 A 61 61 VAL N N 61 119.185 118.851 0.334 1
1 712 . 8 1 1 A 62 62 GLY H H 62 6.715 6.721 -0.006 1
1 713 . 8 1 1 A 62 62 GLY HA2 H 62 3.940 3.935 0.005 1
1 714 . 8 1 1 A 62 62 GLY HA3 H 62 3.538 3.938 -0.400 1
1 715 . 8 1 1 A 62 62 GLY C C 62 169.983 171.984 -2.001 1
1 716 . 8 1 1 A 62 62 GLY CA C 62 44.465 45.587 -1.122 1
1 717 . 8 1 1 A 62 62 GLY N N 62 105.813 106.124 -0.311 1
1 718 . 8 1 1 A 63 63 GLY H H 63 8.004 8.522 -0.518 1
1 719 . 8 1 1 A 63 63 GLY HA2 H 63 4.095 3.275 0.820 1
1 720 . 8 1 1 A 63 63 GLY HA3 H 63 3.813 3.625 0.188 1
1 721 . 8 1 1 A 63 63 GLY C C 63 171.870 172.432 -0.562 1
1 722 . 8 1 1 A 63 63 GLY CA C 63 47.148 44.235 2.913 1
1 723 . 8 1 1 A 63 63 GLY N N 63 105.089 107.960 -2.871 1
1 724 . 8 1 1 A 64 64 PHE H H 64 7.967 7.206 0.761 1
1 725 . 8 1 1 A 64 64 PHE HA H 64 4.934 5.591 -0.657 1
1 733 . 8 1 1 A 64 64 PHE C C 64 173.140 174.392 -1.252 1
1 734 . 8 1 1 A 64 64 PHE CA C 64 55.248 55.257 -0.009 1
1 735 . 8 1 1 A 64 64 PHE CB C 64 40.238 42.477 -2.239 1
1 741 . 8 1 1 A 64 64 PHE N N 64 113.387 121.529 -8.142 1
1 742 . 8 1 1 A 65 65 SER H H 65 8.518 9.074 -0.556 1
1 743 . 8 1 1 A 65 65 SER HA H 65 3.264 5.085 -1.821 1
1 746 . 8 1 1 A 65 65 SER C C 65 176.417 174.718 1.699 1
1 747 . 8 1 1 A 65 65 SER CA C 65 56.819 58.230 -1.411 1
1 748 . 8 1 1 A 65 65 SER CB C 65 63.391 64.829 -1.438 1
1 749 . 8 1 1 A 65 65 SER N N 65 114.674 115.635 -0.961 1
1 750 . 8 1 1 A 66 66 LEU H H 66 7.404 8.624 -1.220 1
1 751 . 8 1 1 A 66 66 LEU HA H 66 4.470 4.414 0.056 1
1 761 . 8 1 1 A 66 66 LEU C C 66 177.993 178.706 -0.713 1
1 762 . 8 1 1 A 66 66 LEU CA C 66 54.242 57.045 -2.803 1
1 763 . 8 1 1 A 66 66 LEU CB C 66 42.787 42.167 0.620 1
1 767 . 8 1 1 A 66 66 LEU N N 66 123.988 122.739 1.249 1
1 768 . 8 1 1 A 67 67 ARG H H 67 7.865 8.087 -0.222 1
1 769 . 8 1 1 A 67 67 ARG HA H 67 4.175 3.988 0.187 1
1 776 . 8 1 1 A 67 67 ARG C C 67 178.562 178.047 0.515 1
1 777 . 8 1 1 A 67 67 ARG CA C 67 58.143 59.295 -1.152 1
1 778 . 8 1 1 A 67 67 ARG CB C 67 29.052 29.922 -0.870 1
1 781 . 8 1 1 A 67 67 ARG N N 67 122.494 117.339 5.155 1
1 782 . 8 1 1 A 68 68 GLY H H 68 9.398 8.179 1.219 1
1 783 . 8 1 1 A 68 68 GLY HA2 H 68 4.066 3.974 0.092 1
1 784 . 8 1 1 A 68 68 GLY HA3 H 68 3.908 3.987 -0.079 1
1 785 . 8 1 1 A 68 68 GLY C C 68 173.982 173.461 0.521 1
1 786 . 8 1 1 A 68 68 GLY CA C 68 46.230 46.563 -0.333 1
1 787 . 8 1 1 A 68 68 GLY N N 68 117.548 107.964 9.584 1
1 788 . 8 1 1 A 69 69 SER H H 69 7.829 7.666 0.163 1
1 789 . 8 1 1 A 69 69 SER HA H 69 4.807 5.385 -0.578 1
1 792 . 8 1 1 A 69 69 SER C C 69 172.854 172.850 0.004 1
1 793 . 8 1 1 A 69 69 SER CA C 69 59.290 57.354 1.936 1
1 794 . 8 1 1 A 69 69 SER CB C 69 65.366 68.020 -2.654 1
1 795 . 8 1 1 A 69 69 SER N N 69 115.188 114.920 0.268 1
1 796 . 8 1 1 A 70 70 LEU H H 70 8.805 8.545 0.260 1
1 797 . 8 1 1 A 70 70 LEU HA H 70 4.846 4.881 -0.035 1
1 807 . 8 1 1 A 70 70 LEU C C 70 175.775 174.260 1.515 1
1 808 . 8 1 1 A 70 70 LEU CA C 70 53.907 54.206 -0.299 1
1 809 . 8 1 1 A 70 70 LEU CB C 70 45.337 46.285 -0.948 1
1 813 . 8 1 1 A 70 70 LEU N N 70 121.265 122.910 -1.645 1
1 814 . 8 1 1 A 71 71 VAL H H 71 8.644 8.749 -0.105 1
1 815 . 8 1 1 A 71 71 VAL HA H 71 5.555 5.211 0.344 1
1 823 . 8 1 1 A 71 71 VAL C C 71 173.636 173.380 0.256 1
1 824 . 8 1 1 A 71 71 VAL CA C 71 58.760 59.969 -1.209 1
1 825 . 8 1 1 A 71 71 VAL CB C 71 34.891 35.739 -0.848 1
1 828 . 8 1 1 A 71 71 VAL N N 71 122.315 122.856 -0.541 1
1 829 . 8 1 1 A 72 72 SER H H 72 8.750 8.840 -0.090 1
1 830 . 8 1 1 A 72 72 SER HA H 72 4.742 4.994 -0.252 1
1 833 . 8 1 1 A 72 72 SER C C 72 173.058 172.468 0.590 1
1 834 . 8 1 1 A 72 72 SER CA C 72 57.190 57.867 -0.677 1
1 835 . 8 1 1 A 72 72 SER CB C 72 65.612 67.526 -1.914 1
1 836 . 8 1 1 A 72 72 SER N N 72 118.611 122.015 -3.404 1
1 837 . 8 1 1 A 73 73 ALA H H 73 9.009 8.682 0.327 1
1 838 . 8 1 1 A 73 73 ALA HA H 73 4.406 5.045 -0.639 1
1 842 . 8 1 1 A 73 73 ALA C C 73 176.708 176.972 -0.264 1
1 843 . 8 1 1 A 73 73 ALA CA C 73 52.672 50.431 2.241 1
1 844 . 8 1 1 A 73 73 ALA CB C 73 18.812 20.831 -2.019 1
1 845 . 8 1 1 A 73 73 ALA N N 73 125.694 125.671 0.023 1
1 846 . 8 1 1 A 74 74 LEU H H 74 7.800 8.589 -0.789 1
1 847 . 8 1 1 A 74 74 LEU HA H 74 4.716 4.484 0.232 1
1 857 . 8 1 1 A 74 74 LEU C C 74 176.551 177.720 -1.169 1
1 858 . 8 1 1 A 74 74 LEU CA C 74 53.784 54.337 -0.553 1
1 859 . 8 1 1 A 74 74 LEU CB C 74 43.446 41.349 2.097 1
1 863 . 8 1 1 A 74 74 LEU N N 74 122.271 121.727 0.544 1
1 864 . 8 1 1 A 75 75 GLU H H 75 8.855 8.673 0.182 1
1 865 . 8 1 1 A 75 75 GLU HA H 75 4.336 4.332 0.004 1
1 870 . 8 1 1 A 75 75 GLU C C 75 176.465 175.254 1.211 1
1 871 . 8 1 1 A 75 75 GLU CA C 75 56.507 56.484 0.023 1
1 872 . 8 1 1 A 75 75 GLU CB C 75 30.245 28.859 1.386 1
1 874 . 8 1 1 A 75 75 GLU N N 75 122.678 121.825 0.853 1
1 875 . 8 1 1 A 76 76 ASP H H 76 8.542 7.338 1.204 1
1 876 . 8 1 1 A 76 76 ASP HA H 76 4.665 5.143 -0.478 1
1 879 . 8 1 1 A 76 76 ASP C C 76 176.087 175.391 0.696 1
1 880 . 8 1 1 A 76 76 ASP CA C 76 55.107 53.372 1.735 1
1 881 . 8 1 1 A 76 76 ASP CB C 76 41.431 44.731 -3.300 1
1 882 . 8 1 1 A 76 76 ASP N N 76 121.488 119.891 1.597 1
1 883 . 8 1 1 A 77 77 ASN H H 77 8.322 8.649 -0.327 1
1 884 . 8 1 1 A 77 77 ASN HA H 77 4.729 4.810 -0.081 1
1 889 . 8 1 1 A 77 77 ASN C C 77 175.566 177.654 -2.088 1
1 890 . 8 1 1 A 77 77 ASN CA C 77 53.131 55.135 -2.004 1
1 891 . 8 1 1 A 77 77 ASN CB C 77 38.617 39.425 -0.808 1
1 892 . 8 1 1 A 77 77 ASN N N 77 118.676 121.164 -2.488 1
1 894 . 8 1 1 A 78 78 GLY H H 78 8.311 8.088 0.223 1
1 895 . 8 1 1 A 78 78 GLY HA2 H 78 3.897 3.716 0.181 1
1 896 . 8 1 1 A 78 78 GLY HA3 H 78 3.897 3.719 0.178 1
1 897 . 8 1 1 A 78 78 GLY C C 78 173.376 174.215 -0.839 1
1 898 . 8 1 1 A 78 78 GLY CA C 78 45.224 46.486 -1.262 1
1 899 . 8 1 1 A 78 78 GLY N N 78 108.939 108.708 0.231 1
1 900 . 8 1 1 A 79 79 VAL H H 79 7.882 8.189 -0.307 1
1 901 . 8 1 1 A 79 79 VAL HA H 79 4.345 4.530 -0.185 1
1 909 . 8 1 1 A 79 79 VAL CA C 79 59.995 58.871 1.124 1
1 910 . 8 1 1 A 79 79 VAL CB C 79 32.589 32.846 -0.257 1
1 913 . 8 1 1 A 79 79 VAL N N 79 121.135 119.352 1.783 1
1 914 . 8 1 1 A 80 80 PRO HA H 80 4.461 4.752 -0.291 1
1 921 . 8 1 1 A 80 80 PRO C C 80 176.979 176.982 -0.003 1
1 922 . 8 1 1 A 80 80 PRO CA C 80 63.101 62.356 0.745 1
1 923 . 8 1 1 A 80 80 PRO CB C 80 32.177 29.559 2.618 1
1 926 . 8 1 1 A 81 81 THR H H 81 8.281 8.559 -0.278 1
1 927 . 8 1 1 A 81 81 THR HA H 81 4.095 4.026 0.069 1
1 932 . 8 1 1 A 81 81 THR C C 81 175.270 175.086 0.184 1
1 933 . 8 1 1 A 81 81 THR CA C 81 62.872 64.467 -1.595 1
1 934 . 8 1 1 A 81 81 THR CB C 81 69.642 67.600 2.042 1
1 936 . 8 1 1 A 81 81 THR N N 81 114.684 111.536 3.148 1
1 937 . 8 1 1 A 82 82 GLY H H 82 8.338 8.794 -0.456 1
1 938 . 8 1 1 A 82 82 GLY HA2 H 82 4.095 3.791 0.304 1
1 939 . 8 1 1 A 82 82 GLY HA3 H 82 3.668 3.817 -0.149 1
1 940 . 8 1 1 A 82 82 GLY C C 82 174.139 174.232 -0.093 1
1 941 . 8 1 1 A 82 82 GLY CA C 82 45.083 47.007 -1.924 1
1 942 . 8 1 1 A 82 82 GLY N N 82 111.289 115.487 -4.198 1
1 943 . 8 1 1 A 83 83 VAL H H 83 7.668 8.625 -0.957 1
1 944 . 8 1 1 A 83 83 VAL HA H 83 3.985 4.249 -0.264 1
1 952 . 8 1 1 A 83 83 VAL C C 83 176.054 176.493 -0.439 1
1 953 . 8 1 1 A 83 83 VAL CA C 83 62.431 63.165 -0.734 1
1 954 . 8 1 1 A 83 83 VAL CB C 83 32.260 34.331 -2.071 1
1 957 . 8 1 1 A 83 83 VAL N N 83 120.003 122.635 -2.632 1
1 958 . 8 1 1 A 84 84 LYS H H 84 8.645 7.621 1.024 1
1 959 . 8 1 1 A 84 84 LYS HA H 84 4.276 3.962 0.314 1
1 968 . 8 1 1 A 84 84 LYS C C 84 176.832 176.611 0.221 1
1 969 . 8 1 1 A 84 84 LYS CA C 84 56.272 58.951 -2.679 1
1 970 . 8 1 1 A 84 84 LYS CB C 84 32.876 30.545 2.331 1
1 974 . 8 1 1 A 84 84 LYS N N 84 126.447 118.803 7.644 1
1 975 . 8 1 1 A 85 85 GLY H H 85 8.410 9.211 -0.801 1
1 976 . 8 1 1 A 85 85 GLY HA2 H 85 4.066 3.932 0.134 1
1 977 . 8 1 1 A 85 85 GLY HA3 H 85 3.781 3.975 -0.194 1
1 978 . 8 1 1 A 85 85 GLY C C 85 173.969 174.316 -0.347 1
1 979 . 8 1 1 A 85 85 GLY CA C 85 45.146 46.932 -1.786 1
1 980 . 8 1 1 A 85 85 GLY N N 85 109.957 106.644 3.313 1
1 981 . 8 1 1 A 86 86 ASN H H 86 8.298 8.588 -0.290 1
1 982 . 8 1 1 A 86 86 ASN HA H 86 4.665 4.650 0.015 1
1 987 . 8 1 1 A 86 86 ASN C C 86 174.987 175.387 -0.400 1
1 988 . 8 1 1 A 86 86 ASN CA C 86 52.989 53.668 -0.679 1
1 989 . 8 1 1 A 86 86 ASN CB C 86 38.376 38.545 -0.169 1
1 990 . 8 1 1 A 86 86 ASN N N 86 118.457 122.037 -3.580 1
1 992 . 8 1 1 A 87 87 VAL H H 87 7.660 8.365 -0.705 1
1 993 . 8 1 1 A 87 87 VAL HA H 87 3.946 4.304 -0.358 1
1 1001 . 8 1 1 A 87 87 VAL C C 87 174.902 175.683 -0.781 1
1 1002 . 8 1 1 A 87 87 VAL CA C 87 62.307 60.409 1.898 1
1 1003 . 8 1 1 A 87 87 VAL CB C 87 32.548 33.921 -1.373 1
1 1006 . 8 1 1 A 87 87 VAL N N 87 120.557 120.446 0.111 1
1 1007 . 8 1 1 A 88 88 GLN H H 88 8.115 8.279 -0.164 1
1 1008 . 8 1 1 A 88 88 GLN HA H 88 4.302 4.284 0.018 1
1 1015 . 8 1 1 A 88 88 GLN C C 88 175.637 176.415 -0.778 1
1 1016 . 8 1 1 A 88 88 GLN CA C 88 55.336 55.977 -0.641 1
1 1017 . 8 1 1 A 88 88 GLN CB C 88 30.574 29.707 0.867 1
1 1019 . 8 1 1 A 88 88 GLN N N 88 122.280 120.756 1.524 1
1 1021 . 8 1 1 A 89 89 GLY H H 89 8.544 8.347 0.197 1
1 1022 . 8 1 1 A 89 89 GLY HA2 H 89 3.885 4.033 -0.148 1
1 1023 . 8 1 1 A 89 89 GLY HA3 H 89 3.885 4.035 -0.150 1
1 1024 . 8 1 1 A 89 89 GLY C C 89 172.861 173.656 -0.795 1
1 1025 . 8 1 1 A 89 89 GLY CA C 89 44.889 45.710 -0.821 1
1 1026 . 8 1 1 A 89 89 GLY N N 89 110.135 110.096 0.039 1
1 1027 . 8 1 1 A 90 90 ASN H H 90 8.451 7.873 0.578 1
1 1028 . 8 1 1 A 90 90 ASN HA H 90 4.222 4.953 -0.731 1
1 1033 . 8 1 1 A 90 90 ASN C C 90 174.926 173.569 1.357 1
1 1034 . 8 1 1 A 90 90 ASN CA C 90 54.613 52.270 2.343 1
1 1035 . 8 1 1 A 90 90 ASN CB C 90 37.852 38.835 -0.983 1
1 1036 . 8 1 1 A 90 90 ASN N N 90 114.322 119.562 -5.240 1
1 1038 . 8 1 1 A 91 91 LEU H H 91 8.933 7.802 1.131 1
1 1039 . 8 1 1 A 91 91 LEU HA H 91 5.367 5.132 0.235 1
1 1049 . 8 1 1 A 91 91 LEU C C 91 178.732 175.507 3.225 1
1 1050 . 8 1 1 A 91 91 LEU CA C 91 55.160 53.063 2.097 1
1 1051 . 8 1 1 A 91 91 LEU CB C 91 45.461 45.395 0.066 1
1 1055 . 8 1 1 A 91 91 LEU N N 91 120.057 121.462 -1.405 1
1 1056 . 8 1 1 A 92 92 PHE H H 92 9.901 8.396 1.505 1
1 1057 . 8 1 1 A 92 92 PHE HA H 92 5.105 5.129 -0.024 1
1 1065 . 8 1 1 A 92 92 PHE C C 92 170.140 172.667 -2.527 1
1 1066 . 8 1 1 A 92 92 PHE CA C 92 56.236 56.069 0.167 1
1 1067 . 8 1 1 A 92 92 PHE CB C 92 42.664 41.208 1.456 1
1 1073 . 8 1 1 A 92 92 PHE N N 92 119.740 116.924 2.816 1
1 1074 . 8 1 1 A 93 93 LYS H H 93 9.154 9.066 0.088 1
1 1075 . 8 1 1 A 93 93 LYS HA H 93 5.584 5.095 0.489 1
1 1083 . 8 1 1 A 93 93 LYS C C 93 174.830 174.950 -0.120 1
1 1084 . 8 1 1 A 93 93 LYS CA C 93 53.148 54.223 -1.075 1
1 1085 . 8 1 1 A 93 93 LYS CB C 93 36.660 36.294 0.366 1
1 1089 . 8 1 1 A 93 93 LYS N N 93 117.710 118.233 -0.523 1
1 1090 . 8 1 1 A 94 94 VAL H H 94 8.507 8.806 -0.299 1
1 1091 . 8 1 1 A 94 94 VAL HA H 94 4.872 5.051 -0.179 1
1 1099 . 8 1 1 A 94 94 VAL C C 94 174.408 175.011 -0.603 1
1 1100 . 8 1 1 A 94 94 VAL CA C 94 60.525 61.541 -1.016 1
1 1101 . 8 1 1 A 94 94 VAL CB C 94 34.862 33.702 1.160 1
1 1104 . 8 1 1 A 94 94 VAL N N 94 121.741 121.392 0.349 1
1 1105 . 8 1 1 A 95 95 ILE H H 95 8.959 8.807 0.152 1
1 1106 . 8 1 1 A 95 95 ILE HA H 95 4.794 5.061 -0.267 1
1 1116 . 8 1 1 A 95 95 ILE C C 95 177.642 176.302 1.340 1
1 1117 . 8 1 1 A 95 95 ILE CA C 95 59.713 60.710 -0.997 1
1 1118 . 8 1 1 A 95 95 ILE CB C 95 40.032 37.816 2.216 1
1 1122 . 8 1 1 A 95 95 ILE N N 95 126.794 128.411 -1.617 1
1 1123 . 8 1 1 A 96 96 THR H H 96 8.765 8.790 -0.025 1
1 1124 . 8 1 1 A 96 96 THR HA H 96 4.584 4.859 -0.275 1
1 1129 . 8 1 1 A 96 96 THR C C 96 177.023 175.595 1.428 1
1 1130 . 8 1 1 A 96 96 THR CA C 96 61.372 60.626 0.746 1
1 1131 . 8 1 1 A 96 96 THR CB C 96 70.794 71.711 -0.917 1
1 1133 . 8 1 1 A 96 96 THR N N 96 117.225 120.475 -3.250 1
1 1134 . 8 1 1 A 97 97 LYS H H 97 8.736 8.842 -0.106 1
1 1135 . 8 1 1 A 97 97 LYS HA H 97 4.101 4.037 0.064 1
1 1144 . 8 1 1 A 97 97 LYS C C 97 176.490 177.416 -0.926 1
1 1145 . 8 1 1 A 97 97 LYS CA C 97 58.583 59.110 -0.527 1
1 1146 . 8 1 1 A 97 97 LYS CB C 97 31.848 32.556 -0.708 1
1 1150 . 8 1 1 A 97 97 LYS N N 97 120.457 122.687 -2.230 1
1 1151 . 8 1 1 A 98 98 ASP H H 98 7.762 7.701 0.061 1
1 1152 . 8 1 1 A 98 98 ASP HA H 98 4.633 4.780 -0.147 1
1 1155 . 8 1 1 A 98 98 ASP C C 98 175.270 175.244 0.026 1
1 1156 . 8 1 1 A 98 98 ASP CA C 98 53.272 54.031 -0.759 1
1 1157 . 8 1 1 A 98 98 ASP CB C 98 39.909 40.846 -0.937 1
1 1158 . 8 1 1 A 98 98 ASP N N 98 116.281 116.904 -0.623 1
1 1159 . 8 1 1 A 99 99 ASP H H 99 8.340 8.319 0.021 1
1 1160 . 8 1 1 A 99 99 ASP HA H 99 4.245 4.368 -0.123 1
1 1163 . 8 1 1 A 99 99 ASP C C 99 175.315 175.080 0.235 1
1 1164 . 8 1 1 A 99 99 ASP CA C 99 55.989 55.069 0.920 1
1 1165 . 8 1 1 A 99 99 ASP CB C 99 39.827 38.509 1.318 1
1 1166 . 8 1 1 A 99 99 ASP N N 99 116.687 116.962 -0.275 1
1 1167 . 8 1 1 A 100 100 THR H H 100 7.511 7.451 0.060 1
1 1168 . 8 1 1 A 100 100 THR HA H 100 4.185 4.229 -0.044 1
1 1173 . 8 1 1 A 100 100 THR C C 100 173.376 173.885 -0.509 1
1 1174 . 8 1 1 A 100 100 THR CA C 100 63.489 62.021 1.468 1
1 1175 . 8 1 1 A 100 100 THR CB C 100 67.909 69.457 -1.548 1
1 1177 . 8 1 1 A 100 100 THR N N 100 116.525 114.952 1.573 1
1 1178 . 8 1 1 A 101 101 HIS H H 101 8.753 8.930 -0.177 1
1 1179 . 8 1 1 A 101 101 HIS HA H 101 4.898 5.071 -0.173 1
1 1184 . 8 1 1 A 101 101 HIS C C 101 174.345 173.866 0.479 1
1 1185 . 8 1 1 A 101 101 HIS CA C 101 55.072 54.489 0.583 1
1 1186 . 8 1 1 A 101 101 HIS CB C 101 32.835 30.049 2.786 1
1 1189 . 8 1 1 A 101 101 HIS N N 101 125.953 126.064 -0.111 1
1 1190 . 8 1 1 A 102 102 TYR H H 102 9.023 9.069 -0.046 1
1 1191 . 8 1 1 A 102 102 TYR HA H 102 4.545 4.900 -0.355 1
1 1198 . 8 1 1 A 102 102 TYR C C 102 174.126 174.997 -0.871 1
1 1199 . 8 1 1 A 102 102 TYR CA C 102 57.260 56.596 0.664 1
1 1200 . 8 1 1 A 102 102 TYR CB C 102 40.381 38.376 2.005 1
1 1205 . 8 1 1 A 102 102 TYR N N 102 121.975 124.243 -2.268 1
1 1206 . 8 1 1 A 103 103 TYR H H 103 8.899 8.910 -0.011 1
1 1207 . 8 1 1 A 103 103 TYR HA H 103 4.729 4.989 -0.260 1
1 1214 . 8 1 1 A 103 103 TYR C C 103 174.139 176.023 -1.884 1
1 1215 . 8 1 1 A 103 103 TYR CA C 103 58.036 58.086 -0.050 1
1 1216 . 8 1 1 A 103 103 TYR CB C 103 40.485 39.128 1.357 1
1 1221 . 8 1 1 A 103 103 TYR N N 103 122.012 124.425 -2.413 1
1 1222 . 8 1 1 A 104 104 ILE H H 104 8.605 8.486 0.119 1
1 1223 . 8 1 1 A 104 104 ILE HA H 104 4.859 4.755 0.104 1
1 1233 . 8 1 1 A 104 104 ILE C C 104 172.769 174.340 -1.571 1
1 1234 . 8 1 1 A 104 104 ILE CA C 104 59.554 59.655 -0.101 1
1 1235 . 8 1 1 A 104 104 ILE CB C 104 40.631 41.690 -1.059 1
1 1239 . 8 1 1 A 104 104 ILE N N 104 123.443 123.531 -0.088 1
1 1240 . 8 1 1 A 105 105 GLN H H 105 9.369 8.681 0.688 1
1 1241 . 8 1 1 A 105 105 GLN HA H 105 4.895 5.145 -0.250 1
1 1248 . 8 1 1 A 105 105 GLN C C 105 175.642 175.830 -0.188 1
1 1249 . 8 1 1 A 105 105 GLN CA C 105 54.965 54.116 0.849 1
1 1250 . 8 1 1 A 105 105 GLN CB C 105 32.856 32.251 0.605 1
1 1252 . 8 1 1 A 105 105 GLN N N 105 125.079 124.479 0.600 1
1 1254 . 8 1 1 A 106 106 ALA H H 106 8.513 8.984 -0.471 1
1 1255 . 8 1 1 A 106 106 ALA HA H 106 4.962 4.657 0.305 1
1 1259 . 8 1 1 A 106 106 ALA C C 106 175.854 178.032 -2.178 1
1 1260 . 8 1 1 A 106 106 ALA CA C 106 50.272 52.118 -1.846 1
1 1261 . 8 1 1 A 106 106 ALA CB C 106 21.197 20.841 0.356 1
1 1262 . 8 1 1 A 106 106 ALA N N 106 129.303 129.377 -0.074 1
1 1263 . 8 1 1 A 107 107 SER H H 107 9.468 9.121 0.347 1
1 1264 . 8 1 1 A 107 107 SER HA H 107 4.447 4.517 -0.070 1
1 1267 . 8 1 1 A 107 107 SER C C 107 173.785 173.649 0.136 1
1 1268 . 8 1 1 A 107 107 SER CA C 107 60.048 61.215 -1.167 1
1 1269 . 8 1 1 A 107 107 SER CB C 107 64.643 63.475 1.168 1
1 1270 . 8 1 1 A 107 107 SER N N 107 112.962 114.391 -1.429 1
1 1271 . 8 1 1 A 108 108 SER H H 108 7.555 7.998 -0.443 1
1 1272 . 8 1 1 A 108 108 SER HA H 108 4.665 4.931 -0.266 1
1 1275 . 8 1 1 A 108 108 SER C C 108 174.381 174.285 0.096 1
1 1276 . 8 1 1 A 108 108 SER CA C 108 56.907 56.145 0.762 1
1 1277 . 8 1 1 A 108 108 SER CB C 108 66.370 66.415 -0.045 1
1 1278 . 8 1 1 A 108 108 SER N N 108 112.243 114.373 -2.130 1
1 1279 . 8 1 1 A 109 109 LYS H H 109 8.978 8.830 0.148 1
1 1280 . 8 1 1 A 109 109 LYS HA H 109 4.777 3.964 0.813 1
1 1287 . 8 1 1 A 109 109 LYS C C 109 179.992 178.081 1.911 1
1 1288 . 8 1 1 A 109 109 LYS CA C 109 59.766 60.196 -0.430 1
1 1289 . 8 1 1 A 109 109 LYS CB C 109 32.342 32.446 -0.104 1
1 1293 . 8 1 1 A 109 109 LYS N N 109 123.170 125.415 -2.245 1
1 1294 . 8 1 1 A 110 110 ALA H H 110 8.608 8.079 0.529 1
1 1295 . 8 1 1 A 110 110 ALA HA H 110 4.178 4.097 0.081 1
1 1299 . 8 1 1 A 110 110 ALA C C 110 179.895 179.222 0.673 1
1 1300 . 8 1 1 A 110 110 ALA CA C 110 54.871 55.306 -0.435 1
1 1301 . 8 1 1 A 110 110 ALA CB C 110 18.065 18.228 -0.163 1
1 1302 . 8 1 1 A 110 110 ALA N N 110 123.750 120.823 2.927 1
1 1303 . 8 1 1 A 111 111 GLU H H 111 8.185 8.371 -0.186 1
1 1304 . 8 1 1 A 111 111 GLU HA H 111 4.180 4.024 0.156 1
1 1309 . 8 1 1 A 111 111 GLU C C 111 178.587 179.006 -0.419 1
1 1310 . 8 1 1 A 111 111 GLU CA C 111 59.466 59.913 -0.447 1
1 1311 . 8 1 1 A 111 111 GLU CB C 111 31.067 29.584 1.483 1
1 1313 . 8 1 1 A 111 111 GLU N N 111 119.757 118.672 1.085 1
1 1314 . 8 1 1 A 112 112 ARG H H 112 8.008 7.791 0.217 1
1 1315 . 8 1 1 A 112 112 ARG HA H 112 3.642 4.033 -0.391 1
1 1322 . 8 1 1 A 112 112 ARG C C 112 176.481 178.506 -2.025 1
1 1323 . 8 1 1 A 112 112 ARG CA C 112 60.419 59.478 0.941 1
1 1324 . 8 1 1 A 112 112 ARG CB C 112 29.957 30.089 -0.132 1
1 1327 . 8 1 1 A 112 112 ARG N N 112 118.430 119.594 -1.164 1
1 1328 . 8 1 1 A 113 113 ALA H H 113 7.985 7.524 0.461 1
1 1329 . 8 1 1 A 113 113 ALA HA H 113 3.925 4.061 -0.136 1
1 1333 . 8 1 1 A 113 113 ALA C C 113 180.117 180.286 -0.169 1
1 1334 . 8 1 1 A 113 113 ALA CA C 113 55.372 54.953 0.419 1
1 1335 . 8 1 1 A 113 113 ALA CB C 113 17.825 18.323 -0.498 1
1 1336 . 8 1 1 A 113 113 ALA N N 113 119.980 120.495 -0.515 1
1 1337 . 8 1 1 A 114 114 GLU H H 114 8.093 8.779 -0.686 1
1 1338 . 8 1 1 A 114 114 GLU HA H 114 3.936 3.894 0.042 1
1 1343 . 8 1 1 A 114 114 GLU C C 114 180.586 179.180 1.406 1
1 1344 . 8 1 1 A 114 114 GLU CA C 114 59.148 59.453 -0.305 1
1 1345 . 8 1 1 A 114 114 GLU CB C 114 30.080 29.248 0.832 1
1 1347 . 8 1 1 A 114 114 GLU N N 114 117.168 117.495 -0.327 1
1 1348 . 8 1 1 A 115 115 TRP H H 115 7.980 8.697 -0.717 1
1 1349 . 8 1 1 A 115 115 TRP HA H 115 3.775 4.371 -0.596 1
1 1358 . 8 1 1 A 115 115 TRP C C 115 177.714 178.641 -0.927 1
1 1359 . 8 1 1 A 115 115 TRP CA C 115 62.696 59.400 3.296 1
1 1360 . 8 1 1 A 115 115 TRP CB C 115 29.052 29.010 0.042 1
1 1366 . 8 1 1 A 115 115 TRP N N 115 120.974 120.885 0.089 1
1 1368 . 8 1 1 A 116 116 ILE H H 116 8.297 8.358 -0.061 1
1 1369 . 8 1 1 A 116 116 ILE HA H 116 3.270 3.471 -0.201 1
1 1379 . 8 1 1 A 116 116 ILE C C 116 177.568 177.841 -0.273 1
1 1380 . 8 1 1 A 116 116 ILE CA C 116 66.643 64.937 1.706 1
1 1381 . 8 1 1 A 116 116 ILE CB C 116 37.606 37.403 0.203 1
1 1385 . 8 1 1 A 116 116 ILE N N 116 118.408 119.770 -1.362 1
1 1386 . 8 1 1 A 117 117 GLU H H 117 8.026 8.910 -0.884 1
1 1387 . 8 1 1 A 117 117 GLU HA H 117 3.880 4.000 -0.120 1
1 1392 . 8 1 1 A 117 117 GLU C C 117 178.476 178.878 -0.402 1
1 1393 . 8 1 1 A 117 117 GLU CA C 117 59.219 59.763 -0.544 1
1 1394 . 8 1 1 A 117 117 GLU CB C 117 29.381 29.618 -0.237 1
1 1396 . 8 1 1 A 117 117 GLU N N 117 117.096 120.468 -3.372 1
1 1397 . 8 1 1 A 118 118 ALA H H 118 7.555 8.504 -0.949 1
1 1398 . 8 1 1 A 118 118 ALA HA H 118 3.952 4.032 -0.080 1
1 1402 . 8 1 1 A 118 118 ALA C C 118 179.862 180.083 -0.221 1
1 1403 . 8 1 1 A 118 118 ALA CA C 118 54.772 54.991 -0.219 1
1 1404 . 8 1 1 A 118 118 ALA CB C 118 18.277 18.426 -0.149 1
1 1405 . 8 1 1 A 118 118 ALA N N 118 119.817 121.325 -1.508 1
1 1406 . 8 1 1 A 119 119 ILE H H 119 8.167 8.358 -0.191 1
1 1407 . 8 1 1 A 119 119 ILE HA H 119 3.558 3.693 -0.135 1
1 1417 . 8 1 1 A 119 119 ILE C C 119 178.564 178.246 0.318 1
1 1418 . 8 1 1 A 119 119 ILE CA C 119 65.766 65.269 0.497 1
1 1419 . 8 1 1 A 119 119 ILE CB C 119 38.840 37.868 0.972 1
1 1423 . 8 1 1 A 119 119 ILE N N 119 116.280 117.738 -1.458 1
1 1424 . 8 1 1 A 120 120 LYS H H 120 8.790 8.210 0.580 1
1 1425 . 8 1 1 A 120 120 LYS HA H 120 3.965 4.006 -0.041 1
1 1434 . 8 1 1 A 120 120 LYS C C 120 179.673 179.416 0.257 1
1 1435 . 8 1 1 A 120 120 LYS CA C 120 60.031 60.425 -0.394 1
1 1436 . 8 1 1 A 120 120 LYS CB C 120 32.547 32.277 0.270 1
1 1440 . 8 1 1 A 120 120 LYS N N 120 119.650 119.059 0.591 1
1 1441 . 8 1 1 A 121 121 LYS H H 121 7.594 9.009 -1.415 1
1 1442 . 8 1 1 A 121 121 LYS HA H 121 4.095 4.250 -0.155 1
1 1451 . 8 1 1 A 121 121 LYS C C 121 177.962 178.985 -1.023 1
1 1452 . 8 1 1 A 121 121 LYS CA C 121 58.848 59.185 -0.337 1
1 1453 . 8 1 1 A 121 121 LYS CB C 121 32.547 32.195 0.352 1
1 1457 . 8 1 1 A 121 121 LYS N N 121 117.197 119.846 -2.649 1
1 1458 . 8 1 1 A 122 122 LEU H H 122 7.586 7.984 -0.398 1
1 1459 . 8 1 1 A 122 122 LEU HA H 122 4.535 3.939 0.596 1
1 1469 . 8 1 1 A 122 122 LEU C C 122 177.902 177.392 0.510 1
1 1470 . 8 1 1 A 122 122 LEU CA C 122 55.071 57.998 -2.927 1
1 1471 . 8 1 1 A 122 122 LEU CB C 122 42.888 41.972 0.916 1
1 1475 . 8 1 1 A 122 122 LEU N N 122 116.861 119.617 -2.756 1
1 1476 . 8 1 1 A 123 123 THR H H 123 7.636 7.992 -0.356 1
1 1477 . 8 1 1 A 123 123 THR HA H 123 4.445 4.366 0.079 1
1 1482 . 8 1 1 A 123 123 THR C C 123 175.714 175.611 0.103 1
1 1483 . 8 1 1 A 123 123 THR CA C 123 62.643 60.796 1.847 1
1 1484 . 8 1 1 A 123 123 THR CB C 123 70.259 71.107 -0.848 1
1 1486 . 8 1 1 A 123 123 THR N N 123 108.963 112.545 -3.582 1
1 1487 . 8 1 1 A 124 124 SER H H 124 7.912 8.923 -1.011 1
1 1488 . 8 1 1 A 124 124 SER HA H 124 4.626 4.210 0.416 1
1 1491 . 8 1 1 A 124 124 SER C C 124 174.405 175.421 -1.016 1
1 1492 . 8 1 1 A 124 124 SER CA C 124 58.390 61.689 -3.299 1
1 1493 . 8 1 1 A 124 124 SER CB C 124 64.255 63.281 0.974 1
1 1494 . 8 1 1 A 124 124 SER N N 124 116.876 116.439 0.437 1
1 1495 . 8 1 1 A 125 125 GLY H H 125 8.307 7.838 0.469 1
1 1496 . 8 1 1 A 125 125 GLY HA2 H 125 4.166 4.069 0.097 1
1 1497 . 8 1 1 A 125 125 GLY HA3 H 125 4.166 4.073 0.093 1
1 1498 . 8 1 1 A 125 125 GLY C C 125 171.921 173.656 -1.735 1
1 1499 . 8 1 1 A 125 125 GLY CA C 125 44.748 44.903 -0.155 1
1 1500 . 8 1 1 A 125 125 GLY N N 125 110.006 107.636 2.370 1
1 1501 . 8 1 1 A 126 126 PRO HA H 126 4.510 4.472 0.038 1
1 1508 . 8 1 1 A 126 126 PRO C C 126 177.471 176.044 1.427 1
1 1509 . 8 1 1 A 126 126 PRO CA C 126 63.419 64.585 -1.166 1
1 1510 . 8 1 1 A 126 126 PRO CB C 126 32.106 32.231 -0.125 1
1 1513 . 8 1 1 A 127 127 SER H H 127 8.607 7.834 0.773 1
1 1514 . 8 1 1 A 127 127 SER C C 127 174.628 173.128 1.500 1
1 1515 . 8 1 1 A 127 127 SER CA C 127 58.513 57.363 1.150 1
1 1516 . 8 1 1 A 127 127 SER CB C 127 63.679 65.469 -1.790 1
1 1517 . 8 1 1 A 127 127 SER N N 127 116.390 108.246 8.144 1
1 1518 . 8 1 1 A 128 128 SER H H 128 8.272 9.012 -0.740 1
1 1519 . 8 1 1 A 128 128 SER HA H 128 4.496 4.738 -0.242 1
1 1520 . 8 1 1 A 128 128 SER C C 128 173.921 174.589 -0.668 1
1 1521 . 8 1 1 A 128 128 SER CA C 128 58.442 59.408 -0.966 1
1 1522 . 8 1 1 A 128 128 SER CB C 128 64.173 65.793 -1.620 1
1 1523 . 8 1 1 A 128 128 SER N N 128 117.506 117.036 0.470 1
1 1 . 9 1 1 A 7 7 GLY HA2 H 7 3.978 4.186 -0.208 1
1 2 . 9 1 1 A 7 7 GLY HA3 H 7 3.978 4.187 -0.209 1
1 3 . 9 1 1 A 7 7 GLY C C 7 174.274 175.204 -0.930 1
1 4 . 9 1 1 A 7 7 GLY CA C 7 45.383 43.929 1.454 1
1 5 . 9 1 1 A 8 8 SER H H 8 8.211 8.804 -0.593 1
1 6 . 9 1 1 A 8 8 SER HA H 8 4.425 4.139 0.286 1
1 9 . 9 1 1 A 8 8 SER C C 8 174.635 174.816 -0.181 1
1 10 . 9 1 1 A 8 8 SER CA C 8 58.425 62.454 -4.029 1
1 11 . 9 1 1 A 8 8 SER CB C 8 63.885 63.024 0.861 1
1 12 . 9 1 1 A 8 8 SER N N 8 115.732 116.775 -1.043 1
1 13 . 9 1 1 A 9 9 LEU H H 9 8.316 8.050 0.266 1
1 14 . 9 1 1 A 9 9 LEU HA H 9 4.334 3.962 0.372 1
1 24 . 9 1 1 A 9 9 LEU C C 9 177.447 175.878 1.569 1
1 25 . 9 1 1 A 9 9 LEU CA C 9 55.407 55.622 -0.215 1
1 26 . 9 1 1 A 9 9 LEU CB C 9 42.171 40.762 1.409 1
1 30 . 9 1 1 A 9 9 LEU N N 9 123.943 120.779 3.164 1
1 31 . 9 1 1 A 10 10 SER H H 10 8.304 8.087 0.217 1
1 32 . 9 1 1 A 10 10 SER HA H 10 4.424 4.713 -0.289 1
1 35 . 9 1 1 A 10 10 SER C C 10 175.025 173.239 1.786 1
1 36 . 9 1 1 A 10 10 SER CA C 10 58.425 59.493 -1.068 1
1 37 . 9 1 1 A 10 10 SER CB C 10 63.638 65.316 -1.678 1
1 38 . 9 1 1 A 10 10 SER N N 10 116.718 118.775 -2.057 1
1 39 . 9 1 1 A 11 11 THR H H 11 8.003 8.001 0.002 1
1 40 . 9 1 1 A 11 11 THR HA H 11 4.196 5.104 -0.908 1
1 45 . 9 1 1 A 11 11 THR C C 11 176.296 173.710 2.586 1
1 46 . 9 1 1 A 11 11 THR CA C 11 62.483 61.309 1.174 1
1 47 . 9 1 1 A 11 11 THR CB C 11 69.266 72.829 -3.563 1
1 49 . 9 1 1 A 11 11 THR N N 11 114.902 112.437 2.465 1
1 50 . 9 1 1 A 12 12 VAL H H 12 8.095 8.659 -0.564 1
1 51 . 9 1 1 A 12 12 VAL HA H 12 3.826 4.270 -0.444 1
1 59 . 9 1 1 A 12 12 VAL C C 12 178.501 177.175 1.326 1
1 60 . 9 1 1 A 12 12 VAL CA C 12 64.760 63.831 0.929 1
1 61 . 9 1 1 A 12 12 VAL CB C 12 32.013 33.768 -1.755 1
1 64 . 9 1 1 A 12 12 VAL N N 12 122.111 122.713 -0.602 1
1 65 . 9 1 1 A 13 13 GLU H H 13 8.151 8.927 -0.776 1
1 66 . 9 1 1 A 13 13 GLU HA H 13 3.244 4.293 -1.049 1
1 71 . 9 1 1 A 13 13 GLU C C 13 175.702 178.904 -3.202 1
1 72 . 9 1 1 A 13 13 GLU CA C 13 58.354 59.516 -1.162 1
1 73 . 9 1 1 A 13 13 GLU CB C 13 28.843 29.048 -0.205 1
1 75 . 9 1 1 A 13 13 GLU N N 13 120.316 122.177 -1.861 1
1 76 . 9 1 1 A 14 14 LEU H H 14 7.067 7.656 -0.589 1
1 77 . 9 1 1 A 14 14 LEU HA H 14 4.157 4.189 -0.032 1
1 87 . 9 1 1 A 14 14 LEU C C 14 176.863 177.559 -0.696 1
1 88 . 9 1 1 A 14 14 LEU CA C 14 53.324 55.358 -2.034 1
1 89 . 9 1 1 A 14 14 LEU CB C 14 41.636 41.649 -0.013 1
1 93 . 9 1 1 A 14 14 LEU N N 14 117.035 119.830 -2.795 1
1 94 . 9 1 1 A 15 15 SER H H 15 7.645 7.827 -0.182 1
1 95 . 9 1 1 A 15 15 SER HA H 15 4.305 4.586 -0.281 1
1 98 . 9 1 1 A 15 15 SER C C 15 175.340 172.991 2.349 1
1 99 . 9 1 1 A 15 15 SER CA C 15 59.783 57.566 2.217 1
1 100 . 9 1 1 A 15 15 SER CB C 15 64.625 61.380 3.245 1
1 101 . 9 1 1 A 15 15 SER N N 15 114.216 115.498 -1.282 1
1 102 . 9 1 1 A 16 16 GLY H H 16 8.506 8.098 0.408 1
1 103 . 9 1 1 A 16 16 GLY HA2 H 16 4.237 4.393 -0.156 1
1 104 . 9 1 1 A 16 16 GLY HA3 H 16 3.927 4.425 -0.498 1
1 105 . 9 1 1 A 16 16 GLY C C 16 173.661 172.062 1.599 1
1 106 . 9 1 1 A 16 16 GLY CA C 16 44.995 44.155 0.840 1
1 107 . 9 1 1 A 16 16 GLY N N 16 111.838 113.119 -1.281 1
1 108 . 9 1 1 A 17 17 THR H H 17 8.482 8.696 -0.214 1
1 109 . 9 1 1 A 17 17 THR HA H 17 4.319 4.350 -0.031 1
1 114 . 9 1 1 A 17 17 THR C C 17 174.758 174.248 0.510 1
1 115 . 9 1 1 A 17 17 THR CA C 17 62.272 63.709 -1.437 1
1 116 . 9 1 1 A 17 17 THR CB C 17 70.706 68.830 1.876 1
1 118 . 9 1 1 A 17 17 THR N N 17 116.679 115.443 1.236 1
1 119 . 9 1 1 A 18 18 VAL H H 18 8.948 8.785 0.163 1
1 120 . 9 1 1 A 18 18 VAL HA H 18 3.950 4.340 -0.390 1
1 128 . 9 1 1 A 18 18 VAL C C 18 176.669 176.885 -0.216 1
1 129 . 9 1 1 A 18 18 VAL CA C 18 64.813 63.459 1.354 1
1 130 . 9 1 1 A 18 18 VAL CB C 18 31.807 31.206 0.601 1
1 133 . 9 1 1 A 18 18 VAL N N 18 127.156 128.319 -1.163 1
1 134 . 9 1 1 A 19 19 VAL H H 19 9.359 9.450 -0.091 1
1 135 . 9 1 1 A 19 19 VAL HA H 19 4.234 4.329 -0.095 1
1 143 . 9 1 1 A 19 19 VAL C C 19 175.738 175.681 0.057 1
1 144 . 9 1 1 A 19 19 VAL CA C 19 62.060 62.360 -0.300 1
1 145 . 9 1 1 A 19 19 VAL CB C 19 33.822 33.104 0.718 1
1 148 . 9 1 1 A 19 19 VAL N N 19 125.162 122.988 2.174 1
1 149 . 9 1 1 A 20 20 LYS H H 20 7.584 7.483 0.101 1
1 150 . 9 1 1 A 20 20 LYS HA H 20 4.346 4.619 -0.273 1
1 159 . 9 1 1 A 20 20 LYS C C 20 172.818 174.248 -1.430 1
1 160 . 9 1 1 A 20 20 LYS CA C 20 56.801 55.349 1.452 1
1 161 . 9 1 1 A 20 20 LYS CB C 20 36.624 35.355 1.269 1
1 165 . 9 1 1 A 20 20 LYS N N 20 121.024 120.996 0.028 1
1 166 . 9 1 1 A 21 21 GLN H H 21 8.625 8.580 0.045 1
1 167 . 9 1 1 A 21 21 GLN HA H 21 6.003 5.675 0.328 1
1 174 . 9 1 1 A 21 21 GLN C C 21 174.914 173.996 0.918 1
1 175 . 9 1 1 A 21 21 GLN CA C 21 54.207 54.915 -0.708 1
1 176 . 9 1 1 A 21 21 GLN CB C 21 33.452 32.349 1.103 1
1 178 . 9 1 1 A 21 21 GLN N N 21 122.108 122.039 0.069 1
1 180 . 9 1 1 A 22 22 GLY H H 22 8.964 8.751 0.213 1
1 181 . 9 1 1 A 22 22 GLY HA2 H 22 4.665 4.365 0.300 1
1 182 . 9 1 1 A 22 22 GLY HA3 H 22 4.295 4.616 -0.321 1
1 183 . 9 1 1 A 22 22 GLY C C 22 170.879 171.298 -0.419 1
1 184 . 9 1 1 A 22 22 GLY CA C 22 45.683 46.428 -0.745 1
1 185 . 9 1 1 A 22 22 GLY N N 22 108.508 107.798 0.710 1
1 186 . 9 1 1 A 23 23 TYR H H 23 9.145 8.710 0.435 1
1 187 . 9 1 1 A 23 23 TYR HA H 23 5.595 5.622 -0.027 1
1 194 . 9 1 1 A 23 23 TYR C C 23 175.824 174.714 1.110 1
1 195 . 9 1 1 A 23 23 TYR CA C 23 58.019 56.587 1.432 1
1 196 . 9 1 1 A 23 23 TYR CB C 23 39.251 40.441 -1.190 1
1 201 . 9 1 1 A 23 23 TYR N N 23 120.809 120.194 0.615 1
1 202 . 9 1 1 A 24 24 LEU H H 24 8.935 9.448 -0.513 1
1 203 . 9 1 1 A 24 24 LEU HA H 24 4.716 4.995 -0.279 1
1 213 . 9 1 1 A 24 24 LEU C C 24 174.648 176.290 -1.642 1
1 214 . 9 1 1 A 24 24 LEU CA C 24 53.907 53.146 0.761 1
1 215 . 9 1 1 A 24 24 LEU CB C 24 46.078 43.685 2.393 1
1 219 . 9 1 1 A 24 24 LEU N N 24 122.887 124.657 -1.770 1
1 220 . 9 1 1 A 25 25 ALA H H 25 8.145 8.442 -0.297 1
1 221 . 9 1 1 A 25 25 ALA HA H 25 5.477 5.577 -0.100 1
1 225 . 9 1 1 A 25 25 ALA C C 25 175.751 175.512 0.239 1
1 226 . 9 1 1 A 25 25 ALA CA C 25 50.719 50.564 0.155 1
1 227 . 9 1 1 A 25 25 ALA CB C 25 21.074 20.646 0.428 1
1 228 . 9 1 1 A 25 25 ALA N N 25 122.280 123.094 -0.814 1
1 229 . 9 1 1 A 26 26 LYS H H 26 9.167 8.448 0.719 1
1 230 . 9 1 1 A 26 26 LYS HA H 26 5.221 4.569 0.652 1
1 239 . 9 1 1 A 26 26 LYS C C 26 175.421 176.426 -1.005 1
1 240 . 9 1 1 A 26 26 LYS CA C 26 54.383 55.311 -0.928 1
1 241 . 9 1 1 A 26 26 LYS CB C 26 36.125 33.667 2.458 1
1 245 . 9 1 1 A 26 26 LYS N N 26 120.638 125.441 -4.803 1
1 246 . 9 1 1 A 27 27 GLN H H 27 7.866 8.154 -0.288 1
1 247 . 9 1 1 A 27 27 GLN HA H 27 3.525 4.067 -0.542 1
1 254 . 9 1 1 A 27 27 GLN C C 27 177.022 174.911 2.111 1
1 255 . 9 1 1 A 27 27 GLN CA C 27 55.778 56.151 -0.373 1
1 256 . 9 1 1 A 27 27 GLN CB C 27 29.864 28.834 1.030 1
1 258 . 9 1 1 A 27 27 GLN N N 27 130.194 127.642 2.552 1
1 260 . 9 1 1 A 28 28 GLY H H 28 8.565 7.660 0.905 1
1 261 . 9 1 1 A 28 28 GLY HA2 H 28 4.125 4.133 -0.008 1
1 262 . 9 1 1 A 28 28 GLY HA3 H 28 4.034 4.184 -0.150 1
1 263 . 9 1 1 A 28 28 GLY C C 28 174.030 173.161 0.869 1
1 264 . 9 1 1 A 28 28 GLY CA C 28 45.665 45.466 0.199 1
1 265 . 9 1 1 A 28 28 GLY N N 28 115.528 111.289 4.239 1
1 266 . 9 1 1 A 29 29 HIS HA H 29 4.355 4.732 -0.377 1
1 271 . 9 1 1 A 29 29 HIS CA C 29 58.795 54.865 3.930 1
1 272 . 9 1 1 A 29 29 HIS CB C 29 31.283 29.424 1.859 1
1 275 . 9 1 1 A 30 30 LYS HA H 30 4.096 4.414 -0.318 1
1 284 . 9 1 1 A 30 30 LYS CA C 30 57.290 54.778 2.512 1
1 285 . 9 1 1 A 30 30 LYS CB C 30 31.951 36.059 -4.108 1
1 289 . 9 1 1 A 31 31 ARG HA H 31 3.975 3.913 0.062 1
1 296 . 9 1 1 A 31 31 ARG CA C 31 55.973 59.712 -3.739 1
1 297 . 9 1 1 A 31 31 ARG CB C 31 29.902 30.155 -0.253 1
1 300 . 9 1 1 A 32 32 LYS HA H 32 4.160 4.549 -0.389 1
1 309 . 9 1 1 A 32 32 LYS C C 32 175.678 177.208 -1.530 1
1 310 . 9 1 1 A 32 32 LYS CA C 32 56.254 55.246 1.008 1
1 311 . 9 1 1 A 32 32 LYS CB C 32 31.602 33.363 -1.761 1
1 315 . 9 1 1 A 33 33 ASN H H 33 7.925 8.953 -1.028 1
1 316 . 9 1 1 A 33 33 ASN HA H 33 4.799 4.522 0.277 1
1 321 . 9 1 1 A 33 33 ASN C C 33 174.005 175.139 -1.134 1
1 322 . 9 1 1 A 33 33 ASN CA C 33 52.407 56.239 -3.832 1
1 323 . 9 1 1 A 33 33 ASN CB C 33 39.879 37.843 2.036 1
1 324 . 9 1 1 A 33 33 ASN N N 33 116.990 119.581 -2.591 1
1 326 . 9 1 1 A 34 34 TRP H H 34 8.798 7.992 0.806 1
1 327 . 9 1 1 A 34 34 TRP HA H 34 4.755 5.307 -0.552 1
1 336 . 9 1 1 A 34 34 TRP C C 34 176.090 174.915 1.175 1
1 337 . 9 1 1 A 34 34 TRP CA C 34 57.119 55.658 1.461 1
1 338 . 9 1 1 A 34 34 TRP CB C 34 30.596 30.792 -0.196 1
1 344 . 9 1 1 A 34 34 TRP N N 34 121.917 117.642 4.275 1
1 346 . 9 1 1 A 35 35 LYS H H 35 8.404 8.472 -0.068 1
1 347 . 9 1 1 A 35 35 LYS HA H 35 4.846 4.797 0.049 1
1 354 . 9 1 1 A 35 35 LYS C C 35 176.088 176.465 -0.377 1
1 355 . 9 1 1 A 35 35 LYS CA C 35 54.418 55.297 -0.879 1
1 356 . 9 1 1 A 35 35 LYS CB C 35 36.125 34.270 1.855 1
1 360 . 9 1 1 A 35 35 LYS N N 35 120.864 125.457 -4.593 1
1 361 . 9 1 1 A 36 36 VAL H H 36 8.977 8.505 0.472 1
1 362 . 9 1 1 A 36 36 VAL HA H 36 4.274 4.701 -0.427 1
1 370 . 9 1 1 A 36 36 VAL C C 36 176.733 176.069 0.664 1
1 371 . 9 1 1 A 36 36 VAL CA C 36 64.319 62.634 1.685 1
1 372 . 9 1 1 A 36 36 VAL CB C 36 31.602 31.706 -0.104 1
1 375 . 9 1 1 A 36 36 VAL N N 36 124.314 124.164 0.150 1
1 376 . 9 1 1 A 37 37 ARG H H 37 9.498 10.575 -1.077 1
1 377 . 9 1 1 A 37 37 ARG HA H 37 5.053 5.079 -0.026 1
1 384 . 9 1 1 A 37 37 ARG C C 37 174.442 174.398 0.044 1
1 385 . 9 1 1 A 37 37 ARG CA C 37 53.272 54.079 -0.807 1
1 386 . 9 1 1 A 37 37 ARG CB C 37 34.563 34.273 0.290 1
1 389 . 9 1 1 A 37 37 ARG N N 37 128.121 126.495 1.626 1
1 390 . 9 1 1 A 38 38 ARG H H 38 8.755 8.819 -0.064 1
1 391 . 9 1 1 A 38 38 ARG HA H 38 4.626 4.827 -0.201 1
1 398 . 9 1 1 A 38 38 ARG C C 38 175.514 174.833 0.681 1
1 399 . 9 1 1 A 38 38 ARG CA C 38 55.601 55.408 0.193 1
1 400 . 9 1 1 A 38 38 ARG CB C 38 32.219 31.048 1.171 1
1 403 . 9 1 1 A 38 38 ARG N N 38 121.442 123.369 -1.927 1
1 404 . 9 1 1 A 39 39 PHE H H 39 9.865 8.850 1.015 1
1 405 . 9 1 1 A 39 39 PHE HA H 39 5.424 5.118 0.306 1
1 413 . 9 1 1 A 39 39 PHE C C 39 175.423 174.871 0.552 1
1 414 . 9 1 1 A 39 39 PHE CA C 39 57.419 57.047 0.372 1
1 415 . 9 1 1 A 39 39 PHE CB C 39 42.623 41.390 1.233 1
1 421 . 9 1 1 A 39 39 PHE N N 39 130.027 126.430 3.597 1
1 422 . 9 1 1 A 40 40 VAL H H 40 9.300 10.473 -1.173 1
1 423 . 9 1 1 A 40 40 VAL HA H 40 4.846 5.364 -0.518 1
1 431 . 9 1 1 A 40 40 VAL C C 40 174.477 173.154 1.323 1
1 432 . 9 1 1 A 40 40 VAL CA C 40 62.343 59.875 2.468 1
1 433 . 9 1 1 A 40 40 VAL CB C 40 35.755 35.211 0.544 1
1 436 . 9 1 1 A 40 40 VAL N N 40 119.369 122.168 -2.799 1
1 437 . 9 1 1 A 41 41 LEU H H 41 9.557 10.801 -1.244 1
1 438 . 9 1 1 A 41 41 LEU HA H 41 5.292 5.461 -0.169 1
1 448 . 9 1 1 A 41 41 LEU C C 41 174.632 175.042 -0.410 1
1 449 . 9 1 1 A 41 41 LEU CA C 41 53.571 53.551 0.020 1
1 450 . 9 1 1 A 41 41 LEU CB C 41 45.337 45.218 0.119 1
1 454 . 9 1 1 A 41 41 LEU N N 41 132.121 129.454 2.667 1
1 455 . 9 1 1 A 42 42 ARG H H 42 9.396 9.301 0.095 1
1 456 . 9 1 1 A 42 42 ARG HA H 42 5.366 5.434 -0.068 1
1 464 . 9 1 1 A 42 42 ARG C C 42 173.997 175.408 -1.411 1
1 465 . 9 1 1 A 42 42 ARG CA C 42 54.631 54.408 0.223 1
1 466 . 9 1 1 A 42 42 ARG CB C 42 35.550 33.729 1.821 1
1 469 . 9 1 1 A 42 42 ARG N N 42 128.120 126.315 1.805 1
1 471 . 9 1 1 A 43 43 LYS H H 43 8.597 8.971 -0.374 1
1 472 . 9 1 1 A 43 43 LYS HA H 43 4.558 4.934 -0.376 1
1 481 . 9 1 1 A 43 43 LYS C C 43 174.648 175.253 -0.605 1
1 482 . 9 1 1 A 43 43 LYS CA C 43 53.378 54.526 -1.148 1
1 483 . 9 1 1 A 43 43 LYS CB C 43 37.303 36.055 1.248 1
1 487 . 9 1 1 A 43 43 LYS N N 43 114.484 119.562 -5.078 1
1 488 . 9 1 1 A 44 44 ASP H H 44 8.388 8.984 -0.596 1
1 489 . 9 1 1 A 44 44 ASP HA H 44 4.349 4.229 0.120 1
1 492 . 9 1 1 A 44 44 ASP C C 44 173.376 174.341 -0.965 1
1 493 . 9 1 1 A 44 44 ASP CA C 44 54.842 54.911 -0.069 1
1 494 . 9 1 1 A 44 44 ASP CB C 44 39.991 39.450 0.541 1
1 495 . 9 1 1 A 44 44 ASP N N 44 115.453 119.579 -4.126 1
1 496 . 9 1 1 A 45 45 PRO HA H 45 4.652 4.473 0.179 1
1 503 . 9 1 1 A 45 45 PRO C C 45 176.914 175.537 1.377 1
1 504 . 9 1 1 A 45 45 PRO CA C 45 63.490 62.451 1.039 1
1 505 . 9 1 1 A 45 45 PRO CB C 45 34.892 32.356 2.536 1
1 508 . 9 1 1 A 46 46 ALA H H 46 8.112 8.121 -0.009 1
1 509 . 9 1 1 A 46 46 ALA HA H 46 5.455 4.843 0.612 1
1 513 . 9 1 1 A 46 46 ALA C C 46 177.234 177.037 0.197 1
1 514 . 9 1 1 A 46 46 ALA CA C 46 51.560 50.652 0.908 1
1 515 . 9 1 1 A 46 46 ALA CB C 46 20.122 20.100 0.022 1
1 516 . 9 1 1 A 46 46 ALA N N 46 120.155 123.250 -3.095 1
1 517 . 9 1 1 A 47 47 PHE H H 47 8.717 9.050 -0.333 1
1 518 . 9 1 1 A 47 47 PHE HA H 47 4.795 5.098 -0.303 1
1 526 . 9 1 1 A 47 47 PHE C C 47 172.588 174.351 -1.763 1
1 527 . 9 1 1 A 47 47 PHE CA C 47 57.348 56.420 0.928 1
1 528 . 9 1 1 A 47 47 PHE CB C 47 47.123 44.229 2.894 1
1 534 . 9 1 1 A 47 47 PHE N N 47 129.946 119.143 10.803 1
1 535 . 9 1 1 A 48 48 LEU H H 48 7.883 8.633 -0.750 1
1 536 . 9 1 1 A 48 48 LEU HA H 48 5.198 5.379 -0.181 1
1 546 . 9 1 1 A 48 48 LEU C C 48 173.569 174.702 -1.133 1
1 547 . 9 1 1 A 48 48 LEU CA C 48 53.290 54.186 -0.896 1
1 548 . 9 1 1 A 48 48 LEU CB C 48 45.502 45.726 -0.224 1
1 552 . 9 1 1 A 48 48 LEU N N 48 121.108 123.154 -2.046 1
1 553 . 9 1 1 A 49 49 HIS H H 49 8.606 9.132 -0.526 1
1 554 . 9 1 1 A 49 49 HIS HA H 49 5.035 4.930 0.105 1
1 559 . 9 1 1 A 49 49 HIS C C 49 173.993 173.816 0.177 1
1 560 . 9 1 1 A 49 49 HIS CA C 49 56.483 53.935 2.548 1
1 561 . 9 1 1 A 49 49 HIS CB C 49 35.919 33.842 2.077 1
1 564 . 9 1 1 A 49 49 HIS N N 49 121.199 125.251 -4.052 1
1 565 . 9 1 1 A 50 50 TYR H H 50 7.777 8.140 -0.363 1
1 566 . 9 1 1 A 50 50 TYR HA H 50 5.695 5.546 0.149 1
1 573 . 9 1 1 A 50 50 TYR C C 50 174.284 172.026 2.258 1
1 574 . 9 1 1 A 50 50 TYR CA C 50 53.430 55.599 -2.169 1
1 575 . 9 1 1 A 50 50 TYR CB C 50 38.552 40.513 -1.961 1
1 580 . 9 1 1 A 50 50 TYR N N 50 114.156 117.332 -3.176 1
1 581 . 9 1 1 A 51 51 TYR H H 51 9.323 9.954 -0.631 1
1 582 . 9 1 1 A 51 51 TYR HA H 51 4.600 5.129 -0.529 1
1 589 . 9 1 1 A 51 51 TYR C C 51 175.352 174.305 1.047 1
1 590 . 9 1 1 A 51 51 TYR CA C 51 57.330 56.789 0.541 1
1 591 . 9 1 1 A 51 51 TYR CB C 51 41.683 42.361 -0.678 1
1 596 . 9 1 1 A 51 51 TYR N N 51 119.100 120.106 -1.006 1
1 597 . 9 1 1 A 52 52 ASP H H 52 9.375 8.782 0.593 1
1 598 . 9 1 1 A 52 52 ASP HA H 52 5.064 5.026 0.038 1
1 601 . 9 1 1 A 52 52 ASP C C 52 175.484 175.449 0.035 1
1 602 . 9 1 1 A 52 52 ASP CA C 52 51.313 50.696 0.617 1
1 603 . 9 1 1 A 52 52 ASP CB C 52 41.883 42.434 -0.551 1
1 604 . 9 1 1 A 52 52 ASP N N 52 124.636 122.892 1.744 1
1 605 . 9 1 1 A 53 53 PRO HA H 53 4.678 4.599 0.079 1
1 612 . 9 1 1 A 53 53 PRO C C 53 176.781 177.057 -0.276 1
1 613 . 9 1 1 A 53 53 PRO CA C 53 64.054 63.976 0.078 1
1 614 . 9 1 1 A 53 53 PRO CB C 53 32.589 32.070 0.519 1
1 617 . 9 1 1 A 54 54 SER H H 54 8.685 8.980 -0.295 1
1 618 . 9 1 1 A 54 54 SER HA H 54 4.483 4.565 -0.082 1
1 621 . 9 1 1 A 54 54 SER C C 54 174.006 174.893 -0.887 1
1 622 . 9 1 1 A 54 54 SER CA C 54 59.378 60.746 -1.368 1
1 623 . 9 1 1 A 54 54 SER CB C 54 64.132 64.472 -0.340 1
1 624 . 9 1 1 A 54 54 SER N N 54 113.769 113.246 0.523 1
1 625 . 9 1 1 A 55 55 LYS H H 55 7.706 7.945 -0.239 1
1 626 . 9 1 1 A 55 55 LYS HA H 55 4.580 4.432 0.148 1
1 635 . 9 1 1 A 55 55 LYS C C 55 175.969 175.443 0.526 1
1 636 . 9 1 1 A 55 55 LYS CA C 55 55.160 56.320 -1.160 1
1 637 . 9 1 1 A 55 55 LYS CB C 55 34.069 33.636 0.433 1
1 641 . 9 1 1 A 55 55 LYS N N 55 122.222 119.303 2.919 1
1 642 . 9 1 1 A 56 56 GLU H H 56 8.666 8.738 -0.072 1
1 643 . 9 1 1 A 56 56 GLU HA H 56 4.174 5.070 -0.896 1
1 648 . 9 1 1 A 56 56 GLU C C 56 177.084 174.637 2.447 1
1 649 . 9 1 1 A 56 56 GLU CA C 56 57.099 55.447 1.652 1
1 650 . 9 1 1 A 56 56 GLU CB C 56 29.694 31.003 -1.309 1
1 652 . 9 1 1 A 56 56 GLU N N 56 122.015 118.917 3.098 1
1 653 . 9 1 1 A 57 57 GLU H H 57 8.303 8.860 -0.557 1
1 654 . 9 1 1 A 57 57 GLU HA H 57 4.214 4.701 -0.487 1
1 659 . 9 1 1 A 57 57 GLU CA C 57 56.960 55.267 1.693 1
1 660 . 9 1 1 A 57 57 GLU CB C 57 30.264 33.752 -3.488 1
1 662 . 9 1 1 A 57 57 GLU N N 57 119.884 124.585 -4.701 1
1 663 . 9 1 1 A 58 58 ASN HA H 58 4.768 4.850 -0.082 1
1 668 . 9 1 1 A 58 58 ASN C C 58 174.902 173.755 1.147 1
1 669 . 9 1 1 A 58 58 ASN CA C 58 52.740 53.045 -0.305 1
1 670 . 9 1 1 A 58 58 ASN CB C 58 38.116 36.430 1.686 1
1 672 . 9 1 1 A 59 59 ARG H H 59 7.805 8.183 -0.378 1
1 673 . 9 1 1 A 59 59 ARG HA H 59 4.762 4.756 0.006 1
1 680 . 9 1 1 A 59 59 ARG CA C 59 53.151 54.242 -1.091 1
1 681 . 9 1 1 A 59 59 ARG CB C 59 31.519 34.613 -3.094 1
1 684 . 9 1 1 A 59 59 ARG N N 59 121.060 120.638 0.422 1
1 685 . 9 1 1 A 60 60 PRO HA H 60 3.357 3.498 -0.141 1
1 692 . 9 1 1 A 60 60 PRO C C 60 176.817 176.445 0.372 1
1 693 . 9 1 1 A 60 60 PRO CA C 60 63.031 61.531 1.500 1
1 694 . 9 1 1 A 60 60 PRO CB C 60 31.273 31.816 -0.543 1
1 697 . 9 1 1 A 61 61 VAL H H 61 8.627 8.200 0.427 1
1 698 . 9 1 1 A 61 61 VAL HA H 61 3.966 3.761 0.205 1
1 706 . 9 1 1 A 61 61 VAL C C 61 176.503 176.284 0.219 1
1 707 . 9 1 1 A 61 61 VAL CA C 61 63.154 64.592 -1.438 1
1 708 . 9 1 1 A 61 61 VAL CB C 61 32.048 32.235 -0.187 1
1 711 . 9 1 1 A 61 61 VAL N N 61 119.185 120.355 -1.170 1
1 712 . 9 1 1 A 62 62 GLY H H 62 6.715 6.281 0.434 1
1 713 . 9 1 1 A 62 62 GLY HA2 H 62 3.940 3.717 0.223 1
1 714 . 9 1 1 A 62 62 GLY HA3 H 62 3.538 3.821 -0.283 1
1 715 . 9 1 1 A 62 62 GLY C C 62 169.983 172.285 -2.302 1
1 716 . 9 1 1 A 62 62 GLY CA C 62 44.465 45.441 -0.976 1
1 717 . 9 1 1 A 62 62 GLY N N 62 105.813 105.808 0.005 1
1 718 . 9 1 1 A 63 63 GLY H H 63 8.004 7.789 0.215 1
1 719 . 9 1 1 A 63 63 GLY HA2 H 63 4.095 3.227 0.868 1
1 720 . 9 1 1 A 63 63 GLY HA3 H 63 3.813 3.358 0.455 1
1 721 . 9 1 1 A 63 63 GLY C C 63 171.870 172.677 -0.807 1
1 722 . 9 1 1 A 63 63 GLY CA C 63 47.148 43.801 3.347 1
1 723 . 9 1 1 A 63 63 GLY N N 63 105.089 106.997 -1.908 1
1 724 . 9 1 1 A 64 64 PHE H H 64 7.967 7.737 0.230 1
1 725 . 9 1 1 A 64 64 PHE HA H 64 4.934 5.265 -0.331 1
1 733 . 9 1 1 A 64 64 PHE C C 64 173.140 174.593 -1.453 1
1 734 . 9 1 1 A 64 64 PHE CA C 64 55.248 55.007 0.241 1
1 735 . 9 1 1 A 64 64 PHE CB C 64 40.238 41.755 -1.517 1
1 741 . 9 1 1 A 64 64 PHE N N 64 113.387 119.930 -6.543 1
1 742 . 9 1 1 A 65 65 SER H H 65 8.518 9.150 -0.632 1
1 743 . 9 1 1 A 65 65 SER HA H 65 3.264 5.111 -1.847 1
1 746 . 9 1 1 A 65 65 SER C C 65 176.417 173.919 2.498 1
1 747 . 9 1 1 A 65 65 SER CA C 65 56.819 58.199 -1.380 1
1 748 . 9 1 1 A 65 65 SER CB C 65 63.391 64.738 -1.347 1
1 749 . 9 1 1 A 65 65 SER N N 65 114.674 115.482 -0.808 1
1 750 . 9 1 1 A 66 66 LEU H H 66 7.404 8.515 -1.111 1
1 751 . 9 1 1 A 66 66 LEU HA H 66 4.470 4.754 -0.284 1
1 761 . 9 1 1 A 66 66 LEU C C 66 177.993 178.393 -0.400 1
1 762 . 9 1 1 A 66 66 LEU CA C 66 54.242 56.043 -1.801 1
1 763 . 9 1 1 A 66 66 LEU CB C 66 42.787 42.672 0.115 1
1 767 . 9 1 1 A 66 66 LEU N N 66 123.988 124.099 -0.111 1
1 768 . 9 1 1 A 67 67 ARG H H 67 7.865 8.074 -0.209 1
1 769 . 9 1 1 A 67 67 ARG HA H 67 4.175 3.978 0.197 1
1 776 . 9 1 1 A 67 67 ARG C C 67 178.562 177.938 0.624 1
1 777 . 9 1 1 A 67 67 ARG CA C 67 58.143 59.225 -1.082 1
1 778 . 9 1 1 A 67 67 ARG CB C 67 29.052 30.206 -1.154 1
1 781 . 9 1 1 A 67 67 ARG N N 67 122.494 118.063 4.431 1
1 782 . 9 1 1 A 68 68 GLY H H 68 9.398 8.126 1.272 1
1 783 . 9 1 1 A 68 68 GLY HA2 H 68 4.066 3.916 0.150 1
1 784 . 9 1 1 A 68 68 GLY HA3 H 68 3.908 3.930 -0.022 1
1 785 . 9 1 1 A 68 68 GLY C C 68 173.982 174.083 -0.101 1
1 786 . 9 1 1 A 68 68 GLY CA C 68 46.230 46.216 0.014 1
1 787 . 9 1 1 A 68 68 GLY N N 68 117.548 108.039 9.509 1
1 788 . 9 1 1 A 69 69 SER H H 69 7.829 7.953 -0.124 1
1 789 . 9 1 1 A 69 69 SER HA H 69 4.807 5.097 -0.290 1
1 792 . 9 1 1 A 69 69 SER C C 69 172.854 173.046 -0.192 1
1 793 . 9 1 1 A 69 69 SER CA C 69 59.290 56.334 2.956 1
1 794 . 9 1 1 A 69 69 SER CB C 69 65.366 66.342 -0.976 1
1 795 . 9 1 1 A 69 69 SER N N 69 115.188 113.111 2.077 1
1 796 . 9 1 1 A 70 70 LEU H H 70 8.805 8.651 0.154 1
1 797 . 9 1 1 A 70 70 LEU HA H 70 4.846 4.862 -0.016 1
1 807 . 9 1 1 A 70 70 LEU C C 70 175.775 174.443 1.332 1
1 808 . 9 1 1 A 70 70 LEU CA C 70 53.907 53.557 0.350 1
1 809 . 9 1 1 A 70 70 LEU CB C 70 45.337 44.241 1.096 1
1 813 . 9 1 1 A 70 70 LEU N N 70 121.265 121.507 -0.242 1
1 814 . 9 1 1 A 71 71 VAL H H 71 8.644 8.629 0.015 1
1 815 . 9 1 1 A 71 71 VAL HA H 71 5.555 5.012 0.543 1
1 823 . 9 1 1 A 71 71 VAL C C 71 173.636 173.297 0.339 1
1 824 . 9 1 1 A 71 71 VAL CA C 71 58.760 60.228 -1.468 1
1 825 . 9 1 1 A 71 71 VAL CB C 71 34.891 35.265 -0.374 1
1 828 . 9 1 1 A 71 71 VAL N N 71 122.315 120.801 1.514 1
1 829 . 9 1 1 A 72 72 SER H H 72 8.750 8.593 0.157 1
1 830 . 9 1 1 A 72 72 SER HA H 72 4.742 5.002 -0.260 1
1 833 . 9 1 1 A 72 72 SER C C 72 173.058 172.781 0.277 1
1 834 . 9 1 1 A 72 72 SER CA C 72 57.190 57.813 -0.623 1
1 835 . 9 1 1 A 72 72 SER CB C 72 65.612 67.349 -1.737 1
1 836 . 9 1 1 A 72 72 SER N N 72 118.611 121.990 -3.379 1
1 837 . 9 1 1 A 73 73 ALA H H 73 9.009 8.483 0.526 1
1 838 . 9 1 1 A 73 73 ALA HA H 73 4.406 5.142 -0.736 1
1 842 . 9 1 1 A 73 73 ALA C C 73 176.708 176.618 0.090 1
1 843 . 9 1 1 A 73 73 ALA CA C 73 52.672 51.031 1.641 1
1 844 . 9 1 1 A 73 73 ALA CB C 73 18.812 20.715 -1.903 1
1 845 . 9 1 1 A 73 73 ALA N N 73 125.694 125.894 -0.200 1
1 846 . 9 1 1 A 74 74 LEU H H 74 7.800 8.804 -1.004 1
1 847 . 9 1 1 A 74 74 LEU HA H 74 4.716 4.811 -0.095 1
1 857 . 9 1 1 A 74 74 LEU C C 74 176.551 176.184 0.367 1
1 858 . 9 1 1 A 74 74 LEU CA C 74 53.784 53.486 0.298 1
1 859 . 9 1 1 A 74 74 LEU CB C 74 43.446 43.755 -0.309 1
1 863 . 9 1 1 A 74 74 LEU N N 74 122.271 121.299 0.972 1
1 864 . 9 1 1 A 75 75 GLU H H 75 8.855 8.589 0.266 1
1 865 . 9 1 1 A 75 75 GLU HA H 75 4.336 4.521 -0.185 1
1 870 . 9 1 1 A 75 75 GLU C C 75 176.465 175.282 1.183 1
1 871 . 9 1 1 A 75 75 GLU CA C 75 56.507 56.047 0.460 1
1 872 . 9 1 1 A 75 75 GLU CB C 75 30.245 30.991 -0.746 1
1 874 . 9 1 1 A 75 75 GLU N N 75 122.678 124.196 -1.518 1
1 875 . 9 1 1 A 76 76 ASP H H 76 8.542 8.752 -0.210 1
1 876 . 9 1 1 A 76 76 ASP HA H 76 4.665 5.563 -0.898 1
1 879 . 9 1 1 A 76 76 ASP C C 76 176.087 175.535 0.552 1
1 880 . 9 1 1 A 76 76 ASP CA C 76 55.107 53.187 1.920 1
1 881 . 9 1 1 A 76 76 ASP CB C 76 41.431 43.674 -2.243 1
1 882 . 9 1 1 A 76 76 ASP N N 76 121.488 122.348 -0.860 1
1 883 . 9 1 1 A 77 77 ASN H H 77 8.322 8.918 -0.596 1
1 884 . 9 1 1 A 77 77 ASN HA H 77 4.729 4.911 -0.182 1
1 889 . 9 1 1 A 77 77 ASN C C 77 175.566 174.972 0.594 1
1 890 . 9 1 1 A 77 77 ASN CA C 77 53.131 54.637 -1.506 1
1 891 . 9 1 1 A 77 77 ASN CB C 77 38.617 40.698 -2.081 1
1 892 . 9 1 1 A 77 77 ASN N N 77 118.676 121.412 -2.736 1
1 894 . 9 1 1 A 78 78 GLY H H 78 8.311 7.408 0.903 1
1 895 . 9 1 1 A 78 78 GLY HA2 H 78 3.897 4.114 -0.217 1
1 896 . 9 1 1 A 78 78 GLY HA3 H 78 3.897 4.115 -0.218 1
1 897 . 9 1 1 A 78 78 GLY C C 78 173.376 173.357 0.019 1
1 898 . 9 1 1 A 78 78 GLY CA C 78 45.224 45.767 -0.543 1
1 899 . 9 1 1 A 78 78 GLY N N 78 108.939 104.111 4.828 1
1 900 . 9 1 1 A 79 79 VAL H H 79 7.882 8.670 -0.788 1
1 901 . 9 1 1 A 79 79 VAL HA H 79 4.345 4.167 0.178 1
1 909 . 9 1 1 A 79 79 VAL CA C 79 59.995 63.338 -3.343 1
1 910 . 9 1 1 A 79 79 VAL CB C 79 32.589 30.811 1.778 1
1 913 . 9 1 1 A 79 79 VAL N N 79 121.135 121.837 -0.702 1
1 914 . 9 1 1 A 80 80 PRO HA H 80 4.461 4.565 -0.104 1
1 921 . 9 1 1 A 80 80 PRO C C 80 176.979 176.618 0.361 1
1 922 . 9 1 1 A 80 80 PRO CA C 80 63.101 65.191 -2.090 1
1 923 . 9 1 1 A 80 80 PRO CB C 80 32.177 32.223 -0.046 1
1 926 . 9 1 1 A 81 81 THR H H 81 8.281 7.724 0.557 1
1 927 . 9 1 1 A 81 81 THR HA H 81 4.095 4.567 -0.472 1
1 932 . 9 1 1 A 81 81 THR C C 81 175.270 173.842 1.428 1
1 933 . 9 1 1 A 81 81 THR CA C 81 62.872 61.364 1.508 1
1 934 . 9 1 1 A 81 81 THR CB C 81 69.642 71.183 -1.541 1
1 936 . 9 1 1 A 81 81 THR N N 81 114.684 110.683 4.001 1
1 937 . 9 1 1 A 82 82 GLY H H 82 8.338 8.963 -0.625 1
1 938 . 9 1 1 A 82 82 GLY HA2 H 82 4.095 3.861 0.234 1
1 939 . 9 1 1 A 82 82 GLY HA3 H 82 3.668 3.877 -0.209 1
1 940 . 9 1 1 A 82 82 GLY C C 82 174.139 174.973 -0.834 1
1 941 . 9 1 1 A 82 82 GLY CA C 82 45.083 47.107 -2.024 1
1 942 . 9 1 1 A 82 82 GLY N N 82 111.289 116.134 -4.845 1
1 943 . 9 1 1 A 83 83 VAL H H 83 7.668 8.285 -0.617 1
1 944 . 9 1 1 A 83 83 VAL HA H 83 3.985 4.106 -0.121 1
1 952 . 9 1 1 A 83 83 VAL C C 83 176.054 175.683 0.371 1
1 953 . 9 1 1 A 83 83 VAL CA C 83 62.431 63.328 -0.897 1
1 954 . 9 1 1 A 83 83 VAL CB C 83 32.260 33.270 -1.010 1
1 957 . 9 1 1 A 83 83 VAL N N 83 120.003 116.985 3.018 1
1 958 . 9 1 1 A 84 84 LYS H H 84 8.645 8.113 0.532 1
1 959 . 9 1 1 A 84 84 LYS HA H 84 4.276 4.099 0.177 1
1 968 . 9 1 1 A 84 84 LYS C C 84 176.832 176.616 0.216 1
1 969 . 9 1 1 A 84 84 LYS CA C 84 56.272 57.380 -1.108 1
1 970 . 9 1 1 A 84 84 LYS CB C 84 32.876 31.359 1.517 1
1 974 . 9 1 1 A 84 84 LYS N N 84 126.447 119.671 6.776 1
1 975 . 9 1 1 A 85 85 GLY H H 85 8.410 8.604 -0.194 1
1 976 . 9 1 1 A 85 85 GLY HA2 H 85 4.066 4.033 0.033 1
1 977 . 9 1 1 A 85 85 GLY HA3 H 85 3.781 4.068 -0.287 1
1 978 . 9 1 1 A 85 85 GLY C C 85 173.969 174.593 -0.624 1
1 979 . 9 1 1 A 85 85 GLY CA C 85 45.146 45.082 0.064 1
1 980 . 9 1 1 A 85 85 GLY N N 85 109.957 112.852 -2.895 1
1 981 . 9 1 1 A 86 86 ASN H H 86 8.298 8.357 -0.059 1
1 982 . 9 1 1 A 86 86 ASN HA H 86 4.665 4.492 0.173 1
1 987 . 9 1 1 A 86 86 ASN C C 86 174.987 175.038 -0.051 1
1 988 . 9 1 1 A 86 86 ASN CA C 86 52.989 53.790 -0.801 1
1 989 . 9 1 1 A 86 86 ASN CB C 86 38.376 37.059 1.317 1
1 990 . 9 1 1 A 86 86 ASN N N 86 118.457 118.536 -0.079 1
1 992 . 9 1 1 A 87 87 VAL H H 87 7.660 8.025 -0.365 1
1 993 . 9 1 1 A 87 87 VAL HA H 87 3.946 3.930 0.016 1
1 1001 . 9 1 1 A 87 87 VAL C C 87 174.902 176.714 -1.812 1
1 1002 . 9 1 1 A 87 87 VAL CA C 87 62.307 62.339 -0.032 1
1 1003 . 9 1 1 A 87 87 VAL CB C 87 32.548 32.887 -0.339 1
1 1006 . 9 1 1 A 87 87 VAL N N 87 120.557 124.844 -4.287 1
1 1007 . 9 1 1 A 88 88 GLN H H 88 8.115 8.354 -0.239 1
1 1008 . 9 1 1 A 88 88 GLN HA H 88 4.302 3.826 0.476 1
1 1015 . 9 1 1 A 88 88 GLN C C 88 175.637 177.126 -1.489 1
1 1016 . 9 1 1 A 88 88 GLN CA C 88 55.336 58.787 -3.451 1
1 1017 . 9 1 1 A 88 88 GLN CB C 88 30.574 28.801 1.773 1
1 1019 . 9 1 1 A 88 88 GLN N N 88 122.280 126.638 -4.358 1
1 1021 . 9 1 1 A 89 89 GLY H H 89 8.544 7.403 1.141 1
1 1022 . 9 1 1 A 89 89 GLY HA2 H 89 3.885 3.929 -0.044 1
1 1023 . 9 1 1 A 89 89 GLY HA3 H 89 3.885 3.939 -0.054 1
1 1024 . 9 1 1 A 89 89 GLY C C 89 172.861 175.050 -2.189 1
1 1025 . 9 1 1 A 89 89 GLY CA C 89 44.889 45.533 -0.644 1
1 1026 . 9 1 1 A 89 89 GLY N N 89 110.135 104.514 5.621 1
1 1027 . 9 1 1 A 90 90 ASN H H 90 8.451 8.221 0.230 1
1 1028 . 9 1 1 A 90 90 ASN HA H 90 4.222 4.885 -0.663 1
1 1033 . 9 1 1 A 90 90 ASN C C 90 174.926 173.591 1.335 1
1 1034 . 9 1 1 A 90 90 ASN CA C 90 54.613 52.397 2.216 1
1 1035 . 9 1 1 A 90 90 ASN CB C 90 37.852 36.618 1.234 1
1 1036 . 9 1 1 A 90 90 ASN N N 90 114.322 119.542 -5.220 1
1 1038 . 9 1 1 A 91 91 LEU H H 91 8.933 8.242 0.691 1
1 1039 . 9 1 1 A 91 91 LEU HA H 91 5.367 5.094 0.273 1
1 1049 . 9 1 1 A 91 91 LEU C C 91 178.732 175.659 3.073 1
1 1050 . 9 1 1 A 91 91 LEU CA C 91 55.160 53.091 2.069 1
1 1051 . 9 1 1 A 91 91 LEU CB C 91 45.461 45.485 -0.024 1
1 1055 . 9 1 1 A 91 91 LEU N N 91 120.057 122.287 -2.230 1
1 1056 . 9 1 1 A 92 92 PHE H H 92 9.901 8.244 1.657 1
1 1057 . 9 1 1 A 92 92 PHE HA H 92 5.105 5.505 -0.400 1
1 1065 . 9 1 1 A 92 92 PHE C C 92 170.140 172.818 -2.678 1
1 1066 . 9 1 1 A 92 92 PHE CA C 92 56.236 55.845 0.391 1
1 1067 . 9 1 1 A 92 92 PHE CB C 92 42.664 41.907 0.757 1
1 1073 . 9 1 1 A 92 92 PHE N N 92 119.740 116.943 2.797 1
1 1074 . 9 1 1 A 93 93 LYS H H 93 9.154 9.261 -0.107 1
1 1075 . 9 1 1 A 93 93 LYS HA H 93 5.584 5.279 0.305 1
1 1083 . 9 1 1 A 93 93 LYS C C 93 174.830 174.879 -0.049 1
1 1084 . 9 1 1 A 93 93 LYS CA C 93 53.148 53.994 -0.846 1
1 1085 . 9 1 1 A 93 93 LYS CB C 93 36.660 36.350 0.310 1
1 1089 . 9 1 1 A 93 93 LYS N N 93 117.710 118.315 -0.605 1
1 1090 . 9 1 1 A 94 94 VAL H H 94 8.507 8.900 -0.393 1
1 1091 . 9 1 1 A 94 94 VAL HA H 94 4.872 4.948 -0.076 1
1 1099 . 9 1 1 A 94 94 VAL C C 94 174.408 174.907 -0.499 1
1 1100 . 9 1 1 A 94 94 VAL CA C 94 60.525 61.555 -1.030 1
1 1101 . 9 1 1 A 94 94 VAL CB C 94 34.862 34.181 0.681 1
1 1104 . 9 1 1 A 94 94 VAL N N 94 121.741 120.650 1.091 1
1 1105 . 9 1 1 A 95 95 ILE H H 95 8.959 8.979 -0.020 1
1 1106 . 9 1 1 A 95 95 ILE HA H 95 4.794 4.717 0.077 1
1 1116 . 9 1 1 A 95 95 ILE C C 95 177.642 176.180 1.462 1
1 1117 . 9 1 1 A 95 95 ILE CA C 95 59.713 60.415 -0.702 1
1 1118 . 9 1 1 A 95 95 ILE CB C 95 40.032 38.061 1.971 1
1 1122 . 9 1 1 A 95 95 ILE N N 95 126.794 128.369 -1.575 1
1 1123 . 9 1 1 A 96 96 THR H H 96 8.765 8.900 -0.135 1
1 1124 . 9 1 1 A 96 96 THR HA H 96 4.584 4.748 -0.164 1
1 1129 . 9 1 1 A 96 96 THR C C 96 177.023 176.368 0.655 1
1 1130 . 9 1 1 A 96 96 THR CA C 96 61.372 60.678 0.694 1
1 1131 . 9 1 1 A 96 96 THR CB C 96 70.794 71.842 -1.048 1
1 1133 . 9 1 1 A 96 96 THR N N 96 117.225 120.242 -3.017 1
1 1134 . 9 1 1 A 97 97 LYS H H 97 8.736 8.957 -0.221 1
1 1135 . 9 1 1 A 97 97 LYS HA H 97 4.101 4.093 0.008 1
1 1144 . 9 1 1 A 97 97 LYS C C 97 176.490 176.362 0.128 1
1 1145 . 9 1 1 A 97 97 LYS CA C 97 58.583 58.440 0.143 1
1 1146 . 9 1 1 A 97 97 LYS CB C 97 31.848 31.922 -0.074 1
1 1150 . 9 1 1 A 97 97 LYS N N 97 120.457 119.602 0.855 1
1 1151 . 9 1 1 A 98 98 ASP H H 98 7.762 7.513 0.249 1
1 1152 . 9 1 1 A 98 98 ASP HA H 98 4.633 4.858 -0.225 1
1 1155 . 9 1 1 A 98 98 ASP C C 98 175.270 175.406 -0.136 1
1 1156 . 9 1 1 A 98 98 ASP CA C 98 53.272 53.614 -0.342 1
1 1157 . 9 1 1 A 98 98 ASP CB C 98 39.909 40.632 -0.723 1
1 1158 . 9 1 1 A 98 98 ASP N N 98 116.281 119.436 -3.155 1
1 1159 . 9 1 1 A 99 99 ASP H H 99 8.340 8.253 0.087 1
1 1160 . 9 1 1 A 99 99 ASP HA H 99 4.245 4.558 -0.313 1
1 1163 . 9 1 1 A 99 99 ASP C C 99 175.315 175.473 -0.158 1
1 1164 . 9 1 1 A 99 99 ASP CA C 99 55.989 54.982 1.007 1
1 1165 . 9 1 1 A 99 99 ASP CB C 99 39.827 38.531 1.296 1
1 1166 . 9 1 1 A 99 99 ASP N N 99 116.687 118.193 -1.506 1
1 1167 . 9 1 1 A 100 100 THR H H 100 7.511 7.975 -0.464 1
1 1168 . 9 1 1 A 100 100 THR HA H 100 4.185 3.844 0.341 1
1 1173 . 9 1 1 A 100 100 THR C C 100 173.376 174.513 -1.137 1
1 1174 . 9 1 1 A 100 100 THR CA C 100 63.489 66.375 -2.886 1
1 1175 . 9 1 1 A 100 100 THR CB C 100 67.909 69.016 -1.107 1
1 1177 . 9 1 1 A 100 100 THR N N 100 116.525 112.284 4.241 1
1 1178 . 9 1 1 A 101 101 HIS H H 101 8.753 8.147 0.606 1
1 1179 . 9 1 1 A 101 101 HIS HA H 101 4.898 4.138 0.760 1
1 1184 . 9 1 1 A 101 101 HIS C C 101 174.345 173.822 0.523 1
1 1185 . 9 1 1 A 101 101 HIS CA C 101 55.072 56.315 -1.243 1
1 1186 . 9 1 1 A 101 101 HIS CB C 101 32.835 27.778 5.057 1
1 1189 . 9 1 1 A 101 101 HIS N N 101 125.953 116.831 9.122 1
1 1190 . 9 1 1 A 102 102 TYR H H 102 9.023 8.973 0.050 1
1 1191 . 9 1 1 A 102 102 TYR HA H 102 4.545 5.105 -0.560 1
1 1198 . 9 1 1 A 102 102 TYR C C 102 174.126 175.102 -0.976 1
1 1199 . 9 1 1 A 102 102 TYR CA C 102 57.260 56.590 0.670 1
1 1200 . 9 1 1 A 102 102 TYR CB C 102 40.381 39.664 0.717 1
1 1205 . 9 1 1 A 102 102 TYR N N 102 121.975 120.534 1.441 1
1 1206 . 9 1 1 A 103 103 TYR H H 103 8.899 9.129 -0.230 1
1 1207 . 9 1 1 A 103 103 TYR HA H 103 4.729 4.864 -0.135 1
1 1214 . 9 1 1 A 103 103 TYR C C 103 174.139 176.029 -1.890 1
1 1215 . 9 1 1 A 103 103 TYR CA C 103 58.036 58.086 -0.050 1
1 1216 . 9 1 1 A 103 103 TYR CB C 103 40.485 39.373 1.112 1
1 1221 . 9 1 1 A 103 103 TYR N N 103 122.012 123.681 -1.669 1
1 1222 . 9 1 1 A 104 104 ILE H H 104 8.605 8.627 -0.022 1
1 1223 . 9 1 1 A 104 104 ILE HA H 104 4.859 4.839 0.020 1
1 1233 . 9 1 1 A 104 104 ILE C C 104 172.769 174.131 -1.362 1
1 1234 . 9 1 1 A 104 104 ILE CA C 104 59.554 59.588 -0.034 1
1 1235 . 9 1 1 A 104 104 ILE CB C 104 40.631 41.873 -1.242 1
1 1239 . 9 1 1 A 104 104 ILE N N 104 123.443 123.521 -0.078 1
1 1240 . 9 1 1 A 105 105 GLN H H 105 9.369 8.638 0.731 1
1 1241 . 9 1 1 A 105 105 GLN HA H 105 4.895 4.973 -0.078 1
1 1248 . 9 1 1 A 105 105 GLN C C 105 175.642 175.167 0.475 1
1 1249 . 9 1 1 A 105 105 GLN CA C 105 54.965 53.765 1.200 1
1 1250 . 9 1 1 A 105 105 GLN CB C 105 32.856 32.129 0.727 1
1 1252 . 9 1 1 A 105 105 GLN N N 105 125.079 124.016 1.063 1
1 1254 . 9 1 1 A 106 106 ALA H H 106 8.513 8.432 0.081 1
1 1255 . 9 1 1 A 106 106 ALA HA H 106 4.962 4.821 0.141 1
1 1259 . 9 1 1 A 106 106 ALA C C 106 175.854 177.950 -2.096 1
1 1260 . 9 1 1 A 106 106 ALA CA C 106 50.272 50.492 -0.220 1
1 1261 . 9 1 1 A 106 106 ALA CB C 106 21.197 21.741 -0.544 1
1 1262 . 9 1 1 A 106 106 ALA N N 106 129.303 127.791 1.512 1
1 1263 . 9 1 1 A 107 107 SER H H 107 9.468 9.095 0.373 1
1 1264 . 9 1 1 A 107 107 SER HA H 107 4.447 4.367 0.080 1
1 1267 . 9 1 1 A 107 107 SER C C 107 173.785 174.209 -0.424 1
1 1268 . 9 1 1 A 107 107 SER CA C 107 60.048 61.339 -1.291 1
1 1269 . 9 1 1 A 107 107 SER CB C 107 64.643 63.676 0.967 1
1 1270 . 9 1 1 A 107 107 SER N N 107 112.962 115.344 -2.382 1
1 1271 . 9 1 1 A 108 108 SER H H 108 7.555 7.940 -0.385 1
1 1272 . 9 1 1 A 108 108 SER HA H 108 4.665 4.835 -0.170 1
1 1275 . 9 1 1 A 108 108 SER C C 108 174.381 174.942 -0.561 1
1 1276 . 9 1 1 A 108 108 SER CA C 108 56.907 55.928 0.979 1
1 1277 . 9 1 1 A 108 108 SER CB C 108 66.370 67.018 -0.648 1
1 1278 . 9 1 1 A 108 108 SER N N 108 112.243 110.967 1.276 1
1 1279 . 9 1 1 A 109 109 LYS H H 109 8.978 8.724 0.254 1
1 1280 . 9 1 1 A 109 109 LYS HA H 109 4.777 3.953 0.824 1
1 1287 . 9 1 1 A 109 109 LYS C C 109 179.992 177.647 2.345 1
1 1288 . 9 1 1 A 109 109 LYS CA C 109 59.766 60.020 -0.254 1
1 1289 . 9 1 1 A 109 109 LYS CB C 109 32.342 32.109 0.233 1
1 1293 . 9 1 1 A 109 109 LYS N N 109 123.170 121.957 1.213 1
1 1294 . 9 1 1 A 110 110 ALA H H 110 8.608 7.751 0.857 1
1 1295 . 9 1 1 A 110 110 ALA HA H 110 4.178 4.069 0.109 1
1 1299 . 9 1 1 A 110 110 ALA C C 110 179.895 179.258 0.637 1
1 1300 . 9 1 1 A 110 110 ALA CA C 110 54.871 55.463 -0.592 1
1 1301 . 9 1 1 A 110 110 ALA CB C 110 18.065 18.622 -0.557 1
1 1302 . 9 1 1 A 110 110 ALA N N 110 123.750 121.485 2.265 1
1 1303 . 9 1 1 A 111 111 GLU H H 111 8.185 8.430 -0.245 1
1 1304 . 9 1 1 A 111 111 GLU HA H 111 4.180 4.088 0.092 1
1 1309 . 9 1 1 A 111 111 GLU C C 111 178.587 178.866 -0.279 1
1 1310 . 9 1 1 A 111 111 GLU CA C 111 59.466 59.791 -0.325 1
1 1311 . 9 1 1 A 111 111 GLU CB C 111 31.067 29.440 1.627 1
1 1313 . 9 1 1 A 111 111 GLU N N 111 119.757 118.596 1.161 1
1 1314 . 9 1 1 A 112 112 ARG H H 112 8.008 7.924 0.084 1
1 1315 . 9 1 1 A 112 112 ARG HA H 112 3.642 4.207 -0.565 1
1 1322 . 9 1 1 A 112 112 ARG C C 112 176.481 178.351 -1.870 1
1 1323 . 9 1 1 A 112 112 ARG CA C 112 60.419 59.643 0.776 1
1 1324 . 9 1 1 A 112 112 ARG CB C 112 29.957 30.273 -0.316 1
1 1327 . 9 1 1 A 112 112 ARG N N 112 118.430 119.756 -1.326 1
1 1328 . 9 1 1 A 113 113 ALA H H 113 7.985 7.673 0.312 1
1 1329 . 9 1 1 A 113 113 ALA HA H 113 3.925 4.079 -0.154 1
1 1333 . 9 1 1 A 113 113 ALA C C 113 180.117 179.772 0.345 1
1 1334 . 9 1 1 A 113 113 ALA CA C 113 55.372 55.127 0.245 1
1 1335 . 9 1 1 A 113 113 ALA CB C 113 17.825 18.590 -0.765 1
1 1336 . 9 1 1 A 113 113 ALA N N 113 119.980 120.652 -0.672 1
1 1337 . 9 1 1 A 114 114 GLU H H 114 8.093 8.168 -0.075 1
1 1338 . 9 1 1 A 114 114 GLU HA H 114 3.936 3.949 -0.013 1
1 1343 . 9 1 1 A 114 114 GLU C C 114 180.586 179.298 1.288 1
1 1344 . 9 1 1 A 114 114 GLU CA C 114 59.148 59.201 -0.053 1
1 1345 . 9 1 1 A 114 114 GLU CB C 114 30.080 29.157 0.923 1
1 1347 . 9 1 1 A 114 114 GLU N N 114 117.168 117.931 -0.763 1
1 1348 . 9 1 1 A 115 115 TRP H H 115 7.980 9.110 -1.130 1
1 1349 . 9 1 1 A 115 115 TRP HA H 115 3.775 4.400 -0.625 1
1 1358 . 9 1 1 A 115 115 TRP C C 115 177.714 178.591 -0.877 1
1 1359 . 9 1 1 A 115 115 TRP CA C 115 62.696 59.529 3.167 1
1 1360 . 9 1 1 A 115 115 TRP CB C 115 29.052 29.177 -0.125 1
1 1366 . 9 1 1 A 115 115 TRP N N 115 120.974 120.798 0.176 1
1 1368 . 9 1 1 A 116 116 ILE H H 116 8.297 8.674 -0.377 1
1 1369 . 9 1 1 A 116 116 ILE HA H 116 3.270 3.418 -0.148 1
1 1379 . 9 1 1 A 116 116 ILE C C 116 177.568 177.695 -0.127 1
1 1380 . 9 1 1 A 116 116 ILE CA C 116 66.643 64.645 1.998 1
1 1381 . 9 1 1 A 116 116 ILE CB C 116 37.606 37.526 0.080 1
1 1385 . 9 1 1 A 116 116 ILE N N 116 118.408 119.978 -1.570 1
1 1386 . 9 1 1 A 117 117 GLU H H 117 8.026 8.811 -0.785 1
1 1387 . 9 1 1 A 117 117 GLU HA H 117 3.880 3.951 -0.071 1
1 1392 . 9 1 1 A 117 117 GLU C C 117 178.476 179.023 -0.547 1
1 1393 . 9 1 1 A 117 117 GLU CA C 117 59.219 59.888 -0.669 1
1 1394 . 9 1 1 A 117 117 GLU CB C 117 29.381 29.624 -0.243 1
1 1396 . 9 1 1 A 117 117 GLU N N 117 117.096 120.259 -3.163 1
1 1397 . 9 1 1 A 118 118 ALA H H 118 7.555 8.184 -0.629 1
1 1398 . 9 1 1 A 118 118 ALA HA H 118 3.952 4.040 -0.088 1
1 1402 . 9 1 1 A 118 118 ALA C C 118 179.862 180.031 -0.169 1
1 1403 . 9 1 1 A 118 118 ALA CA C 118 54.772 55.040 -0.268 1
1 1404 . 9 1 1 A 118 118 ALA CB C 118 18.277 18.497 -0.220 1
1 1405 . 9 1 1 A 118 118 ALA N N 118 119.817 121.680 -1.863 1
1 1406 . 9 1 1 A 119 119 ILE H H 119 8.167 7.973 0.194 1
1 1407 . 9 1 1 A 119 119 ILE HA H 119 3.558 3.744 -0.186 1
1 1417 . 9 1 1 A 119 119 ILE C C 119 178.564 177.926 0.638 1
1 1418 . 9 1 1 A 119 119 ILE CA C 119 65.766 65.293 0.473 1
1 1419 . 9 1 1 A 119 119 ILE CB C 119 38.840 37.825 1.015 1
1 1423 . 9 1 1 A 119 119 ILE N N 119 116.280 117.999 -1.719 1
1 1424 . 9 1 1 A 120 120 LYS H H 120 8.790 8.096 0.694 1
1 1425 . 9 1 1 A 120 120 LYS HA H 120 3.965 4.266 -0.301 1
1 1434 . 9 1 1 A 120 120 LYS C C 120 179.673 179.321 0.352 1
1 1435 . 9 1 1 A 120 120 LYS CA C 120 60.031 60.150 -0.119 1
1 1436 . 9 1 1 A 120 120 LYS CB C 120 32.547 32.195 0.352 1
1 1440 . 9 1 1 A 120 120 LYS N N 120 119.650 118.772 0.878 1
1 1441 . 9 1 1 A 121 121 LYS H H 121 7.594 8.261 -0.667 1
1 1442 . 9 1 1 A 121 121 LYS HA H 121 4.095 3.935 0.160 1
1 1451 . 9 1 1 A 121 121 LYS C C 121 177.962 179.196 -1.234 1
1 1452 . 9 1 1 A 121 121 LYS CA C 121 58.848 59.230 -0.382 1
1 1453 . 9 1 1 A 121 121 LYS CB C 121 32.547 32.243 0.304 1
1 1457 . 9 1 1 A 121 121 LYS N N 121 117.197 119.725 -2.528 1
1 1458 . 9 1 1 A 122 122 LEU H H 122 7.586 7.757 -0.171 1
1 1459 . 9 1 1 A 122 122 LEU HA H 122 4.535 3.976 0.559 1
1 1469 . 9 1 1 A 122 122 LEU C C 122 177.902 178.062 -0.160 1
1 1470 . 9 1 1 A 122 122 LEU CA C 122 55.071 57.951 -2.880 1
1 1471 . 9 1 1 A 122 122 LEU CB C 122 42.888 41.818 1.070 1
1 1475 . 9 1 1 A 122 122 LEU N N 122 116.861 120.152 -3.291 1
1 1476 . 9 1 1 A 123 123 THR H H 123 7.636 7.891 -0.255 1
1 1477 . 9 1 1 A 123 123 THR HA H 123 4.445 4.316 0.129 1
1 1482 . 9 1 1 A 123 123 THR C C 123 175.714 173.899 1.815 1
1 1483 . 9 1 1 A 123 123 THR CA C 123 62.643 61.559 1.084 1
1 1484 . 9 1 1 A 123 123 THR CB C 123 70.259 67.981 2.278 1
1 1486 . 9 1 1 A 123 123 THR N N 123 108.963 107.938 1.025 1
1 1487 . 9 1 1 A 124 124 SER H H 124 7.912 8.209 -0.297 1
1 1488 . 9 1 1 A 124 124 SER HA H 124 4.626 4.759 -0.133 1
1 1491 . 9 1 1 A 124 124 SER C C 124 174.405 173.558 0.847 1
1 1492 . 9 1 1 A 124 124 SER CA C 124 58.390 57.206 1.184 1
1 1493 . 9 1 1 A 124 124 SER CB C 124 64.255 66.138 -1.883 1
1 1494 . 9 1 1 A 124 124 SER N N 124 116.876 119.907 -3.031 1
1 1495 . 9 1 1 A 125 125 GLY H H 125 8.307 8.566 -0.259 1
1 1496 . 9 1 1 A 125 125 GLY HA2 H 125 4.166 4.069 0.097 1
1 1497 . 9 1 1 A 125 125 GLY HA3 H 125 4.166 4.073 0.093 1
1 1498 . 9 1 1 A 125 125 GLY C C 125 171.921 173.523 -1.602 1
1 1499 . 9 1 1 A 125 125 GLY CA C 125 44.748 44.438 0.310 1
1 1500 . 9 1 1 A 125 125 GLY N N 125 110.006 110.759 -0.753 1
1 1501 . 9 1 1 A 126 126 PRO HA H 126 4.510 4.637 -0.127 1
1 1508 . 9 1 1 A 126 126 PRO C C 126 177.471 176.007 1.464 1
1 1509 . 9 1 1 A 126 126 PRO CA C 126 63.419 62.747 0.672 1
1 1510 . 9 1 1 A 126 126 PRO CB C 126 32.106 32.258 -0.152 1
1 1513 . 9 1 1 A 127 127 SER H H 127 8.607 8.762 -0.155 1
1 1514 . 9 1 1 A 127 127 SER C C 127 174.628 172.996 1.632 1
1 1515 . 9 1 1 A 127 127 SER CA C 127 58.513 57.570 0.943 1
1 1516 . 9 1 1 A 127 127 SER CB C 127 63.679 66.189 -2.510 1
1 1517 . 9 1 1 A 127 127 SER N N 127 116.390 119.492 -3.102 1
1 1518 . 9 1 1 A 128 128 SER H H 128 8.272 8.512 -0.240 1
1 1519 . 9 1 1 A 128 128 SER HA H 128 4.496 5.239 -0.743 1
1 1520 . 9 1 1 A 128 128 SER C C 128 173.921 174.254 -0.333 1
1 1521 . 9 1 1 A 128 128 SER CA C 128 58.442 56.963 1.479 1
1 1522 . 9 1 1 A 128 128 SER CB C 128 64.173 64.681 -0.508 1
1 1523 . 9 1 1 A 128 128 SER N N 128 117.506 116.233 1.273 1
1 1 . 10 1 1 A 7 7 GLY HA2 H 7 3.978 3.897 0.081 1
1 2 . 10 1 1 A 7 7 GLY HA3 H 7 3.978 3.898 0.080 1
1 3 . 10 1 1 A 7 7 GLY C C 7 174.274 173.483 0.791 1
1 4 . 10 1 1 A 7 7 GLY CA C 7 45.383 47.156 -1.773 1
1 5 . 10 1 1 A 8 8 SER H H 8 8.211 7.848 0.363 1
1 6 . 10 1 1 A 8 8 SER HA H 8 4.425 4.786 -0.361 1
1 9 . 10 1 1 A 8 8 SER C C 8 174.635 172.655 1.980 1
1 10 . 10 1 1 A 8 8 SER CA C 8 58.425 57.517 0.908 1
1 11 . 10 1 1 A 8 8 SER CB C 8 63.885 64.671 -0.786 1
1 12 . 10 1 1 A 8 8 SER N N 8 115.732 113.672 2.060 1
1 13 . 10 1 1 A 9 9 LEU H H 9 8.316 8.731 -0.415 1
1 14 . 10 1 1 A 9 9 LEU HA H 9 4.334 4.502 -0.168 1
1 24 . 10 1 1 A 9 9 LEU C C 9 177.447 176.416 1.031 1
1 25 . 10 1 1 A 9 9 LEU CA C 9 55.407 56.313 -0.906 1
1 26 . 10 1 1 A 9 9 LEU CB C 9 42.171 43.929 -1.758 1
1 30 . 10 1 1 A 9 9 LEU N N 9 123.943 128.740 -4.797 1
1 31 . 10 1 1 A 10 10 SER H H 10 8.304 8.092 0.212 1
1 32 . 10 1 1 A 10 10 SER HA H 10 4.424 4.549 -0.125 1
1 35 . 10 1 1 A 10 10 SER C C 10 175.025 173.716 1.309 1
1 36 . 10 1 1 A 10 10 SER CA C 10 58.425 59.972 -1.547 1
1 37 . 10 1 1 A 10 10 SER CB C 10 63.638 62.417 1.221 1
1 38 . 10 1 1 A 10 10 SER N N 10 116.718 113.312 3.406 1
1 39 . 10 1 1 A 11 11 THR H H 11 8.003 8.653 -0.650 1
1 40 . 10 1 1 A 11 11 THR HA H 11 4.196 4.395 -0.199 1
1 45 . 10 1 1 A 11 11 THR C C 11 176.296 174.380 1.916 1
1 46 . 10 1 1 A 11 11 THR CA C 11 62.483 63.545 -1.062 1
1 47 . 10 1 1 A 11 11 THR CB C 11 69.266 69.424 -0.158 1
1 49 . 10 1 1 A 11 11 THR N N 11 114.902 118.858 -3.956 1
1 50 . 10 1 1 A 12 12 VAL H H 12 8.095 8.583 -0.488 1
1 51 . 10 1 1 A 12 12 VAL HA H 12 3.826 4.287 -0.461 1
1 59 . 10 1 1 A 12 12 VAL C C 12 178.501 177.174 1.327 1
1 60 . 10 1 1 A 12 12 VAL CA C 12 64.760 63.825 0.935 1
1 61 . 10 1 1 A 12 12 VAL CB C 12 32.013 33.667 -1.654 1
1 64 . 10 1 1 A 12 12 VAL N N 12 122.111 123.231 -1.120 1
1 65 . 10 1 1 A 13 13 GLU H H 13 8.151 8.840 -0.689 1
1 66 . 10 1 1 A 13 13 GLU HA H 13 3.244 4.420 -1.176 1
1 71 . 10 1 1 A 13 13 GLU C C 13 175.702 178.469 -2.767 1
1 72 . 10 1 1 A 13 13 GLU CA C 13 58.354 59.463 -1.109 1
1 73 . 10 1 1 A 13 13 GLU CB C 13 28.843 29.114 -0.271 1
1 75 . 10 1 1 A 13 13 GLU N N 13 120.316 122.314 -1.998 1
1 76 . 10 1 1 A 14 14 LEU H H 14 7.067 7.666 -0.599 1
1 77 . 10 1 1 A 14 14 LEU HA H 14 4.157 4.357 -0.200 1
1 87 . 10 1 1 A 14 14 LEU C C 14 176.863 176.656 0.207 1
1 88 . 10 1 1 A 14 14 LEU CA C 14 53.324 54.364 -1.040 1
1 89 . 10 1 1 A 14 14 LEU CB C 14 41.636 41.161 0.475 1
1 93 . 10 1 1 A 14 14 LEU N N 14 117.035 118.818 -1.783 1
1 94 . 10 1 1 A 15 15 SER H H 15 7.645 7.677 -0.032 1
1 95 . 10 1 1 A 15 15 SER HA H 15 4.305 4.608 -0.303 1
1 98 . 10 1 1 A 15 15 SER C C 15 175.340 172.996 2.344 1
1 99 . 10 1 1 A 15 15 SER CA C 15 59.783 57.597 2.186 1
1 100 . 10 1 1 A 15 15 SER CB C 15 64.625 61.631 2.994 1
1 101 . 10 1 1 A 15 15 SER N N 15 114.216 116.703 -2.487 1
1 102 . 10 1 1 A 16 16 GLY H H 16 8.506 8.384 0.122 1
1 103 . 10 1 1 A 16 16 GLY HA2 H 16 4.237 4.360 -0.123 1
1 104 . 10 1 1 A 16 16 GLY HA3 H 16 3.927 4.374 -0.447 1
1 105 . 10 1 1 A 16 16 GLY C C 16 173.661 172.110 1.551 1
1 106 . 10 1 1 A 16 16 GLY CA C 16 44.995 44.160 0.835 1
1 107 . 10 1 1 A 16 16 GLY N N 16 111.838 111.246 0.592 1
1 108 . 10 1 1 A 17 17 THR H H 17 8.482 9.151 -0.669 1
1 109 . 10 1 1 A 17 17 THR HA H 17 4.319 4.319 0.000 1
1 114 . 10 1 1 A 17 17 THR C C 17 174.758 174.340 0.418 1
1 115 . 10 1 1 A 17 17 THR CA C 17 62.272 63.486 -1.214 1
1 116 . 10 1 1 A 17 17 THR CB C 17 70.706 69.015 1.691 1
1 118 . 10 1 1 A 17 17 THR N N 17 116.679 115.162 1.517 1
1 119 . 10 1 1 A 18 18 VAL H H 18 8.948 8.747 0.201 1
1 120 . 10 1 1 A 18 18 VAL HA H 18 3.950 4.276 -0.326 1
1 128 . 10 1 1 A 18 18 VAL C C 18 176.669 176.877 -0.208 1
1 129 . 10 1 1 A 18 18 VAL CA C 18 64.813 63.623 1.190 1
1 130 . 10 1 1 A 18 18 VAL CB C 18 31.807 31.628 0.179 1
1 133 . 10 1 1 A 18 18 VAL N N 18 127.156 127.642 -0.486 1
1 134 . 10 1 1 A 19 19 VAL H H 19 9.359 9.412 -0.053 1
1 135 . 10 1 1 A 19 19 VAL HA H 19 4.234 4.396 -0.162 1
1 143 . 10 1 1 A 19 19 VAL C C 19 175.738 175.797 -0.059 1
1 144 . 10 1 1 A 19 19 VAL CA C 19 62.060 62.047 0.013 1
1 145 . 10 1 1 A 19 19 VAL CB C 19 33.822 33.435 0.387 1
1 148 . 10 1 1 A 19 19 VAL N N 19 125.162 121.772 3.390 1
1 149 . 10 1 1 A 20 20 LYS H H 20 7.584 7.430 0.154 1
1 150 . 10 1 1 A 20 20 LYS HA H 20 4.346 4.508 -0.162 1
1 159 . 10 1 1 A 20 20 LYS C C 20 172.818 173.997 -1.179 1
1 160 . 10 1 1 A 20 20 LYS CA C 20 56.801 55.536 1.265 1
1 161 . 10 1 1 A 20 20 LYS CB C 20 36.624 35.579 1.045 1
1 165 . 10 1 1 A 20 20 LYS N N 20 121.024 121.013 0.011 1
1 166 . 10 1 1 A 21 21 GLN H H 21 8.625 8.559 0.066 1
1 167 . 10 1 1 A 21 21 GLN HA H 21 6.003 5.372 0.631 1
1 174 . 10 1 1 A 21 21 GLN C C 21 174.914 174.923 -0.009 1
1 175 . 10 1 1 A 21 21 GLN CA C 21 54.207 54.711 -0.504 1
1 176 . 10 1 1 A 21 21 GLN CB C 21 33.452 33.705 -0.253 1
1 178 . 10 1 1 A 21 21 GLN N N 21 122.108 124.147 -2.039 1
1 180 . 10 1 1 A 22 22 GLY H H 22 8.964 8.297 0.667 1
1 181 . 10 1 1 A 22 22 GLY HA2 H 22 4.665 4.456 0.209 1
1 182 . 10 1 1 A 22 22 GLY HA3 H 22 4.295 4.629 -0.334 1
1 183 . 10 1 1 A 22 22 GLY C C 22 170.879 171.761 -0.882 1
1 184 . 10 1 1 A 22 22 GLY CA C 22 45.683 45.991 -0.308 1
1 185 . 10 1 1 A 22 22 GLY N N 22 108.508 109.013 -0.505 1
1 186 . 10 1 1 A 23 23 TYR H H 23 9.145 8.767 0.378 1
1 187 . 10 1 1 A 23 23 TYR HA H 23 5.595 5.473 0.122 1
1 194 . 10 1 1 A 23 23 TYR C C 23 175.824 175.305 0.519 1
1 195 . 10 1 1 A 23 23 TYR CA C 23 58.019 56.739 1.280 1
1 196 . 10 1 1 A 23 23 TYR CB C 23 39.251 40.958 -1.707 1
1 201 . 10 1 1 A 23 23 TYR N N 23 120.809 120.083 0.726 1
1 202 . 10 1 1 A 24 24 LEU H H 24 8.935 9.602 -0.667 1
1 203 . 10 1 1 A 24 24 LEU HA H 24 4.716 5.110 -0.394 1
1 213 . 10 1 1 A 24 24 LEU C C 24 174.648 176.240 -1.592 1
1 214 . 10 1 1 A 24 24 LEU CA C 24 53.907 53.238 0.669 1
1 215 . 10 1 1 A 24 24 LEU CB C 24 46.078 44.877 1.201 1
1 219 . 10 1 1 A 24 24 LEU N N 24 122.887 124.708 -1.821 1
1 220 . 10 1 1 A 25 25 ALA H H 25 8.145 8.644 -0.499 1
1 221 . 10 1 1 A 25 25 ALA HA H 25 5.477 5.633 -0.156 1
1 225 . 10 1 1 A 25 25 ALA C C 25 175.751 175.576 0.175 1
1 226 . 10 1 1 A 25 25 ALA CA C 25 50.719 50.583 0.136 1
1 227 . 10 1 1 A 25 25 ALA CB C 25 21.074 20.522 0.552 1
1 228 . 10 1 1 A 25 25 ALA N N 25 122.280 123.347 -1.067 1
1 229 . 10 1 1 A 26 26 LYS H H 26 9.167 8.742 0.425 1
1 230 . 10 1 1 A 26 26 LYS HA H 26 5.221 4.539 0.682 1
1 239 . 10 1 1 A 26 26 LYS C C 26 175.421 175.425 -0.004 1
1 240 . 10 1 1 A 26 26 LYS CA C 26 54.383 55.166 -0.783 1
1 241 . 10 1 1 A 26 26 LYS CB C 26 36.125 33.894 2.231 1
1 245 . 10 1 1 A 26 26 LYS N N 26 120.638 125.405 -4.767 1
1 246 . 10 1 1 A 27 27 GLN H H 27 7.866 7.989 -0.123 1
1 247 . 10 1 1 A 27 27 GLN HA H 27 3.525 4.219 -0.694 1
1 254 . 10 1 1 A 27 27 GLN C C 27 177.022 175.363 1.659 1
1 255 . 10 1 1 A 27 27 GLN CA C 27 55.778 54.381 1.397 1
1 256 . 10 1 1 A 27 27 GLN CB C 27 29.864 28.605 1.259 1
1 258 . 10 1 1 A 27 27 GLN N N 27 130.194 127.191 3.003 1
1 260 . 10 1 1 A 28 28 GLY H H 28 8.565 8.663 -0.098 1
1 261 . 10 1 1 A 28 28 GLY HA2 H 28 4.125 4.142 -0.017 1
1 262 . 10 1 1 A 28 28 GLY HA3 H 28 4.034 4.166 -0.132 1
1 263 . 10 1 1 A 28 28 GLY C C 28 174.030 172.020 2.010 1
1 264 . 10 1 1 A 28 28 GLY CA C 28 45.665 43.945 1.720 1
1 265 . 10 1 1 A 28 28 GLY N N 28 115.528 113.096 2.432 1
1 266 . 10 1 1 A 29 29 HIS HA H 29 4.355 4.832 -0.477 1
1 271 . 10 1 1 A 29 29 HIS CA C 29 58.795 54.805 3.990 1
1 272 . 10 1 1 A 29 29 HIS CB C 29 31.283 30.188 1.095 1
1 275 . 10 1 1 A 30 30 LYS HA H 30 4.096 4.606 -0.510 1
1 284 . 10 1 1 A 30 30 LYS CA C 30 57.290 55.751 1.539 1
1 285 . 10 1 1 A 30 30 LYS CB C 30 31.951 36.109 -4.158 1
1 289 . 10 1 1 A 31 31 ARG HA H 31 3.975 3.975 0.000 1
1 296 . 10 1 1 A 31 31 ARG CA C 31 55.973 59.987 -4.014 1
1 297 . 10 1 1 A 31 31 ARG CB C 31 29.902 30.174 -0.272 1
1 300 . 10 1 1 A 32 32 LYS HA H 32 4.160 4.222 -0.062 1
1 309 . 10 1 1 A 32 32 LYS C C 32 175.678 176.351 -0.673 1
1 310 . 10 1 1 A 32 32 LYS CA C 32 56.254 56.574 -0.320 1
1 311 . 10 1 1 A 32 32 LYS CB C 32 31.602 33.124 -1.522 1
1 315 . 10 1 1 A 33 33 ASN H H 33 7.925 8.483 -0.558 1
1 316 . 10 1 1 A 33 33 ASN HA H 33 4.799 5.057 -0.258 1
1 321 . 10 1 1 A 33 33 ASN C C 33 174.005 175.310 -1.305 1
1 322 . 10 1 1 A 33 33 ASN CA C 33 52.407 51.868 0.539 1
1 323 . 10 1 1 A 33 33 ASN CB C 33 39.879 39.103 0.776 1
1 324 . 10 1 1 A 33 33 ASN N N 33 116.990 118.570 -1.580 1
1 326 . 10 1 1 A 34 34 TRP H H 34 8.798 8.763 0.035 1
1 327 . 10 1 1 A 34 34 TRP HA H 34 4.755 4.684 0.071 1
1 336 . 10 1 1 A 34 34 TRP C C 34 176.090 175.960 0.130 1
1 337 . 10 1 1 A 34 34 TRP CA C 34 57.119 58.443 -1.324 1
1 338 . 10 1 1 A 34 34 TRP CB C 34 30.596 30.504 0.092 1
1 344 . 10 1 1 A 34 34 TRP N N 34 121.917 120.243 1.674 1
1 346 . 10 1 1 A 35 35 LYS H H 35 8.404 8.713 -0.309 1
1 347 . 10 1 1 A 35 35 LYS HA H 35 4.846 5.098 -0.252 1
1 354 . 10 1 1 A 35 35 LYS C C 35 176.088 175.515 0.573 1
1 355 . 10 1 1 A 35 35 LYS CA C 35 54.418 54.607 -0.189 1
1 356 . 10 1 1 A 35 35 LYS CB C 35 36.125 35.478 0.647 1
1 360 . 10 1 1 A 35 35 LYS N N 35 120.864 119.578 1.286 1
1 361 . 10 1 1 A 36 36 VAL H H 36 8.977 8.694 0.283 1
1 362 . 10 1 1 A 36 36 VAL HA H 36 4.274 4.637 -0.363 1
1 370 . 10 1 1 A 36 36 VAL C C 36 176.733 175.529 1.204 1
1 371 . 10 1 1 A 36 36 VAL CA C 36 64.319 62.491 1.828 1
1 372 . 10 1 1 A 36 36 VAL CB C 36 31.602 31.781 -0.179 1
1 375 . 10 1 1 A 36 36 VAL N N 36 124.314 124.154 0.160 1
1 376 . 10 1 1 A 37 37 ARG H H 37 9.498 10.538 -1.040 1
1 377 . 10 1 1 A 37 37 ARG HA H 37 5.053 5.260 -0.207 1
1 384 . 10 1 1 A 37 37 ARG C C 37 174.442 174.950 -0.508 1
1 385 . 10 1 1 A 37 37 ARG CA C 37 53.272 54.350 -1.078 1
1 386 . 10 1 1 A 37 37 ARG CB C 37 34.563 33.882 0.681 1
1 389 . 10 1 1 A 37 37 ARG N N 37 128.121 128.016 0.105 1
1 390 . 10 1 1 A 38 38 ARG H H 38 8.755 8.897 -0.142 1
1 391 . 10 1 1 A 38 38 ARG HA H 38 4.626 4.365 0.261 1
1 398 . 10 1 1 A 38 38 ARG C C 38 175.514 175.223 0.291 1
1 399 . 10 1 1 A 38 38 ARG CA C 38 55.601 56.073 -0.472 1
1 400 . 10 1 1 A 38 38 ARG CB C 38 32.219 30.541 1.678 1
1 403 . 10 1 1 A 38 38 ARG N N 38 121.442 126.673 -5.231 1
1 404 . 10 1 1 A 39 39 PHE H H 39 9.865 8.807 1.058 1
1 405 . 10 1 1 A 39 39 PHE HA H 39 5.424 5.036 0.388 1
1 413 . 10 1 1 A 39 39 PHE C C 39 175.423 174.862 0.561 1
1 414 . 10 1 1 A 39 39 PHE CA C 39 57.419 57.016 0.403 1
1 415 . 10 1 1 A 39 39 PHE CB C 39 42.623 41.349 1.274 1
1 421 . 10 1 1 A 39 39 PHE N N 39 130.027 126.448 3.579 1
1 422 . 10 1 1 A 40 40 VAL H H 40 9.300 9.661 -0.361 1
1 423 . 10 1 1 A 40 40 VAL HA H 40 4.846 5.327 -0.481 1
1 431 . 10 1 1 A 40 40 VAL C C 40 174.477 173.158 1.319 1
1 432 . 10 1 1 A 40 40 VAL CA C 40 62.343 59.943 2.400 1
1 433 . 10 1 1 A 40 40 VAL CB C 40 35.755 35.083 0.672 1
1 436 . 10 1 1 A 40 40 VAL N N 40 119.369 121.256 -1.887 1
1 437 . 10 1 1 A 41 41 LEU H H 41 9.557 10.117 -0.560 1
1 438 . 10 1 1 A 41 41 LEU HA H 41 5.292 5.471 -0.179 1
1 448 . 10 1 1 A 41 41 LEU C C 41 174.632 175.319 -0.687 1
1 449 . 10 1 1 A 41 41 LEU CA C 41 53.571 53.725 -0.154 1
1 450 . 10 1 1 A 41 41 LEU CB C 41 45.337 44.623 0.714 1
1 454 . 10 1 1 A 41 41 LEU N N 41 132.121 129.680 2.441 1
1 455 . 10 1 1 A 42 42 ARG H H 42 9.396 8.828 0.568 1
1 456 . 10 1 1 A 42 42 ARG HA H 42 5.366 5.440 -0.074 1
1 464 . 10 1 1 A 42 42 ARG C C 42 173.997 174.782 -0.785 1
1 465 . 10 1 1 A 42 42 ARG CA C 42 54.631 54.146 0.485 1
1 466 . 10 1 1 A 42 42 ARG CB C 42 35.550 34.408 1.142 1
1 469 . 10 1 1 A 42 42 ARG N N 42 128.120 124.688 3.432 1
1 471 . 10 1 1 A 43 43 LYS H H 43 8.597 9.058 -0.461 1
1 472 . 10 1 1 A 43 43 LYS HA H 43 4.558 4.885 -0.327 1
1 481 . 10 1 1 A 43 43 LYS C C 43 174.648 175.211 -0.563 1
1 482 . 10 1 1 A 43 43 LYS CA C 43 53.378 54.790 -1.412 1
1 483 . 10 1 1 A 43 43 LYS CB C 43 37.303 35.885 1.418 1
1 487 . 10 1 1 A 43 43 LYS N N 43 114.484 117.653 -3.169 1
1 488 . 10 1 1 A 44 44 ASP H H 44 8.388 8.933 -0.545 1
1 489 . 10 1 1 A 44 44 ASP HA H 44 4.349 4.190 0.159 1
1 492 . 10 1 1 A 44 44 ASP C C 44 173.376 174.250 -0.874 1
1 493 . 10 1 1 A 44 44 ASP CA C 44 54.842 54.889 -0.047 1
1 494 . 10 1 1 A 44 44 ASP CB C 44 39.991 39.552 0.439 1
1 495 . 10 1 1 A 44 44 ASP N N 44 115.453 119.398 -3.945 1
1 496 . 10 1 1 A 45 45 PRO HA H 45 4.652 4.447 0.205 1
1 503 . 10 1 1 A 45 45 PRO C C 45 176.914 175.214 1.700 1
1 504 . 10 1 1 A 45 45 PRO CA C 45 63.490 62.403 1.087 1
1 505 . 10 1 1 A 45 45 PRO CB C 45 34.892 32.522 2.370 1
1 508 . 10 1 1 A 46 46 ALA H H 46 8.112 7.959 0.153 1
1 509 . 10 1 1 A 46 46 ALA HA H 46 5.455 4.601 0.854 1
1 513 . 10 1 1 A 46 46 ALA C C 46 177.234 176.654 0.580 1
1 514 . 10 1 1 A 46 46 ALA CA C 46 51.560 50.508 1.052 1
1 515 . 10 1 1 A 46 46 ALA CB C 46 20.122 19.521 0.601 1
1 516 . 10 1 1 A 46 46 ALA N N 46 120.155 122.909 -2.754 1
1 517 . 10 1 1 A 47 47 PHE H H 47 8.717 8.915 -0.198 1
1 518 . 10 1 1 A 47 47 PHE HA H 47 4.795 4.958 -0.163 1
1 526 . 10 1 1 A 47 47 PHE C C 47 172.588 174.284 -1.696 1
1 527 . 10 1 1 A 47 47 PHE CA C 47 57.348 56.405 0.943 1
1 528 . 10 1 1 A 47 47 PHE CB C 47 47.123 43.833 3.290 1
1 534 . 10 1 1 A 47 47 PHE N N 47 129.946 120.067 9.879 1
1 535 . 10 1 1 A 48 48 LEU H H 48 7.883 8.198 -0.315 1
1 536 . 10 1 1 A 48 48 LEU HA H 48 5.198 5.337 -0.139 1
1 546 . 10 1 1 A 48 48 LEU C C 48 173.569 174.422 -0.853 1
1 547 . 10 1 1 A 48 48 LEU CA C 48 53.290 53.644 -0.354 1
1 548 . 10 1 1 A 48 48 LEU CB C 48 45.502 45.008 0.494 1
1 552 . 10 1 1 A 48 48 LEU N N 48 121.108 123.187 -2.079 1
1 553 . 10 1 1 A 49 49 HIS H H 49 8.606 8.938 -0.332 1
1 554 . 10 1 1 A 49 49 HIS HA H 49 5.035 4.899 0.136 1
1 559 . 10 1 1 A 49 49 HIS C C 49 173.993 173.738 0.255 1
1 560 . 10 1 1 A 49 49 HIS CA C 49 56.483 53.988 2.495 1
1 561 . 10 1 1 A 49 49 HIS CB C 49 35.919 33.587 2.332 1
1 564 . 10 1 1 A 49 49 HIS N N 49 121.199 125.825 -4.626 1
1 565 . 10 1 1 A 50 50 TYR H H 50 7.777 7.900 -0.123 1
1 566 . 10 1 1 A 50 50 TYR HA H 50 5.695 5.651 0.044 1
1 573 . 10 1 1 A 50 50 TYR C C 50 174.284 172.346 1.938 1
1 574 . 10 1 1 A 50 50 TYR CA C 50 53.430 54.940 -1.510 1
1 575 . 10 1 1 A 50 50 TYR CB C 50 38.552 40.822 -2.270 1
1 580 . 10 1 1 A 50 50 TYR N N 50 114.156 117.327 -3.171 1
1 581 . 10 1 1 A 51 51 TYR H H 51 9.323 8.807 0.516 1
1 582 . 10 1 1 A 51 51 TYR HA H 51 4.600 4.953 -0.353 1
1 589 . 10 1 1 A 51 51 TYR C C 51 175.352 174.174 1.178 1
1 590 . 10 1 1 A 51 51 TYR CA C 51 57.330 56.568 0.762 1
1 591 . 10 1 1 A 51 51 TYR CB C 51 41.683 42.622 -0.939 1
1 596 . 10 1 1 A 51 51 TYR N N 51 119.100 117.970 1.130 1
1 597 . 10 1 1 A 52 52 ASP H H 52 9.375 8.664 0.711 1
1 598 . 10 1 1 A 52 52 ASP HA H 52 5.064 4.877 0.187 1
1 601 . 10 1 1 A 52 52 ASP C C 52 175.484 176.319 -0.835 1
1 602 . 10 1 1 A 52 52 ASP CA C 52 51.313 51.504 -0.191 1
1 603 . 10 1 1 A 52 52 ASP CB C 52 41.883 41.990 -0.107 1
1 604 . 10 1 1 A 52 52 ASP N N 52 124.636 124.334 0.302 1
1 605 . 10 1 1 A 53 53 PRO HA H 53 4.678 4.477 0.201 1
1 612 . 10 1 1 A 53 53 PRO C C 53 176.781 177.756 -0.975 1
1 613 . 10 1 1 A 53 53 PRO CA C 53 64.054 64.860 -0.806 1
1 614 . 10 1 1 A 53 53 PRO CB C 53 32.589 32.248 0.341 1
1 617 . 10 1 1 A 54 54 SER H H 54 8.685 8.308 0.377 1
1 618 . 10 1 1 A 54 54 SER HA H 54 4.483 4.221 0.262 1
1 621 . 10 1 1 A 54 54 SER C C 54 174.006 174.622 -0.616 1
1 622 . 10 1 1 A 54 54 SER CA C 54 59.378 61.154 -1.776 1
1 623 . 10 1 1 A 54 54 SER CB C 54 64.132 63.103 1.029 1
1 624 . 10 1 1 A 54 54 SER N N 54 113.769 111.967 1.802 1
1 625 . 10 1 1 A 55 55 LYS H H 55 7.706 7.878 -0.172 1
1 626 . 10 1 1 A 55 55 LYS HA H 55 4.580 4.740 -0.160 1
1 635 . 10 1 1 A 55 55 LYS C C 55 175.969 175.847 0.122 1
1 636 . 10 1 1 A 55 55 LYS CA C 55 55.160 54.799 0.361 1
1 637 . 10 1 1 A 55 55 LYS CB C 55 34.069 34.281 -0.212 1
1 641 . 10 1 1 A 55 55 LYS N N 55 122.222 120.436 1.786 1
1 642 . 10 1 1 A 56 56 GLU H H 56 8.666 8.590 0.076 1
1 643 . 10 1 1 A 56 56 GLU HA H 56 4.174 4.781 -0.607 1
1 648 . 10 1 1 A 56 56 GLU C C 56 177.084 174.718 2.366 1
1 649 . 10 1 1 A 56 56 GLU CA C 56 57.099 55.574 1.525 1
1 650 . 10 1 1 A 56 56 GLU CB C 56 29.694 30.630 -0.936 1
1 652 . 10 1 1 A 56 56 GLU N N 56 122.015 119.467 2.548 1
1 653 . 10 1 1 A 57 57 GLU H H 57 8.303 8.421 -0.118 1
1 654 . 10 1 1 A 57 57 GLU HA H 57 4.214 4.896 -0.682 1
1 659 . 10 1 1 A 57 57 GLU CA C 57 56.960 54.998 1.962 1
1 660 . 10 1 1 A 57 57 GLU CB C 57 30.264 33.391 -3.127 1
1 662 . 10 1 1 A 57 57 GLU N N 57 119.884 124.402 -4.518 1
1 663 . 10 1 1 A 58 58 ASN HA H 58 4.768 4.674 0.094 1
1 668 . 10 1 1 A 58 58 ASN C C 58 174.902 175.598 -0.696 1
1 669 . 10 1 1 A 58 58 ASN CA C 58 52.740 54.819 -2.079 1
1 670 . 10 1 1 A 58 58 ASN CB C 58 38.116 39.716 -1.600 1
1 672 . 10 1 1 A 59 59 ARG H H 59 7.805 7.634 0.171 1
1 673 . 10 1 1 A 59 59 ARG HA H 59 4.762 4.541 0.221 1
1 680 . 10 1 1 A 59 59 ARG CA C 59 53.151 54.630 -1.479 1
1 681 . 10 1 1 A 59 59 ARG CB C 59 31.519 29.905 1.614 1
1 684 . 10 1 1 A 59 59 ARG N N 59 121.060 119.883 1.177 1
1 685 . 10 1 1 A 60 60 PRO HA H 60 3.357 4.113 -0.756 1
1 692 . 10 1 1 A 60 60 PRO C C 60 176.817 176.729 0.088 1
1 693 . 10 1 1 A 60 60 PRO CA C 60 63.031 61.823 1.208 1
1 694 . 10 1 1 A 60 60 PRO CB C 60 31.273 31.883 -0.610 1
1 697 . 10 1 1 A 61 61 VAL H H 61 8.627 7.900 0.727 1
1 698 . 10 1 1 A 61 61 VAL HA H 61 3.966 3.807 0.159 1
1 706 . 10 1 1 A 61 61 VAL C C 61 176.503 176.240 0.263 1
1 707 . 10 1 1 A 61 61 VAL CA C 61 63.154 64.588 -1.434 1
1 708 . 10 1 1 A 61 61 VAL CB C 61 32.048 32.457 -0.409 1
1 711 . 10 1 1 A 61 61 VAL N N 61 119.185 120.387 -1.202 1
1 712 . 10 1 1 A 62 62 GLY H H 62 6.715 6.589 0.126 1
1 713 . 10 1 1 A 62 62 GLY HA2 H 62 3.940 3.919 0.021 1
1 714 . 10 1 1 A 62 62 GLY HA3 H 62 3.538 4.013 -0.475 1
1 715 . 10 1 1 A 62 62 GLY C C 62 169.983 171.734 -1.751 1
1 716 . 10 1 1 A 62 62 GLY CA C 62 44.465 45.712 -1.247 1
1 717 . 10 1 1 A 62 62 GLY N N 62 105.813 105.870 -0.057 1
1 718 . 10 1 1 A 63 63 GLY H H 63 8.004 8.632 -0.628 1
1 719 . 10 1 1 A 63 63 GLY HA2 H 63 4.095 3.180 0.915 1
1 720 . 10 1 1 A 63 63 GLY HA3 H 63 3.813 3.548 0.265 1
1 721 . 10 1 1 A 63 63 GLY C C 63 171.870 172.406 -0.536 1
1 722 . 10 1 1 A 63 63 GLY CA C 63 47.148 44.432 2.716 1
1 723 . 10 1 1 A 63 63 GLY N N 63 105.089 107.637 -2.548 1
1 724 . 10 1 1 A 64 64 PHE H H 64 7.967 7.406 0.561 1
1 725 . 10 1 1 A 64 64 PHE HA H 64 4.934 5.554 -0.620 1
1 733 . 10 1 1 A 64 64 PHE C C 64 173.140 174.746 -1.606 1
1 734 . 10 1 1 A 64 64 PHE CA C 64 55.248 55.078 0.170 1
1 735 . 10 1 1 A 64 64 PHE CB C 64 40.238 42.411 -2.173 1
1 741 . 10 1 1 A 64 64 PHE N N 64 113.387 121.662 -8.275 1
1 742 . 10 1 1 A 65 65 SER H H 65 8.518 8.980 -0.462 1
1 743 . 10 1 1 A 65 65 SER HA H 65 3.264 5.025 -1.761 1
1 746 . 10 1 1 A 65 65 SER C C 65 176.417 174.493 1.924 1
1 747 . 10 1 1 A 65 65 SER CA C 65 56.819 58.199 -1.380 1
1 748 . 10 1 1 A 65 65 SER CB C 65 63.391 64.991 -1.600 1
1 749 . 10 1 1 A 65 65 SER N N 65 114.674 115.623 -0.949 1
1 750 . 10 1 1 A 66 66 LEU H H 66 7.404 8.663 -1.259 1
1 751 . 10 1 1 A 66 66 LEU HA H 66 4.470 4.542 -0.072 1
1 761 . 10 1 1 A 66 66 LEU C C 66 177.993 178.252 -0.259 1
1 762 . 10 1 1 A 66 66 LEU CA C 66 54.242 56.163 -1.921 1
1 763 . 10 1 1 A 66 66 LEU CB C 66 42.787 43.485 -0.698 1
1 767 . 10 1 1 A 66 66 LEU N N 66 123.988 121.175 2.813 1
1 768 . 10 1 1 A 67 67 ARG H H 67 7.865 8.252 -0.387 1
1 769 . 10 1 1 A 67 67 ARG HA H 67 4.175 4.010 0.165 1
1 776 . 10 1 1 A 67 67 ARG C C 67 178.562 178.171 0.391 1
1 777 . 10 1 1 A 67 67 ARG CA C 67 58.143 59.542 -1.399 1
1 778 . 10 1 1 A 67 67 ARG CB C 67 29.052 30.202 -1.150 1
1 781 . 10 1 1 A 67 67 ARG N N 67 122.494 117.916 4.578 1
1 782 . 10 1 1 A 68 68 GLY H H 68 9.398 8.238 1.160 1
1 783 . 10 1 1 A 68 68 GLY HA2 H 68 4.066 3.957 0.109 1
1 784 . 10 1 1 A 68 68 GLY HA3 H 68 3.908 3.971 -0.063 1
1 785 . 10 1 1 A 68 68 GLY C C 68 173.982 173.571 0.411 1
1 786 . 10 1 1 A 68 68 GLY CA C 68 46.230 46.571 -0.341 1
1 787 . 10 1 1 A 68 68 GLY N N 68 117.548 107.627 9.921 1
1 788 . 10 1 1 A 69 69 SER H H 69 7.829 7.644 0.185 1
1 789 . 10 1 1 A 69 69 SER HA H 69 4.807 5.334 -0.527 1
1 792 . 10 1 1 A 69 69 SER C C 69 172.854 172.792 0.062 1
1 793 . 10 1 1 A 69 69 SER CA C 69 59.290 57.425 1.865 1
1 794 . 10 1 1 A 69 69 SER CB C 69 65.366 68.026 -2.660 1
1 795 . 10 1 1 A 69 69 SER N N 69 115.188 114.878 0.310 1
1 796 . 10 1 1 A 70 70 LEU H H 70 8.805 8.555 0.250 1
1 797 . 10 1 1 A 70 70 LEU HA H 70 4.846 4.854 -0.008 1
1 807 . 10 1 1 A 70 70 LEU C C 70 175.775 174.076 1.699 1
1 808 . 10 1 1 A 70 70 LEU CA C 70 53.907 53.968 -0.061 1
1 809 . 10 1 1 A 70 70 LEU CB C 70 45.337 46.465 -1.128 1
1 813 . 10 1 1 A 70 70 LEU N N 70 121.265 123.050 -1.785 1
1 814 . 10 1 1 A 71 71 VAL H H 71 8.644 8.784 -0.140 1
1 815 . 10 1 1 A 71 71 VAL HA H 71 5.555 5.210 0.345 1
1 823 . 10 1 1 A 71 71 VAL C C 71 173.636 173.564 0.072 1
1 824 . 10 1 1 A 71 71 VAL CA C 71 58.760 59.595 -0.835 1
1 825 . 10 1 1 A 71 71 VAL CB C 71 34.891 36.044 -1.153 1
1 828 . 10 1 1 A 71 71 VAL N N 71 122.315 123.049 -0.734 1
1 829 . 10 1 1 A 72 72 SER H H 72 8.750 8.925 -0.175 1
1 830 . 10 1 1 A 72 72 SER HA H 72 4.742 4.989 -0.247 1
1 833 . 10 1 1 A 72 72 SER C C 72 173.058 172.649 0.409 1
1 834 . 10 1 1 A 72 72 SER CA C 72 57.190 57.745 -0.555 1
1 835 . 10 1 1 A 72 72 SER CB C 72 65.612 67.504 -1.892 1
1 836 . 10 1 1 A 72 72 SER N N 72 118.611 121.242 -2.631 1
1 837 . 10 1 1 A 73 73 ALA H H 73 9.009 8.652 0.357 1
1 838 . 10 1 1 A 73 73 ALA HA H 73 4.406 5.146 -0.740 1
1 842 . 10 1 1 A 73 73 ALA C C 73 176.708 176.828 -0.120 1
1 843 . 10 1 1 A 73 73 ALA CA C 73 52.672 50.629 2.043 1
1 844 . 10 1 1 A 73 73 ALA CB C 73 18.812 21.214 -2.402 1
1 845 . 10 1 1 A 73 73 ALA N N 73 125.694 125.782 -0.088 1
1 846 . 10 1 1 A 74 74 LEU H H 74 7.800 9.251 -1.451 1
1 847 . 10 1 1 A 74 74 LEU HA H 74 4.716 4.897 -0.181 1
1 857 . 10 1 1 A 74 74 LEU C C 74 176.551 176.665 -0.114 1
1 858 . 10 1 1 A 74 74 LEU CA C 74 53.784 53.680 0.104 1
1 859 . 10 1 1 A 74 74 LEU CB C 74 43.446 42.813 0.633 1
1 863 . 10 1 1 A 74 74 LEU N N 74 122.271 121.754 0.517 1
1 864 . 10 1 1 A 75 75 GLU H H 75 8.855 8.547 0.308 1
1 865 . 10 1 1 A 75 75 GLU HA H 75 4.336 4.173 0.163 1
1 870 . 10 1 1 A 75 75 GLU C C 75 176.465 176.619 -0.154 1
1 871 . 10 1 1 A 75 75 GLU CA C 75 56.507 57.649 -1.142 1
1 872 . 10 1 1 A 75 75 GLU CB C 75 30.245 30.181 0.064 1
1 874 . 10 1 1 A 75 75 GLU N N 75 122.678 125.127 -2.449 1
1 875 . 10 1 1 A 76 76 ASP H H 76 8.542 8.448 0.094 1
1 876 . 10 1 1 A 76 76 ASP HA H 76 4.665 4.888 -0.223 1
1 879 . 10 1 1 A 76 76 ASP C C 76 176.087 176.026 0.061 1
1 880 . 10 1 1 A 76 76 ASP CA C 76 55.107 54.576 0.531 1
1 881 . 10 1 1 A 76 76 ASP CB C 76 41.431 39.779 1.652 1
1 882 . 10 1 1 A 76 76 ASP N N 76 121.488 122.431 -0.943 1
1 883 . 10 1 1 A 77 77 ASN H H 77 8.322 8.384 -0.062 1
1 884 . 10 1 1 A 77 77 ASN HA H 77 4.729 4.945 -0.216 1
1 889 . 10 1 1 A 77 77 ASN C C 77 175.566 175.895 -0.329 1
1 890 . 10 1 1 A 77 77 ASN CA C 77 53.131 52.770 0.361 1
1 891 . 10 1 1 A 77 77 ASN CB C 77 38.617 42.359 -3.742 1
1 892 . 10 1 1 A 77 77 ASN N N 77 118.676 122.960 -4.284 1
1 894 . 10 1 1 A 78 78 GLY H H 78 8.311 8.777 -0.466 1
1 895 . 10 1 1 A 78 78 GLY HA2 H 78 3.897 3.826 0.071 1
1 896 . 10 1 1 A 78 78 GLY HA3 H 78 3.897 3.833 0.064 1
1 897 . 10 1 1 A 78 78 GLY C C 78 173.376 174.104 -0.728 1
1 898 . 10 1 1 A 78 78 GLY CA C 78 45.224 47.405 -2.181 1
1 899 . 10 1 1 A 78 78 GLY N N 78 108.939 110.543 -1.604 1
1 900 . 10 1 1 A 79 79 VAL H H 79 7.882 7.833 0.049 1
1 901 . 10 1 1 A 79 79 VAL HA H 79 4.345 4.701 -0.356 1
1 909 . 10 1 1 A 79 79 VAL CA C 79 59.995 58.079 1.916 1
1 910 . 10 1 1 A 79 79 VAL CB C 79 32.589 34.855 -2.266 1
1 913 . 10 1 1 A 79 79 VAL N N 79 121.135 118.327 2.808 1
1 914 . 10 1 1 A 80 80 PRO HA H 80 4.461 4.609 -0.148 1
1 921 . 10 1 1 A 80 80 PRO C C 80 176.979 176.408 0.571 1
1 922 . 10 1 1 A 80 80 PRO CA C 80 63.101 62.215 0.886 1
1 923 . 10 1 1 A 80 80 PRO CB C 80 32.177 33.257 -1.080 1
1 926 . 10 1 1 A 81 81 THR H H 81 8.281 8.345 -0.064 1
1 927 . 10 1 1 A 81 81 THR HA H 81 4.095 3.812 0.283 1
1 932 . 10 1 1 A 81 81 THR C C 81 175.270 175.851 -0.581 1
1 933 . 10 1 1 A 81 81 THR CA C 81 62.872 64.654 -1.782 1
1 934 . 10 1 1 A 81 81 THR CB C 81 69.642 68.493 1.149 1
1 936 . 10 1 1 A 81 81 THR N N 81 114.684 117.079 -2.395 1
1 937 . 10 1 1 A 82 82 GLY H H 82 8.338 8.859 -0.521 1
1 938 . 10 1 1 A 82 82 GLY HA2 H 82 4.095 3.790 0.305 1
1 939 . 10 1 1 A 82 82 GLY HA3 H 82 3.668 3.807 -0.139 1
1 940 . 10 1 1 A 82 82 GLY C C 82 174.139 174.884 -0.745 1
1 941 . 10 1 1 A 82 82 GLY CA C 82 45.083 47.079 -1.996 1
1 942 . 10 1 1 A 82 82 GLY N N 82 111.289 116.072 -4.783 1
1 943 . 10 1 1 A 83 83 VAL H H 83 7.668 7.936 -0.268 1
1 944 . 10 1 1 A 83 83 VAL HA H 83 3.985 3.545 0.440 1
1 952 . 10 1 1 A 83 83 VAL C C 83 176.054 174.885 1.169 1
1 953 . 10 1 1 A 83 83 VAL CA C 83 62.431 62.469 -0.038 1
1 954 . 10 1 1 A 83 83 VAL CB C 83 32.260 30.295 1.965 1
1 957 . 10 1 1 A 83 83 VAL N N 83 120.003 121.475 -1.472 1
1 958 . 10 1 1 A 84 84 LYS H H 84 8.645 7.832 0.813 1
1 959 . 10 1 1 A 84 84 LYS HA H 84 4.276 4.063 0.213 1
1 968 . 10 1 1 A 84 84 LYS C C 84 176.832 176.920 -0.088 1
1 969 . 10 1 1 A 84 84 LYS CA C 84 56.272 56.766 -0.494 1
1 970 . 10 1 1 A 84 84 LYS CB C 84 32.876 32.703 0.173 1
1 974 . 10 1 1 A 84 84 LYS N N 84 126.447 121.074 5.373 1
1 975 . 10 1 1 A 85 85 GLY H H 85 8.410 8.819 -0.409 1
1 976 . 10 1 1 A 85 85 GLY HA2 H 85 4.066 4.040 0.026 1
1 977 . 10 1 1 A 85 85 GLY HA3 H 85 3.781 4.181 -0.400 1
1 978 . 10 1 1 A 85 85 GLY C C 85 173.969 174.724 -0.755 1
1 979 . 10 1 1 A 85 85 GLY CA C 85 45.146 45.156 -0.010 1
1 980 . 10 1 1 A 85 85 GLY N N 85 109.957 111.649 -1.692 1
1 981 . 10 1 1 A 86 86 ASN H H 86 8.298 8.328 -0.030 1
1 982 . 10 1 1 A 86 86 ASN HA H 86 4.665 4.519 0.146 1
1 987 . 10 1 1 A 86 86 ASN C C 86 174.987 175.232 -0.245 1
1 988 . 10 1 1 A 86 86 ASN CA C 86 52.989 53.690 -0.701 1
1 989 . 10 1 1 A 86 86 ASN CB C 86 38.376 37.169 1.207 1
1 990 . 10 1 1 A 86 86 ASN N N 86 118.457 115.593 2.864 1
1 992 . 10 1 1 A 87 87 VAL H H 87 7.660 8.101 -0.441 1
1 993 . 10 1 1 A 87 87 VAL HA H 87 3.946 3.996 -0.050 1
1 1001 . 10 1 1 A 87 87 VAL C C 87 174.902 176.094 -1.192 1
1 1002 . 10 1 1 A 87 87 VAL CA C 87 62.307 62.813 -0.506 1
1 1003 . 10 1 1 A 87 87 VAL CB C 87 32.548 32.563 -0.015 1
1 1006 . 10 1 1 A 87 87 VAL N N 87 120.557 123.018 -2.461 1
1 1007 . 10 1 1 A 88 88 GLN H H 88 8.115 7.939 0.176 1
1 1008 . 10 1 1 A 88 88 GLN HA H 88 4.302 4.343 -0.041 1
1 1015 . 10 1 1 A 88 88 GLN C C 88 175.637 175.978 -0.341 1
1 1016 . 10 1 1 A 88 88 GLN CA C 88 55.336 55.648 -0.312 1
1 1017 . 10 1 1 A 88 88 GLN CB C 88 30.574 28.578 1.996 1
1 1019 . 10 1 1 A 88 88 GLN N N 88 122.280 122.002 0.278 1
1 1021 . 10 1 1 A 89 89 GLY H H 89 8.544 8.660 -0.116 1
1 1022 . 10 1 1 A 89 89 GLY HA2 H 89 3.885 3.916 -0.031 1
1 1023 . 10 1 1 A 89 89 GLY HA3 H 89 3.885 3.937 -0.052 1
1 1024 . 10 1 1 A 89 89 GLY C C 89 172.861 174.872 -2.011 1
1 1025 . 10 1 1 A 89 89 GLY CA C 89 44.889 45.303 -0.414 1
1 1026 . 10 1 1 A 89 89 GLY N N 89 110.135 109.835 0.300 1
1 1027 . 10 1 1 A 90 90 ASN H H 90 8.451 8.492 -0.041 1
1 1028 . 10 1 1 A 90 90 ASN HA H 90 4.222 4.409 -0.187 1
1 1033 . 10 1 1 A 90 90 ASN C C 90 174.926 174.828 0.098 1
1 1034 . 10 1 1 A 90 90 ASN CA C 90 54.613 54.161 0.452 1
1 1035 . 10 1 1 A 90 90 ASN CB C 90 37.852 36.993 0.859 1
1 1036 . 10 1 1 A 90 90 ASN N N 90 114.322 111.912 2.410 1
1 1038 . 10 1 1 A 91 91 LEU H H 91 8.933 8.142 0.791 1
1 1039 . 10 1 1 A 91 91 LEU HA H 91 5.367 4.533 0.834 1
1 1049 . 10 1 1 A 91 91 LEU C C 91 178.732 176.208 2.524 1
1 1050 . 10 1 1 A 91 91 LEU CA C 91 55.160 54.959 0.201 1
1 1051 . 10 1 1 A 91 91 LEU CB C 91 45.461 42.813 2.648 1
1 1055 . 10 1 1 A 91 91 LEU N N 91 120.057 119.806 0.251 1
1 1056 . 10 1 1 A 92 92 PHE H H 92 9.901 8.306 1.595 1
1 1057 . 10 1 1 A 92 92 PHE HA H 92 5.105 5.618 -0.513 1
1 1065 . 10 1 1 A 92 92 PHE C C 92 170.140 172.844 -2.704 1
1 1066 . 10 1 1 A 92 92 PHE CA C 92 56.236 55.478 0.758 1
1 1067 . 10 1 1 A 92 92 PHE CB C 92 42.664 42.748 -0.084 1
1 1073 . 10 1 1 A 92 92 PHE N N 92 119.740 116.472 3.268 1
1 1074 . 10 1 1 A 93 93 LYS H H 93 9.154 9.296 -0.142 1
1 1075 . 10 1 1 A 93 93 LYS HA H 93 5.584 4.980 0.604 1
1 1083 . 10 1 1 A 93 93 LYS C C 93 174.830 174.880 -0.050 1
1 1084 . 10 1 1 A 93 93 LYS CA C 93 53.148 53.849 -0.701 1
1 1085 . 10 1 1 A 93 93 LYS CB C 93 36.660 36.208 0.452 1
1 1089 . 10 1 1 A 93 93 LYS N N 93 117.710 118.486 -0.776 1
1 1090 . 10 1 1 A 94 94 VAL H H 94 8.507 8.216 0.291 1
1 1091 . 10 1 1 A 94 94 VAL HA H 94 4.872 4.985 -0.113 1
1 1099 . 10 1 1 A 94 94 VAL C C 94 174.408 174.834 -0.426 1
1 1100 . 10 1 1 A 94 94 VAL CA C 94 60.525 61.267 -0.742 1
1 1101 . 10 1 1 A 94 94 VAL CB C 94 34.862 33.926 0.936 1
1 1104 . 10 1 1 A 94 94 VAL N N 94 121.741 120.536 1.205 1
1 1105 . 10 1 1 A 95 95 ILE H H 95 8.959 8.817 0.142 1
1 1106 . 10 1 1 A 95 95 ILE HA H 95 4.794 4.495 0.299 1
1 1116 . 10 1 1 A 95 95 ILE C C 95 177.642 176.180 1.462 1
1 1117 . 10 1 1 A 95 95 ILE CA C 95 59.713 60.726 -1.013 1
1 1118 . 10 1 1 A 95 95 ILE CB C 95 40.032 37.300 2.732 1
1 1122 . 10 1 1 A 95 95 ILE N N 95 126.794 128.237 -1.443 1
1 1123 . 10 1 1 A 96 96 THR H H 96 8.765 8.858 -0.093 1
1 1124 . 10 1 1 A 96 96 THR HA H 96 4.584 4.811 -0.227 1
1 1129 . 10 1 1 A 96 96 THR C C 96 177.023 176.005 1.018 1
1 1130 . 10 1 1 A 96 96 THR CA C 96 61.372 61.018 0.354 1
1 1131 . 10 1 1 A 96 96 THR CB C 96 70.794 70.589 0.205 1
1 1133 . 10 1 1 A 96 96 THR N N 96 117.225 121.018 -3.793 1
1 1134 . 10 1 1 A 97 97 LYS H H 97 8.736 8.890 -0.154 1
1 1135 . 10 1 1 A 97 97 LYS HA H 97 4.101 4.131 -0.030 1
1 1144 . 10 1 1 A 97 97 LYS C C 97 176.490 176.597 -0.107 1
1 1145 . 10 1 1 A 97 97 LYS CA C 97 58.583 58.554 0.029 1
1 1146 . 10 1 1 A 97 97 LYS CB C 97 31.848 31.997 -0.149 1
1 1150 . 10 1 1 A 97 97 LYS N N 97 120.457 119.586 0.871 1
1 1151 . 10 1 1 A 98 98 ASP H H 98 7.762 7.472 0.290 1
1 1152 . 10 1 1 A 98 98 ASP HA H 98 4.633 4.839 -0.206 1
1 1155 . 10 1 1 A 98 98 ASP C C 98 175.270 175.340 -0.070 1
1 1156 . 10 1 1 A 98 98 ASP CA C 98 53.272 52.928 0.344 1
1 1157 . 10 1 1 A 98 98 ASP CB C 98 39.909 40.693 -0.784 1
1 1158 . 10 1 1 A 98 98 ASP N N 98 116.281 119.842 -3.561 1
1 1159 . 10 1 1 A 99 99 ASP H H 99 8.340 8.144 0.196 1
1 1160 . 10 1 1 A 99 99 ASP HA H 99 4.245 4.508 -0.263 1
1 1163 . 10 1 1 A 99 99 ASP C C 99 175.315 175.609 -0.294 1
1 1164 . 10 1 1 A 99 99 ASP CA C 99 55.989 55.415 0.574 1
1 1165 . 10 1 1 A 99 99 ASP CB C 99 39.827 39.048 0.779 1
1 1166 . 10 1 1 A 99 99 ASP N N 99 116.687 115.829 0.858 1
1 1167 . 10 1 1 A 100 100 THR H H 100 7.511 7.950 -0.439 1
1 1168 . 10 1 1 A 100 100 THR HA H 100 4.185 3.814 0.371 1
1 1173 . 10 1 1 A 100 100 THR C C 100 173.376 174.433 -1.057 1
1 1174 . 10 1 1 A 100 100 THR CA C 100 63.489 65.868 -2.379 1
1 1175 . 10 1 1 A 100 100 THR CB C 100 67.909 69.184 -1.275 1
1 1177 . 10 1 1 A 100 100 THR N N 100 116.525 111.375 5.150 1
1 1178 . 10 1 1 A 101 101 HIS H H 101 8.753 8.030 0.723 1
1 1179 . 10 1 1 A 101 101 HIS HA H 101 4.898 4.308 0.590 1
1 1184 . 10 1 1 A 101 101 HIS C C 101 174.345 173.467 0.878 1
1 1185 . 10 1 1 A 101 101 HIS CA C 101 55.072 55.943 -0.871 1
1 1186 . 10 1 1 A 101 101 HIS CB C 101 32.835 27.521 5.314 1
1 1189 . 10 1 1 A 101 101 HIS N N 101 125.953 116.555 9.398 1
1 1190 . 10 1 1 A 102 102 TYR H H 102 9.023 8.385 0.638 1
1 1191 . 10 1 1 A 102 102 TYR HA H 102 4.545 4.721 -0.176 1
1 1198 . 10 1 1 A 102 102 TYR C C 102 174.126 174.668 -0.542 1
1 1199 . 10 1 1 A 102 102 TYR CA C 102 57.260 56.380 0.880 1
1 1200 . 10 1 1 A 102 102 TYR CB C 102 40.381 38.474 1.907 1
1 1205 . 10 1 1 A 102 102 TYR N N 102 121.975 121.262 0.713 1
1 1206 . 10 1 1 A 103 103 TYR H H 103 8.899 8.845 0.054 1
1 1207 . 10 1 1 A 103 103 TYR HA H 103 4.729 4.833 -0.104 1
1 1214 . 10 1 1 A 103 103 TYR C C 103 174.139 176.015 -1.876 1
1 1215 . 10 1 1 A 103 103 TYR CA C 103 58.036 58.187 -0.151 1
1 1216 . 10 1 1 A 103 103 TYR CB C 103 40.485 39.529 0.956 1
1 1221 . 10 1 1 A 103 103 TYR N N 103 122.012 124.204 -2.192 1
1 1222 . 10 1 1 A 104 104 ILE H H 104 8.605 8.200 0.405 1
1 1223 . 10 1 1 A 104 104 ILE HA H 104 4.859 4.789 0.070 1
1 1233 . 10 1 1 A 104 104 ILE C C 104 172.769 174.272 -1.503 1
1 1234 . 10 1 1 A 104 104 ILE CA C 104 59.554 59.631 -0.077 1
1 1235 . 10 1 1 A 104 104 ILE CB C 104 40.631 42.220 -1.589 1
1 1239 . 10 1 1 A 104 104 ILE N N 104 123.443 123.016 0.427 1
1 1240 . 10 1 1 A 105 105 GLN H H 105 9.369 8.377 0.992 1
1 1241 . 10 1 1 A 105 105 GLN HA H 105 4.895 5.194 -0.299 1
1 1248 . 10 1 1 A 105 105 GLN C C 105 175.642 175.073 0.569 1
1 1249 . 10 1 1 A 105 105 GLN CA C 105 54.965 53.978 0.987 1
1 1250 . 10 1 1 A 105 105 GLN CB C 105 32.856 32.350 0.506 1
1 1252 . 10 1 1 A 105 105 GLN N N 105 125.079 124.031 1.048 1
1 1254 . 10 1 1 A 106 106 ALA H H 106 8.513 8.554 -0.041 1
1 1255 . 10 1 1 A 106 106 ALA HA H 106 4.962 4.805 0.157 1
1 1259 . 10 1 1 A 106 106 ALA C C 106 175.854 177.736 -1.882 1
1 1260 . 10 1 1 A 106 106 ALA CA C 106 50.272 50.327 -0.055 1
1 1261 . 10 1 1 A 106 106 ALA CB C 106 21.197 21.964 -0.767 1
1 1262 . 10 1 1 A 106 106 ALA N N 106 129.303 128.576 0.727 1
1 1263 . 10 1 1 A 107 107 SER H H 107 9.468 8.690 0.778 1
1 1264 . 10 1 1 A 107 107 SER HA H 107 4.447 4.370 0.077 1
1 1267 . 10 1 1 A 107 107 SER C C 107 173.785 174.794 -1.009 1
1 1268 . 10 1 1 A 107 107 SER CA C 107 60.048 62.002 -1.954 1
1 1269 . 10 1 1 A 107 107 SER CB C 107 64.643 63.434 1.209 1
1 1270 . 10 1 1 A 107 107 SER N N 107 112.962 116.388 -3.426 1
1 1271 . 10 1 1 A 108 108 SER H H 108 7.555 7.963 -0.408 1
1 1272 . 10 1 1 A 108 108 SER HA H 108 4.665 4.953 -0.288 1
1 1275 . 10 1 1 A 108 108 SER C C 108 174.381 174.308 0.073 1
1 1276 . 10 1 1 A 108 108 SER CA C 108 56.907 57.513 -0.606 1
1 1277 . 10 1 1 A 108 108 SER CB C 108 66.370 66.437 -0.067 1
1 1278 . 10 1 1 A 108 108 SER N N 108 112.243 114.227 -1.984 1
1 1279 . 10 1 1 A 109 109 LYS H H 109 8.978 9.310 -0.332 1
1 1280 . 10 1 1 A 109 109 LYS HA H 109 4.777 3.995 0.782 1
1 1287 . 10 1 1 A 109 109 LYS C C 109 179.992 179.008 0.984 1
1 1288 . 10 1 1 A 109 109 LYS CA C 109 59.766 59.788 -0.022 1
1 1289 . 10 1 1 A 109 109 LYS CB C 109 32.342 32.093 0.249 1
1 1293 . 10 1 1 A 109 109 LYS N N 109 123.170 124.320 -1.150 1
1 1294 . 10 1 1 A 110 110 ALA H H 110 8.608 8.069 0.539 1
1 1295 . 10 1 1 A 110 110 ALA HA H 110 4.178 4.097 0.081 1
1 1299 . 10 1 1 A 110 110 ALA C C 110 179.895 179.134 0.761 1
1 1300 . 10 1 1 A 110 110 ALA CA C 110 54.871 55.375 -0.504 1
1 1301 . 10 1 1 A 110 110 ALA CB C 110 18.065 18.354 -0.289 1
1 1302 . 10 1 1 A 110 110 ALA N N 110 123.750 122.021 1.729 1
1 1303 . 10 1 1 A 111 111 GLU H H 111 8.185 8.309 -0.124 1
1 1304 . 10 1 1 A 111 111 GLU HA H 111 4.180 4.041 0.139 1
1 1309 . 10 1 1 A 111 111 GLU C C 111 178.587 179.169 -0.582 1
1 1310 . 10 1 1 A 111 111 GLU CA C 111 59.466 59.745 -0.279 1
1 1311 . 10 1 1 A 111 111 GLU CB C 111 31.067 29.361 1.706 1
1 1313 . 10 1 1 A 111 111 GLU N N 111 119.757 118.585 1.172 1
1 1314 . 10 1 1 A 112 112 ARG H H 112 8.008 7.921 0.087 1
1 1315 . 10 1 1 A 112 112 ARG HA H 112 3.642 4.059 -0.417 1
1 1322 . 10 1 1 A 112 112 ARG C C 112 176.481 178.310 -1.829 1
1 1323 . 10 1 1 A 112 112 ARG CA C 112 60.419 59.528 0.891 1
1 1324 . 10 1 1 A 112 112 ARG CB C 112 29.957 29.879 0.078 1
1 1327 . 10 1 1 A 112 112 ARG N N 112 118.430 119.877 -1.447 1
1 1328 . 10 1 1 A 113 113 ALA H H 113 7.985 7.858 0.127 1
1 1329 . 10 1 1 A 113 113 ALA HA H 113 3.925 4.051 -0.126 1
1 1333 . 10 1 1 A 113 113 ALA C C 113 180.117 179.730 0.387 1
1 1334 . 10 1 1 A 113 113 ALA CA C 113 55.372 55.142 0.230 1
1 1335 . 10 1 1 A 113 113 ALA CB C 113 17.825 18.452 -0.627 1
1 1336 . 10 1 1 A 113 113 ALA N N 113 119.980 120.734 -0.754 1
1 1337 . 10 1 1 A 114 114 GLU H H 114 8.093 8.149 -0.056 1
1 1338 . 10 1 1 A 114 114 GLU HA H 114 3.936 3.942 -0.006 1
1 1343 . 10 1 1 A 114 114 GLU C C 114 180.586 179.231 1.355 1
1 1344 . 10 1 1 A 114 114 GLU CA C 114 59.148 59.121 0.027 1
1 1345 . 10 1 1 A 114 114 GLU CB C 114 30.080 29.629 0.451 1
1 1347 . 10 1 1 A 114 114 GLU N N 114 117.168 118.012 -0.844 1
1 1348 . 10 1 1 A 115 115 TRP H H 115 7.980 9.063 -1.083 1
1 1349 . 10 1 1 A 115 115 TRP HA H 115 3.775 4.347 -0.572 1
1 1358 . 10 1 1 A 115 115 TRP C C 115 177.714 178.709 -0.995 1
1 1359 . 10 1 1 A 115 115 TRP CA C 115 62.696 60.151 2.545 1
1 1360 . 10 1 1 A 115 115 TRP CB C 115 29.052 28.918 0.134 1
1 1366 . 10 1 1 A 115 115 TRP N N 115 120.974 120.659 0.315 1
1 1368 . 10 1 1 A 116 116 ILE H H 116 8.297 8.060 0.237 1
1 1369 . 10 1 1 A 116 116 ILE HA H 116 3.270 3.751 -0.481 1
1 1379 . 10 1 1 A 116 116 ILE C C 116 177.568 178.011 -0.443 1
1 1380 . 10 1 1 A 116 116 ILE CA C 116 66.643 64.057 2.586 1
1 1381 . 10 1 1 A 116 116 ILE CB C 116 37.606 37.551 0.055 1
1 1385 . 10 1 1 A 116 116 ILE N N 116 118.408 121.359 -2.951 1
1 1386 . 10 1 1 A 117 117 GLU H H 117 8.026 8.880 -0.854 1
1 1387 . 10 1 1 A 117 117 GLU HA H 117 3.880 3.954 -0.074 1
1 1392 . 10 1 1 A 117 117 GLU C C 117 178.476 178.984 -0.508 1
1 1393 . 10 1 1 A 117 117 GLU CA C 117 59.219 59.739 -0.520 1
1 1394 . 10 1 1 A 117 117 GLU CB C 117 29.381 29.316 0.065 1
1 1396 . 10 1 1 A 117 117 GLU N N 117 117.096 120.319 -3.223 1
1 1397 . 10 1 1 A 118 118 ALA H H 118 7.555 8.059 -0.504 1
1 1398 . 10 1 1 A 118 118 ALA HA H 118 3.952 4.044 -0.092 1
1 1402 . 10 1 1 A 118 118 ALA C C 118 179.862 179.966 -0.104 1
1 1403 . 10 1 1 A 118 118 ALA CA C 118 54.772 55.058 -0.286 1
1 1404 . 10 1 1 A 118 118 ALA CB C 118 18.277 18.464 -0.187 1
1 1405 . 10 1 1 A 118 118 ALA N N 118 119.817 121.812 -1.995 1
1 1406 . 10 1 1 A 119 119 ILE H H 119 8.167 7.951 0.216 1
1 1407 . 10 1 1 A 119 119 ILE HA H 119 3.558 3.772 -0.214 1
1 1417 . 10 1 1 A 119 119 ILE C C 119 178.564 177.892 0.672 1
1 1418 . 10 1 1 A 119 119 ILE CA C 119 65.766 65.277 0.489 1
1 1419 . 10 1 1 A 119 119 ILE CB C 119 38.840 38.081 0.759 1
1 1423 . 10 1 1 A 119 119 ILE N N 119 116.280 117.939 -1.659 1
1 1424 . 10 1 1 A 120 120 LYS H H 120 8.790 8.030 0.760 1
1 1425 . 10 1 1 A 120 120 LYS HA H 120 3.965 4.364 -0.399 1
1 1434 . 10 1 1 A 120 120 LYS C C 120 179.673 179.200 0.473 1
1 1435 . 10 1 1 A 120 120 LYS CA C 120 60.031 60.343 -0.312 1
1 1436 . 10 1 1 A 120 120 LYS CB C 120 32.547 32.411 0.136 1
1 1440 . 10 1 1 A 120 120 LYS N N 120 119.650 118.853 0.797 1
1 1441 . 10 1 1 A 121 121 LYS H H 121 7.594 7.823 -0.229 1
1 1442 . 10 1 1 A 121 121 LYS HA H 121 4.095 4.121 -0.026 1
1 1451 . 10 1 1 A 121 121 LYS C C 121 177.962 179.269 -1.307 1
1 1452 . 10 1 1 A 121 121 LYS CA C 121 58.848 59.159 -0.311 1
1 1453 . 10 1 1 A 121 121 LYS CB C 121 32.547 32.312 0.235 1
1 1457 . 10 1 1 A 121 121 LYS N N 121 117.197 119.723 -2.526 1
1 1458 . 10 1 1 A 122 122 LEU H H 122 7.586 7.808 -0.222 1
1 1459 . 10 1 1 A 122 122 LEU HA H 122 4.535 3.958 0.577 1
1 1469 . 10 1 1 A 122 122 LEU C C 122 177.902 179.154 -1.252 1
1 1470 . 10 1 1 A 122 122 LEU CA C 122 55.071 58.027 -2.956 1
1 1471 . 10 1 1 A 122 122 LEU CB C 122 42.888 41.927 0.961 1
1 1475 . 10 1 1 A 122 122 LEU N N 122 116.861 120.415 -3.554 1
1 1476 . 10 1 1 A 123 123 THR H H 123 7.636 8.258 -0.622 1
1 1477 . 10 1 1 A 123 123 THR HA H 123 4.445 4.151 0.294 1
1 1482 . 10 1 1 A 123 123 THR C C 123 175.714 174.695 1.019 1
1 1483 . 10 1 1 A 123 123 THR CA C 123 62.643 64.797 -2.154 1
1 1484 . 10 1 1 A 123 123 THR CB C 123 70.259 68.909 1.350 1
1 1486 . 10 1 1 A 123 123 THR N N 123 108.963 111.087 -2.124 1
1 1487 . 10 1 1 A 124 124 SER H H 124 7.912 8.386 -0.474 1
1 1488 . 10 1 1 A 124 124 SER HA H 124 4.626 4.781 -0.155 1
1 1491 . 10 1 1 A 124 124 SER C C 124 174.405 173.058 1.347 1
1 1492 . 10 1 1 A 124 124 SER CA C 124 58.390 57.834 0.556 1
1 1493 . 10 1 1 A 124 124 SER CB C 124 64.255 65.829 -1.574 1
1 1494 . 10 1 1 A 124 124 SER N N 124 116.876 113.148 3.728 1
1 1495 . 10 1 1 A 125 125 GLY H H 125 8.307 9.098 -0.791 1
1 1496 . 10 1 1 A 125 125 GLY HA2 H 125 4.166 3.990 0.176 1
1 1497 . 10 1 1 A 125 125 GLY HA3 H 125 4.166 3.991 0.175 1
1 1498 . 10 1 1 A 125 125 GLY C C 125 171.921 173.485 -1.564 1
1 1499 . 10 1 1 A 125 125 GLY CA C 125 44.748 45.434 -0.686 1
1 1500 . 10 1 1 A 125 125 GLY N N 125 110.006 110.400 -0.394 1
1 1501 . 10 1 1 A 126 126 PRO HA H 126 4.510 4.481 0.029 1
1 1508 . 10 1 1 A 126 126 PRO C C 126 177.471 177.190 0.281 1
1 1509 . 10 1 1 A 126 126 PRO CA C 126 63.419 63.416 0.003 1
1 1510 . 10 1 1 A 126 126 PRO CB C 126 32.106 31.505 0.601 1
1 1513 . 10 1 1 A 127 127 SER H H 127 8.607 8.842 -0.235 1
1 1514 . 10 1 1 A 127 127 SER C C 127 174.628 173.052 1.576 1
1 1515 . 10 1 1 A 127 127 SER CA C 127 58.513 59.029 -0.516 1
1 1516 . 10 1 1 A 127 127 SER CB C 127 63.679 61.520 2.159 1
1 1517 . 10 1 1 A 127 127 SER N N 127 116.390 114.551 1.839 1
1 1518 . 10 1 1 A 128 128 SER H H 128 8.272 8.024 0.248 1
1 1519 . 10 1 1 A 128 128 SER HA H 128 4.496 5.009 -0.513 1
1 1520 . 10 1 1 A 128 128 SER C C 128 173.921 172.922 0.999 1
1 1521 . 10 1 1 A 128 128 SER CA C 128 58.442 57.596 0.846 1
1 1522 . 10 1 1 A 128 128 SER CB C 128 64.173 65.258 -1.085 1
1 1523 . 10 1 1 A 128 128 SER N N 128 117.506 117.611 -0.105 1
1 1 . 11 1 1 A 7 7 GLY HA2 H 7 3.978 4.142 -0.164 1
1 2 . 11 1 1 A 7 7 GLY HA3 H 7 3.978 4.144 -0.166 1
1 3 . 11 1 1 A 7 7 GLY C C 7 174.274 173.713 0.561 1
1 4 . 11 1 1 A 7 7 GLY CA C 7 45.383 46.031 -0.648 1
1 5 . 11 1 1 A 8 8 SER H H 8 8.211 8.312 -0.101 1
1 6 . 11 1 1 A 8 8 SER HA H 8 4.425 4.177 0.248 1
1 9 . 11 1 1 A 8 8 SER C C 8 174.635 174.146 0.489 1
1 10 . 11 1 1 A 8 8 SER CA C 8 58.425 58.952 -0.527 1
1 11 . 11 1 1 A 8 8 SER CB C 8 63.885 61.831 2.054 1
1 12 . 11 1 1 A 8 8 SER N N 8 115.732 112.899 2.833 1
1 13 . 11 1 1 A 9 9 LEU H H 9 8.316 8.300 0.016 1
1 14 . 11 1 1 A 9 9 LEU HA H 9 4.334 4.516 -0.182 1
1 24 . 11 1 1 A 9 9 LEU C C 9 177.447 176.566 0.881 1
1 25 . 11 1 1 A 9 9 LEU CA C 9 55.407 55.874 -0.467 1
1 26 . 11 1 1 A 9 9 LEU CB C 9 42.171 44.511 -2.340 1
1 30 . 11 1 1 A 9 9 LEU N N 9 123.943 126.681 -2.738 1
1 31 . 11 1 1 A 10 10 SER H H 10 8.304 7.925 0.379 1
1 32 . 11 1 1 A 10 10 SER HA H 10 4.424 4.825 -0.401 1
1 35 . 11 1 1 A 10 10 SER C C 10 175.025 173.076 1.949 1
1 36 . 11 1 1 A 10 10 SER CA C 10 58.425 57.342 1.083 1
1 37 . 11 1 1 A 10 10 SER CB C 10 63.638 65.770 -2.132 1
1 38 . 11 1 1 A 10 10 SER N N 10 116.718 110.912 5.806 1
1 39 . 11 1 1 A 11 11 THR H H 11 8.003 9.011 -1.008 1
1 40 . 11 1 1 A 11 11 THR HA H 11 4.196 4.564 -0.368 1
1 45 . 11 1 1 A 11 11 THR C C 11 176.296 174.071 2.225 1
1 46 . 11 1 1 A 11 11 THR CA C 11 62.483 61.702 0.781 1
1 47 . 11 1 1 A 11 11 THR CB C 11 69.266 70.052 -0.786 1
1 49 . 11 1 1 A 11 11 THR N N 11 114.902 121.668 -6.766 1
1 50 . 11 1 1 A 12 12 VAL H H 12 8.095 8.570 -0.475 1
1 51 . 11 1 1 A 12 12 VAL HA H 12 3.826 4.139 -0.313 1
1 59 . 11 1 1 A 12 12 VAL C C 12 178.501 176.851 1.650 1
1 60 . 11 1 1 A 12 12 VAL CA C 12 64.760 63.648 1.112 1
1 61 . 11 1 1 A 12 12 VAL CB C 12 32.013 33.134 -1.121 1
1 64 . 11 1 1 A 12 12 VAL N N 12 122.111 121.000 1.111 1
1 65 . 11 1 1 A 13 13 GLU H H 13 8.151 8.778 -0.627 1
1 66 . 11 1 1 A 13 13 GLU HA H 13 3.244 3.222 0.022 1
1 71 . 11 1 1 A 13 13 GLU C C 13 175.702 178.334 -2.632 1
1 72 . 11 1 1 A 13 13 GLU CA C 13 58.354 59.011 -0.657 1
1 73 . 11 1 1 A 13 13 GLU CB C 13 28.843 28.659 0.184 1
1 75 . 11 1 1 A 13 13 GLU N N 13 120.316 122.584 -2.268 1
1 76 . 11 1 1 A 14 14 LEU H H 14 7.067 7.487 -0.420 1
1 77 . 11 1 1 A 14 14 LEU HA H 14 4.157 4.117 0.040 1
1 87 . 11 1 1 A 14 14 LEU C C 14 176.863 177.196 -0.333 1
1 88 . 11 1 1 A 14 14 LEU CA C 14 53.324 54.711 -1.387 1
1 89 . 11 1 1 A 14 14 LEU CB C 14 41.636 41.367 0.269 1
1 93 . 11 1 1 A 14 14 LEU N N 14 117.035 119.252 -2.217 1
1 94 . 11 1 1 A 15 15 SER H H 15 7.645 7.894 -0.249 1
1 95 . 11 1 1 A 15 15 SER HA H 15 4.305 4.555 -0.250 1
1 98 . 11 1 1 A 15 15 SER C C 15 175.340 172.879 2.461 1
1 99 . 11 1 1 A 15 15 SER CA C 15 59.783 57.065 2.718 1
1 100 . 11 1 1 A 15 15 SER CB C 15 64.625 61.877 2.748 1
1 101 . 11 1 1 A 15 15 SER N N 15 114.216 115.561 -1.345 1
1 102 . 11 1 1 A 16 16 GLY H H 16 8.506 8.216 0.290 1
1 103 . 11 1 1 A 16 16 GLY HA2 H 16 4.237 4.306 -0.069 1
1 104 . 11 1 1 A 16 16 GLY HA3 H 16 3.927 4.321 -0.394 1
1 105 . 11 1 1 A 16 16 GLY C C 16 173.661 172.004 1.657 1
1 106 . 11 1 1 A 16 16 GLY CA C 16 44.995 44.383 0.612 1
1 107 . 11 1 1 A 16 16 GLY N N 16 111.838 112.534 -0.696 1
1 108 . 11 1 1 A 17 17 THR H H 17 8.482 8.834 -0.352 1
1 109 . 11 1 1 A 17 17 THR HA H 17 4.319 4.439 -0.120 1
1 114 . 11 1 1 A 17 17 THR C C 17 174.758 174.551 0.207 1
1 115 . 11 1 1 A 17 17 THR CA C 17 62.272 63.039 -0.767 1
1 116 . 11 1 1 A 17 17 THR CB C 17 70.706 69.315 1.391 1
1 118 . 11 1 1 A 17 17 THR N N 17 116.679 115.157 1.522 1
1 119 . 11 1 1 A 18 18 VAL H H 18 8.948 8.695 0.253 1
1 120 . 11 1 1 A 18 18 VAL HA H 18 3.950 4.141 -0.191 1
1 128 . 11 1 1 A 18 18 VAL C C 18 176.669 176.980 -0.311 1
1 129 . 11 1 1 A 18 18 VAL CA C 18 64.813 63.541 1.272 1
1 130 . 11 1 1 A 18 18 VAL CB C 18 31.807 31.614 0.193 1
1 133 . 11 1 1 A 18 18 VAL N N 18 127.156 126.317 0.839 1
1 134 . 11 1 1 A 19 19 VAL H H 19 9.359 9.681 -0.322 1
1 135 . 11 1 1 A 19 19 VAL HA H 19 4.234 4.348 -0.114 1
1 143 . 11 1 1 A 19 19 VAL C C 19 175.738 175.811 -0.073 1
1 144 . 11 1 1 A 19 19 VAL CA C 19 62.060 62.230 -0.170 1
1 145 . 11 1 1 A 19 19 VAL CB C 19 33.822 33.337 0.485 1
1 148 . 11 1 1 A 19 19 VAL N N 19 125.162 122.069 3.093 1
1 149 . 11 1 1 A 20 20 LYS H H 20 7.584 7.391 0.193 1
1 150 . 11 1 1 A 20 20 LYS HA H 20 4.346 4.516 -0.170 1
1 159 . 11 1 1 A 20 20 LYS C C 20 172.818 173.976 -1.158 1
1 160 . 11 1 1 A 20 20 LYS CA C 20 56.801 55.550 1.251 1
1 161 . 11 1 1 A 20 20 LYS CB C 20 36.624 35.448 1.176 1
1 165 . 11 1 1 A 20 20 LYS N N 20 121.024 121.072 -0.048 1
1 166 . 11 1 1 A 21 21 GLN H H 21 8.625 8.528 0.097 1
1 167 . 11 1 1 A 21 21 GLN HA H 21 6.003 5.390 0.613 1
1 174 . 11 1 1 A 21 21 GLN C C 21 174.914 175.234 -0.320 1
1 175 . 11 1 1 A 21 21 GLN CA C 21 54.207 54.617 -0.410 1
1 176 . 11 1 1 A 21 21 GLN CB C 21 33.452 33.136 0.316 1
1 178 . 11 1 1 A 21 21 GLN N N 21 122.108 124.250 -2.142 1
1 180 . 11 1 1 A 22 22 GLY H H 22 8.964 8.465 0.499 1
1 181 . 11 1 1 A 22 22 GLY HA2 H 22 4.665 4.458 0.207 1
1 182 . 11 1 1 A 22 22 GLY HA3 H 22 4.295 4.607 -0.312 1
1 183 . 11 1 1 A 22 22 GLY C C 22 170.879 171.493 -0.614 1
1 184 . 11 1 1 A 22 22 GLY CA C 22 45.683 46.232 -0.549 1
1 185 . 11 1 1 A 22 22 GLY N N 22 108.508 109.427 -0.919 1
1 186 . 11 1 1 A 23 23 TYR H H 23 9.145 8.749 0.396 1
1 187 . 11 1 1 A 23 23 TYR HA H 23 5.595 5.644 -0.049 1
1 194 . 11 1 1 A 23 23 TYR C C 23 175.824 175.317 0.507 1
1 195 . 11 1 1 A 23 23 TYR CA C 23 58.019 56.663 1.356 1
1 196 . 11 1 1 A 23 23 TYR CB C 23 39.251 40.929 -1.678 1
1 201 . 11 1 1 A 23 23 TYR N N 23 120.809 119.954 0.855 1
1 202 . 11 1 1 A 24 24 LEU H H 24 8.935 9.550 -0.615 1
1 203 . 11 1 1 A 24 24 LEU HA H 24 4.716 5.019 -0.303 1
1 213 . 11 1 1 A 24 24 LEU C C 24 174.648 175.957 -1.309 1
1 214 . 11 1 1 A 24 24 LEU CA C 24 53.907 53.080 0.827 1
1 215 . 11 1 1 A 24 24 LEU CB C 24 46.078 44.530 1.548 1
1 219 . 11 1 1 A 24 24 LEU N N 24 122.887 124.760 -1.873 1
1 220 . 11 1 1 A 25 25 ALA H H 25 8.145 8.427 -0.282 1
1 221 . 11 1 1 A 25 25 ALA HA H 25 5.477 5.602 -0.125 1
1 225 . 11 1 1 A 25 25 ALA C C 25 175.751 175.566 0.185 1
1 226 . 11 1 1 A 25 25 ALA CA C 25 50.719 50.430 0.289 1
1 227 . 11 1 1 A 25 25 ALA CB C 25 21.074 20.899 0.175 1
1 228 . 11 1 1 A 25 25 ALA N N 25 122.280 123.130 -0.850 1
1 229 . 11 1 1 A 26 26 LYS H H 26 9.167 8.678 0.489 1
1 230 . 11 1 1 A 26 26 LYS HA H 26 5.221 4.465 0.756 1
1 239 . 11 1 1 A 26 26 LYS C C 26 175.421 175.794 -0.373 1
1 240 . 11 1 1 A 26 26 LYS CA C 26 54.383 55.360 -0.977 1
1 241 . 11 1 1 A 26 26 LYS CB C 26 36.125 33.711 2.414 1
1 245 . 11 1 1 A 26 26 LYS N N 26 120.638 125.285 -4.647 1
1 246 . 11 1 1 A 27 27 GLN H H 27 7.866 8.027 -0.161 1
1 247 . 11 1 1 A 27 27 GLN HA H 27 3.525 3.862 -0.337 1
1 254 . 11 1 1 A 27 27 GLN C C 27 177.022 176.056 0.966 1
1 255 . 11 1 1 A 27 27 GLN CA C 27 55.778 54.548 1.230 1
1 256 . 11 1 1 A 27 27 GLN CB C 27 29.864 28.458 1.406 1
1 258 . 11 1 1 A 27 27 GLN N N 27 130.194 125.665 4.529 1
1 260 . 11 1 1 A 28 28 GLY H H 28 8.565 8.442 0.123 1
1 261 . 11 1 1 A 28 28 GLY HA2 H 28 4.125 3.906 0.219 1
1 262 . 11 1 1 A 28 28 GLY HA3 H 28 4.034 3.917 0.117 1
1 263 . 11 1 1 A 28 28 GLY C C 28 174.030 174.731 -0.701 1
1 264 . 11 1 1 A 28 28 GLY CA C 28 45.665 45.381 0.284 1
1 265 . 11 1 1 A 28 28 GLY N N 28 115.528 113.487 2.041 1
1 266 . 11 1 1 A 29 29 HIS HA H 29 4.355 4.617 -0.262 1
1 271 . 11 1 1 A 29 29 HIS CA C 29 58.795 56.993 1.802 1
1 272 . 11 1 1 A 29 29 HIS CB C 29 31.283 32.026 -0.743 1
1 275 . 11 1 1 A 30 30 LYS HA H 30 4.096 4.605 -0.509 1
1 284 . 11 1 1 A 30 30 LYS CA C 30 57.290 54.859 2.431 1
1 285 . 11 1 1 A 30 30 LYS CB C 30 31.951 35.896 -3.945 1
1 289 . 11 1 1 A 31 31 ARG HA H 31 3.975 3.878 0.097 1
1 296 . 11 1 1 A 31 31 ARG CA C 31 55.973 58.544 -2.571 1
1 297 . 11 1 1 A 31 31 ARG CB C 31 29.902 28.823 1.079 1
1 300 . 11 1 1 A 32 32 LYS HA H 32 4.160 4.312 -0.152 1
1 309 . 11 1 1 A 32 32 LYS C C 32 175.678 176.057 -0.379 1
1 310 . 11 1 1 A 32 32 LYS CA C 32 56.254 56.327 -0.073 1
1 311 . 11 1 1 A 32 32 LYS CB C 32 31.602 32.219 -0.617 1
1 315 . 11 1 1 A 33 33 ASN H H 33 7.925 8.559 -0.634 1
1 316 . 11 1 1 A 33 33 ASN HA H 33 4.799 4.911 -0.112 1
1 321 . 11 1 1 A 33 33 ASN C C 33 174.005 175.593 -1.588 1
1 322 . 11 1 1 A 33 33 ASN CA C 33 52.407 52.825 -0.418 1
1 323 . 11 1 1 A 33 33 ASN CB C 33 39.879 39.797 0.082 1
1 324 . 11 1 1 A 33 33 ASN N N 33 116.990 123.109 -6.119 1
1 326 . 11 1 1 A 34 34 TRP H H 34 8.798 8.750 0.048 1
1 327 . 11 1 1 A 34 34 TRP HA H 34 4.755 4.761 -0.006 1
1 336 . 11 1 1 A 34 34 TRP C C 34 176.090 176.953 -0.863 1
1 337 . 11 1 1 A 34 34 TRP CA C 34 57.119 58.171 -1.052 1
1 338 . 11 1 1 A 34 34 TRP CB C 34 30.596 30.848 -0.252 1
1 344 . 11 1 1 A 34 34 TRP N N 34 121.917 120.527 1.390 1
1 346 . 11 1 1 A 35 35 LYS H H 35 8.404 8.840 -0.436 1
1 347 . 11 1 1 A 35 35 LYS HA H 35 4.846 4.994 -0.148 1
1 354 . 11 1 1 A 35 35 LYS C C 35 176.088 175.624 0.464 1
1 355 . 11 1 1 A 35 35 LYS CA C 35 54.418 55.065 -0.647 1
1 356 . 11 1 1 A 35 35 LYS CB C 35 36.125 35.959 0.166 1
1 360 . 11 1 1 A 35 35 LYS N N 35 120.864 121.743 -0.879 1
1 361 . 11 1 1 A 36 36 VAL H H 36 8.977 8.848 0.129 1
1 362 . 11 1 1 A 36 36 VAL HA H 36 4.274 4.618 -0.344 1
1 370 . 11 1 1 A 36 36 VAL C C 36 176.733 176.175 0.558 1
1 371 . 11 1 1 A 36 36 VAL CA C 36 64.319 62.915 1.404 1
1 372 . 11 1 1 A 36 36 VAL CB C 36 31.602 31.359 0.243 1
1 375 . 11 1 1 A 36 36 VAL N N 36 124.314 124.459 -0.145 1
1 376 . 11 1 1 A 37 37 ARG H H 37 9.498 10.269 -0.771 1
1 377 . 11 1 1 A 37 37 ARG HA H 37 5.053 5.212 -0.159 1
1 384 . 11 1 1 A 37 37 ARG C C 37 174.442 174.565 -0.123 1
1 385 . 11 1 1 A 37 37 ARG CA C 37 53.272 53.767 -0.495 1
1 386 . 11 1 1 A 37 37 ARG CB C 37 34.563 33.992 0.571 1
1 389 . 11 1 1 A 37 37 ARG N N 37 128.121 127.353 0.768 1
1 390 . 11 1 1 A 38 38 ARG H H 38 8.755 8.802 -0.047 1
1 391 . 11 1 1 A 38 38 ARG HA H 38 4.626 4.235 0.391 1
1 398 . 11 1 1 A 38 38 ARG C C 38 175.514 174.831 0.683 1
1 399 . 11 1 1 A 38 38 ARG CA C 38 55.601 55.526 0.075 1
1 400 . 11 1 1 A 38 38 ARG CB C 38 32.219 30.759 1.460 1
1 403 . 11 1 1 A 38 38 ARG N N 38 121.442 123.343 -1.901 1
1 404 . 11 1 1 A 39 39 PHE H H 39 9.865 8.870 0.995 1
1 405 . 11 1 1 A 39 39 PHE HA H 39 5.424 5.031 0.393 1
1 413 . 11 1 1 A 39 39 PHE C C 39 175.423 174.880 0.543 1
1 414 . 11 1 1 A 39 39 PHE CA C 39 57.419 56.897 0.522 1
1 415 . 11 1 1 A 39 39 PHE CB C 39 42.623 40.705 1.918 1
1 421 . 11 1 1 A 39 39 PHE N N 39 130.027 126.442 3.585 1
1 422 . 11 1 1 A 40 40 VAL H H 40 9.300 10.063 -0.763 1
1 423 . 11 1 1 A 40 40 VAL HA H 40 4.846 5.290 -0.444 1
1 431 . 11 1 1 A 40 40 VAL C C 40 174.477 173.550 0.927 1
1 432 . 11 1 1 A 40 40 VAL CA C 40 62.343 59.670 2.673 1
1 433 . 11 1 1 A 40 40 VAL CB C 40 35.755 34.812 0.943 1
1 436 . 11 1 1 A 40 40 VAL N N 40 119.369 122.629 -3.260 1
1 437 . 11 1 1 A 41 41 LEU H H 41 9.557 9.941 -0.384 1
1 438 . 11 1 1 A 41 41 LEU HA H 41 5.292 5.271 0.021 1
1 448 . 11 1 1 A 41 41 LEU C C 41 174.632 175.376 -0.744 1
1 449 . 11 1 1 A 41 41 LEU CA C 41 53.571 53.883 -0.312 1
1 450 . 11 1 1 A 41 41 LEU CB C 41 45.337 44.241 1.096 1
1 454 . 11 1 1 A 41 41 LEU N N 41 132.121 129.865 2.256 1
1 455 . 11 1 1 A 42 42 ARG H H 42 9.396 8.760 0.636 1
1 456 . 11 1 1 A 42 42 ARG HA H 42 5.366 5.603 -0.237 1
1 464 . 11 1 1 A 42 42 ARG C C 42 173.997 175.236 -1.239 1
1 465 . 11 1 1 A 42 42 ARG CA C 42 54.631 54.331 0.300 1
1 466 . 11 1 1 A 42 42 ARG CB C 42 35.550 33.639 1.911 1
1 469 . 11 1 1 A 42 42 ARG N N 42 128.120 125.119 3.001 1
1 471 . 11 1 1 A 43 43 LYS H H 43 8.597 9.767 -1.170 1
1 472 . 11 1 1 A 43 43 LYS HA H 43 4.558 4.929 -0.371 1
1 481 . 11 1 1 A 43 43 LYS C C 43 174.648 175.122 -0.474 1
1 482 . 11 1 1 A 43 43 LYS CA C 43 53.378 54.624 -1.246 1
1 483 . 11 1 1 A 43 43 LYS CB C 43 37.303 35.669 1.634 1
1 487 . 11 1 1 A 43 43 LYS N N 43 114.484 120.173 -5.689 1
1 488 . 11 1 1 A 44 44 ASP H H 44 8.388 8.824 -0.436 1
1 489 . 11 1 1 A 44 44 ASP HA H 44 4.349 4.164 0.185 1
1 492 . 11 1 1 A 44 44 ASP C C 44 173.376 174.527 -1.151 1
1 493 . 11 1 1 A 44 44 ASP CA C 44 54.842 54.770 0.072 1
1 494 . 11 1 1 A 44 44 ASP CB C 44 39.991 39.513 0.478 1
1 495 . 11 1 1 A 44 44 ASP N N 44 115.453 117.762 -2.309 1
1 496 . 11 1 1 A 45 45 PRO HA H 45 4.652 4.645 0.007 1
1 503 . 11 1 1 A 45 45 PRO C C 45 176.914 175.952 0.962 1
1 504 . 11 1 1 A 45 45 PRO CA C 45 63.490 62.736 0.754 1
1 505 . 11 1 1 A 45 45 PRO CB C 45 34.892 32.491 2.401 1
1 508 . 11 1 1 A 46 46 ALA H H 46 8.112 8.495 -0.383 1
1 509 . 11 1 1 A 46 46 ALA HA H 46 5.455 4.723 0.732 1
1 513 . 11 1 1 A 46 46 ALA C C 46 177.234 176.446 0.788 1
1 514 . 11 1 1 A 46 46 ALA CA C 46 51.560 51.298 0.262 1
1 515 . 11 1 1 A 46 46 ALA CB C 46 20.122 19.325 0.797 1
1 516 . 11 1 1 A 46 46 ALA N N 46 120.155 124.225 -4.070 1
1 517 . 11 1 1 A 47 47 PHE H H 47 8.717 9.047 -0.330 1
1 518 . 11 1 1 A 47 47 PHE HA H 47 4.795 5.241 -0.446 1
1 526 . 11 1 1 A 47 47 PHE C C 47 172.588 174.349 -1.761 1
1 527 . 11 1 1 A 47 47 PHE CA C 47 57.348 56.432 0.916 1
1 528 . 11 1 1 A 47 47 PHE CB C 47 47.123 44.341 2.782 1
1 534 . 11 1 1 A 47 47 PHE N N 47 129.946 120.165 9.781 1
1 535 . 11 1 1 A 48 48 LEU H H 48 7.883 8.538 -0.655 1
1 536 . 11 1 1 A 48 48 LEU HA H 48 5.198 4.995 0.203 1
1 546 . 11 1 1 A 48 48 LEU C C 48 173.569 174.350 -0.781 1
1 547 . 11 1 1 A 48 48 LEU CA C 48 53.290 54.636 -1.346 1
1 548 . 11 1 1 A 48 48 LEU CB C 48 45.502 45.462 0.040 1
1 552 . 11 1 1 A 48 48 LEU N N 48 121.108 121.068 0.040 1
1 553 . 11 1 1 A 49 49 HIS H H 49 8.606 8.964 -0.358 1
1 554 . 11 1 1 A 49 49 HIS HA H 49 5.035 4.870 0.165 1
1 559 . 11 1 1 A 49 49 HIS C C 49 173.993 173.395 0.598 1
1 560 . 11 1 1 A 49 49 HIS CA C 49 56.483 53.946 2.537 1
1 561 . 11 1 1 A 49 49 HIS CB C 49 35.919 33.429 2.490 1
1 564 . 11 1 1 A 49 49 HIS N N 49 121.199 125.226 -4.027 1
1 565 . 11 1 1 A 50 50 TYR H H 50 7.777 8.208 -0.431 1
1 566 . 11 1 1 A 50 50 TYR HA H 50 5.695 5.623 0.072 1
1 573 . 11 1 1 A 50 50 TYR C C 50 174.284 172.356 1.928 1
1 574 . 11 1 1 A 50 50 TYR CA C 50 53.430 55.059 -1.629 1
1 575 . 11 1 1 A 50 50 TYR CB C 50 38.552 41.344 -2.792 1
1 580 . 11 1 1 A 50 50 TYR N N 50 114.156 118.083 -3.927 1
1 581 . 11 1 1 A 51 51 TYR H H 51 9.323 10.026 -0.703 1
1 582 . 11 1 1 A 51 51 TYR HA H 51 4.600 5.186 -0.586 1
1 589 . 11 1 1 A 51 51 TYR C C 51 175.352 174.453 0.899 1
1 590 . 11 1 1 A 51 51 TYR CA C 51 57.330 56.354 0.976 1
1 591 . 11 1 1 A 51 51 TYR CB C 51 41.683 41.839 -0.156 1
1 596 . 11 1 1 A 51 51 TYR N N 51 119.100 120.250 -1.150 1
1 597 . 11 1 1 A 52 52 ASP H H 52 9.375 8.791 0.584 1
1 598 . 11 1 1 A 52 52 ASP HA H 52 5.064 5.086 -0.022 1
1 601 . 11 1 1 A 52 52 ASP C C 52 175.484 176.258 -0.774 1
1 602 . 11 1 1 A 52 52 ASP CA C 52 51.313 52.120 -0.807 1
1 603 . 11 1 1 A 52 52 ASP CB C 52 41.883 41.287 0.596 1
1 604 . 11 1 1 A 52 52 ASP N N 52 124.636 122.092 2.544 1
1 605 . 11 1 1 A 53 53 PRO HA H 53 4.678 4.497 0.181 1
1 612 . 11 1 1 A 53 53 PRO C C 53 176.781 177.782 -1.001 1
1 613 . 11 1 1 A 53 53 PRO CA C 53 64.054 64.873 -0.819 1
1 614 . 11 1 1 A 53 53 PRO CB C 53 32.589 32.300 0.289 1
1 617 . 11 1 1 A 54 54 SER H H 54 8.685 8.313 0.372 1
1 618 . 11 1 1 A 54 54 SER HA H 54 4.483 4.229 0.254 1
1 621 . 11 1 1 A 54 54 SER C C 54 174.006 174.156 -0.150 1
1 622 . 11 1 1 A 54 54 SER CA C 54 59.378 61.266 -1.888 1
1 623 . 11 1 1 A 54 54 SER CB C 54 64.132 63.006 1.126 1
1 624 . 11 1 1 A 54 54 SER N N 54 113.769 112.537 1.232 1
1 625 . 11 1 1 A 55 55 LYS H H 55 7.706 7.714 -0.008 1
1 626 . 11 1 1 A 55 55 LYS HA H 55 4.580 4.760 -0.180 1
1 635 . 11 1 1 A 55 55 LYS C C 55 175.969 175.491 0.478 1
1 636 . 11 1 1 A 55 55 LYS CA C 55 55.160 54.501 0.659 1
1 637 . 11 1 1 A 55 55 LYS CB C 55 34.069 35.060 -0.991 1
1 641 . 11 1 1 A 55 55 LYS N N 55 122.222 119.316 2.906 1
1 642 . 11 1 1 A 56 56 GLU H H 56 8.666 8.713 -0.047 1
1 643 . 11 1 1 A 56 56 GLU HA H 56 4.174 4.551 -0.377 1
1 648 . 11 1 1 A 56 56 GLU C C 56 177.084 176.117 0.967 1
1 649 . 11 1 1 A 56 56 GLU CA C 56 57.099 57.106 -0.007 1
1 650 . 11 1 1 A 56 56 GLU CB C 56 29.694 31.098 -1.404 1
1 652 . 11 1 1 A 56 56 GLU N N 56 122.015 118.773 3.242 1
1 653 . 11 1 1 A 57 57 GLU H H 57 8.303 8.466 -0.163 1
1 654 . 11 1 1 A 57 57 GLU HA H 57 4.214 4.341 -0.127 1
1 659 . 11 1 1 A 57 57 GLU CA C 57 56.960 57.273 -0.313 1
1 660 . 11 1 1 A 57 57 GLU CB C 57 30.264 28.800 1.464 1
1 662 . 11 1 1 A 57 57 GLU N N 57 119.884 120.308 -0.424 1
1 663 . 11 1 1 A 58 58 ASN HA H 58 4.768 4.846 -0.078 1
1 668 . 11 1 1 A 58 58 ASN C C 58 174.902 174.236 0.666 1
1 669 . 11 1 1 A 58 58 ASN CA C 58 52.740 52.761 -0.021 1
1 670 . 11 1 1 A 58 58 ASN CB C 58 38.116 36.493 1.623 1
1 672 . 11 1 1 A 59 59 ARG H H 59 7.805 8.511 -0.706 1
1 673 . 11 1 1 A 59 59 ARG HA H 59 4.762 4.705 0.057 1
1 680 . 11 1 1 A 59 59 ARG CA C 59 53.151 54.871 -1.720 1
1 681 . 11 1 1 A 59 59 ARG CB C 59 31.519 33.655 -2.136 1
1 684 . 11 1 1 A 59 59 ARG N N 59 121.060 120.797 0.263 1
1 685 . 11 1 1 A 60 60 PRO HA H 60 3.357 4.014 -0.657 1
1 692 . 11 1 1 A 60 60 PRO C C 60 176.817 176.133 0.684 1
1 693 . 11 1 1 A 60 60 PRO CA C 60 63.031 61.795 1.236 1
1 694 . 11 1 1 A 60 60 PRO CB C 60 31.273 32.379 -1.106 1
1 697 . 11 1 1 A 61 61 VAL H H 61 8.627 9.394 -0.767 1
1 698 . 11 1 1 A 61 61 VAL HA H 61 3.966 4.118 -0.152 1
1 706 . 11 1 1 A 61 61 VAL C C 61 176.503 175.896 0.607 1
1 707 . 11 1 1 A 61 61 VAL CA C 61 63.154 63.027 0.127 1
1 708 . 11 1 1 A 61 61 VAL CB C 61 32.048 32.795 -0.747 1
1 711 . 11 1 1 A 61 61 VAL N N 61 119.185 118.956 0.229 1
1 712 . 11 1 1 A 62 62 GLY H H 62 6.715 6.286 0.429 1
1 713 . 11 1 1 A 62 62 GLY HA2 H 62 3.940 3.764 0.176 1
1 714 . 11 1 1 A 62 62 GLY HA3 H 62 3.538 3.892 -0.354 1
1 715 . 11 1 1 A 62 62 GLY C C 62 169.983 171.650 -1.667 1
1 716 . 11 1 1 A 62 62 GLY CA C 62 44.465 45.724 -1.259 1
1 717 . 11 1 1 A 62 62 GLY N N 62 105.813 106.312 -0.499 1
1 718 . 11 1 1 A 63 63 GLY H H 63 8.004 8.193 -0.189 1
1 719 . 11 1 1 A 63 63 GLY HA2 H 63 4.095 3.088 1.007 1
1 720 . 11 1 1 A 63 63 GLY HA3 H 63 3.813 3.404 0.409 1
1 721 . 11 1 1 A 63 63 GLY C C 63 171.870 172.114 -0.244 1
1 722 . 11 1 1 A 63 63 GLY CA C 63 47.148 44.100 3.048 1
1 723 . 11 1 1 A 63 63 GLY N N 63 105.089 107.666 -2.577 1
1 724 . 11 1 1 A 64 64 PHE H H 64 7.967 7.524 0.443 1
1 725 . 11 1 1 A 64 64 PHE HA H 64 4.934 5.506 -0.572 1
1 733 . 11 1 1 A 64 64 PHE C C 64 173.140 174.196 -1.056 1
1 734 . 11 1 1 A 64 64 PHE CA C 64 55.248 55.408 -0.160 1
1 735 . 11 1 1 A 64 64 PHE CB C 64 40.238 42.295 -2.057 1
1 741 . 11 1 1 A 64 64 PHE N N 64 113.387 119.499 -6.112 1
1 742 . 11 1 1 A 65 65 SER H H 65 8.518 9.030 -0.512 1
1 743 . 11 1 1 A 65 65 SER HA H 65 3.264 4.124 -0.860 1
1 746 . 11 1 1 A 65 65 SER C C 65 176.417 174.347 2.070 1
1 747 . 11 1 1 A 65 65 SER CA C 65 56.819 57.774 -0.955 1
1 748 . 11 1 1 A 65 65 SER CB C 65 63.391 64.411 -1.020 1
1 749 . 11 1 1 A 65 65 SER N N 65 114.674 115.488 -0.814 1
1 750 . 11 1 1 A 66 66 LEU H H 66 7.404 7.678 -0.274 1
1 751 . 11 1 1 A 66 66 LEU HA H 66 4.470 4.896 -0.426 1
1 761 . 11 1 1 A 66 66 LEU C C 66 177.993 177.974 0.019 1
1 762 . 11 1 1 A 66 66 LEU CA C 66 54.242 55.076 -0.834 1
1 763 . 11 1 1 A 66 66 LEU CB C 66 42.787 42.647 0.140 1
1 767 . 11 1 1 A 66 66 LEU N N 66 123.988 121.738 2.250 1
1 768 . 11 1 1 A 67 67 ARG H H 67 7.865 7.775 0.090 1
1 769 . 11 1 1 A 67 67 ARG HA H 67 4.175 3.957 0.218 1
1 776 . 11 1 1 A 67 67 ARG C C 67 178.562 177.873 0.689 1
1 777 . 11 1 1 A 67 67 ARG CA C 67 58.143 59.309 -1.166 1
1 778 . 11 1 1 A 67 67 ARG CB C 67 29.052 30.092 -1.040 1
1 781 . 11 1 1 A 67 67 ARG N N 67 122.494 118.916 3.578 1
1 782 . 11 1 1 A 68 68 GLY H H 68 9.398 8.038 1.360 1
1 783 . 11 1 1 A 68 68 GLY HA2 H 68 4.066 3.941 0.125 1
1 784 . 11 1 1 A 68 68 GLY HA3 H 68 3.908 3.942 -0.034 1
1 785 . 11 1 1 A 68 68 GLY C C 68 173.982 174.043 -0.061 1
1 786 . 11 1 1 A 68 68 GLY CA C 68 46.230 45.925 0.305 1
1 787 . 11 1 1 A 68 68 GLY N N 68 117.548 107.666 9.882 1
1 788 . 11 1 1 A 69 69 SER H H 69 7.829 8.212 -0.383 1
1 789 . 11 1 1 A 69 69 SER HA H 69 4.807 5.160 -0.353 1
1 792 . 11 1 1 A 69 69 SER C C 69 172.854 172.987 -0.133 1
1 793 . 11 1 1 A 69 69 SER CA C 69 59.290 56.306 2.984 1
1 794 . 11 1 1 A 69 69 SER CB C 69 65.366 66.295 -0.929 1
1 795 . 11 1 1 A 69 69 SER N N 69 115.188 113.306 1.882 1
1 796 . 11 1 1 A 70 70 LEU H H 70 8.805 8.651 0.154 1
1 797 . 11 1 1 A 70 70 LEU HA H 70 4.846 4.832 0.014 1
1 807 . 11 1 1 A 70 70 LEU C C 70 175.775 174.276 1.499 1
1 808 . 11 1 1 A 70 70 LEU CA C 70 53.907 54.065 -0.158 1
1 809 . 11 1 1 A 70 70 LEU CB C 70 45.337 46.460 -1.123 1
1 813 . 11 1 1 A 70 70 LEU N N 70 121.265 122.801 -1.536 1
1 814 . 11 1 1 A 71 71 VAL H H 71 8.644 8.829 -0.185 1
1 815 . 11 1 1 A 71 71 VAL HA H 71 5.555 5.246 0.309 1
1 823 . 11 1 1 A 71 71 VAL C C 71 173.636 173.311 0.325 1
1 824 . 11 1 1 A 71 71 VAL CA C 71 58.760 59.618 -0.858 1
1 825 . 11 1 1 A 71 71 VAL CB C 71 34.891 35.782 -0.891 1
1 828 . 11 1 1 A 71 71 VAL N N 71 122.315 122.771 -0.456 1
1 829 . 11 1 1 A 72 72 SER H H 72 8.750 8.790 -0.040 1
1 830 . 11 1 1 A 72 72 SER HA H 72 4.742 5.003 -0.261 1
1 833 . 11 1 1 A 72 72 SER C C 72 173.058 172.604 0.454 1
1 834 . 11 1 1 A 72 72 SER CA C 72 57.190 57.686 -0.496 1
1 835 . 11 1 1 A 72 72 SER CB C 72 65.612 67.350 -1.738 1
1 836 . 11 1 1 A 72 72 SER N N 72 118.611 123.362 -4.751 1
1 837 . 11 1 1 A 73 73 ALA H H 73 9.009 8.753 0.256 1
1 838 . 11 1 1 A 73 73 ALA HA H 73 4.406 5.185 -0.779 1
1 842 . 11 1 1 A 73 73 ALA C C 73 176.708 176.793 -0.085 1
1 843 . 11 1 1 A 73 73 ALA CA C 73 52.672 50.330 2.342 1
1 844 . 11 1 1 A 73 73 ALA CB C 73 18.812 21.754 -2.942 1
1 845 . 11 1 1 A 73 73 ALA N N 73 125.694 125.656 0.038 1
1 846 . 11 1 1 A 74 74 LEU H H 74 7.800 8.546 -0.746 1
1 847 . 11 1 1 A 74 74 LEU HA H 74 4.716 4.692 0.024 1
1 857 . 11 1 1 A 74 74 LEU C C 74 176.551 175.694 0.857 1
1 858 . 11 1 1 A 74 74 LEU CA C 74 53.784 53.960 -0.176 1
1 859 . 11 1 1 A 74 74 LEU CB C 74 43.446 41.500 1.946 1
1 863 . 11 1 1 A 74 74 LEU N N 74 122.271 121.268 1.003 1
1 864 . 11 1 1 A 75 75 GLU H H 75 8.855 8.772 0.083 1
1 865 . 11 1 1 A 75 75 GLU HA H 75 4.336 4.832 -0.496 1
1 870 . 11 1 1 A 75 75 GLU C C 75 176.465 175.491 0.974 1
1 871 . 11 1 1 A 75 75 GLU CA C 75 56.507 54.898 1.609 1
1 872 . 11 1 1 A 75 75 GLU CB C 75 30.245 33.055 -2.810 1
1 874 . 11 1 1 A 75 75 GLU N N 75 122.678 122.683 -0.005 1
1 875 . 11 1 1 A 76 76 ASP H H 76 8.542 9.433 -0.891 1
1 876 . 11 1 1 A 76 76 ASP HA H 76 4.665 4.514 0.151 1
1 879 . 11 1 1 A 76 76 ASP C C 76 176.087 175.484 0.603 1
1 880 . 11 1 1 A 76 76 ASP CA C 76 55.107 55.851 -0.744 1
1 881 . 11 1 1 A 76 76 ASP CB C 76 41.431 40.218 1.213 1
1 882 . 11 1 1 A 76 76 ASP N N 76 121.488 121.423 0.065 1
1 883 . 11 1 1 A 77 77 ASN H H 77 8.322 8.910 -0.588 1
1 884 . 11 1 1 A 77 77 ASN HA H 77 4.729 4.520 0.209 1
1 889 . 11 1 1 A 77 77 ASN C C 77 175.566 176.281 -0.715 1
1 890 . 11 1 1 A 77 77 ASN CA C 77 53.131 54.224 -1.093 1
1 891 . 11 1 1 A 77 77 ASN CB C 77 38.617 37.283 1.334 1
1 892 . 11 1 1 A 77 77 ASN N N 77 118.676 118.800 -0.124 1
1 894 . 11 1 1 A 78 78 GLY H H 78 8.311 8.702 -0.391 1
1 895 . 11 1 1 A 78 78 GLY HA2 H 78 3.897 3.838 0.059 1
1 896 . 11 1 1 A 78 78 GLY HA3 H 78 3.897 3.838 0.059 1
1 897 . 11 1 1 A 78 78 GLY C C 78 173.376 175.381 -2.005 1
1 898 . 11 1 1 A 78 78 GLY CA C 78 45.224 47.358 -2.134 1
1 899 . 11 1 1 A 78 78 GLY N N 78 108.939 111.571 -2.632 1
1 900 . 11 1 1 A 79 79 VAL H H 79 7.882 7.986 -0.104 1
1 901 . 11 1 1 A 79 79 VAL HA H 79 4.345 4.171 0.174 1
1 909 . 11 1 1 A 79 79 VAL CA C 79 59.995 60.870 -0.875 1
1 910 . 11 1 1 A 79 79 VAL CB C 79 32.589 32.483 0.106 1
1 913 . 11 1 1 A 79 79 VAL N N 79 121.135 118.925 2.210 1
1 914 . 11 1 1 A 80 80 PRO HA H 80 4.461 4.662 -0.201 1
1 921 . 11 1 1 A 80 80 PRO C C 80 176.979 176.991 -0.012 1
1 922 . 11 1 1 A 80 80 PRO CA C 80 63.101 63.478 -0.377 1
1 923 . 11 1 1 A 80 80 PRO CB C 80 32.177 31.736 0.441 1
1 926 . 11 1 1 A 81 81 THR H H 81 8.281 8.575 -0.294 1
1 927 . 11 1 1 A 81 81 THR HA H 81 4.095 4.079 0.016 1
1 932 . 11 1 1 A 81 81 THR C C 81 175.270 174.519 0.751 1
1 933 . 11 1 1 A 81 81 THR CA C 81 62.872 64.658 -1.786 1
1 934 . 11 1 1 A 81 81 THR CB C 81 69.642 67.700 1.942 1
1 936 . 11 1 1 A 81 81 THR N N 81 114.684 111.061 3.623 1
1 937 . 11 1 1 A 82 82 GLY H H 82 8.338 8.532 -0.194 1
1 938 . 11 1 1 A 82 82 GLY HA2 H 82 4.095 4.017 0.078 1
1 939 . 11 1 1 A 82 82 GLY HA3 H 82 3.668 4.038 -0.370 1
1 940 . 11 1 1 A 82 82 GLY C C 82 174.139 174.180 -0.041 1
1 941 . 11 1 1 A 82 82 GLY CA C 82 45.083 45.321 -0.238 1
1 942 . 11 1 1 A 82 82 GLY N N 82 111.289 112.793 -1.504 1
1 943 . 11 1 1 A 83 83 VAL H H 83 7.668 8.231 -0.563 1
1 944 . 11 1 1 A 83 83 VAL HA H 83 3.985 3.808 0.177 1
1 952 . 11 1 1 A 83 83 VAL C C 83 176.054 176.362 -0.308 1
1 953 . 11 1 1 A 83 83 VAL CA C 83 62.431 62.945 -0.514 1
1 954 . 11 1 1 A 83 83 VAL CB C 83 32.260 31.956 0.304 1
1 957 . 11 1 1 A 83 83 VAL N N 83 120.003 120.547 -0.544 1
1 958 . 11 1 1 A 84 84 LYS H H 84 8.645 8.549 0.096 1
1 959 . 11 1 1 A 84 84 LYS HA H 84 4.276 3.949 0.327 1
1 968 . 11 1 1 A 84 84 LYS C C 84 176.832 177.774 -0.942 1
1 969 . 11 1 1 A 84 84 LYS CA C 84 56.272 59.344 -3.072 1
1 970 . 11 1 1 A 84 84 LYS CB C 84 32.876 32.489 0.387 1
1 974 . 11 1 1 A 84 84 LYS N N 84 126.447 125.846 0.601 1
1 975 . 11 1 1 A 85 85 GLY H H 85 8.410 7.996 0.414 1
1 976 . 11 1 1 A 85 85 GLY HA2 H 85 4.066 3.973 0.093 1
1 977 . 11 1 1 A 85 85 GLY HA3 H 85 3.781 3.978 -0.197 1
1 978 . 11 1 1 A 85 85 GLY C C 85 173.969 174.357 -0.388 1
1 979 . 11 1 1 A 85 85 GLY CA C 85 45.146 45.276 -0.130 1
1 980 . 11 1 1 A 85 85 GLY N N 85 109.957 108.768 1.189 1
1 981 . 11 1 1 A 86 86 ASN H H 86 8.298 8.729 -0.431 1
1 982 . 11 1 1 A 86 86 ASN HA H 86 4.665 4.712 -0.047 1
1 987 . 11 1 1 A 86 86 ASN C C 86 174.987 175.292 -0.305 1
1 988 . 11 1 1 A 86 86 ASN CA C 86 52.989 53.756 -0.767 1
1 989 . 11 1 1 A 86 86 ASN CB C 86 38.376 38.843 -0.467 1
1 990 . 11 1 1 A 86 86 ASN N N 86 118.457 122.525 -4.068 1
1 992 . 11 1 1 A 87 87 VAL H H 87 7.660 8.588 -0.928 1
1 993 . 11 1 1 A 87 87 VAL HA H 87 3.946 4.281 -0.335 1
1 1001 . 11 1 1 A 87 87 VAL C C 87 174.902 177.122 -2.220 1
1 1002 . 11 1 1 A 87 87 VAL CA C 87 62.307 61.147 1.160 1
1 1003 . 11 1 1 A 87 87 VAL CB C 87 32.548 32.459 0.089 1
1 1006 . 11 1 1 A 87 87 VAL N N 87 120.557 121.266 -0.709 1
1 1007 . 11 1 1 A 88 88 GLN H H 88 8.115 8.180 -0.065 1
1 1008 . 11 1 1 A 88 88 GLN HA H 88 4.302 4.133 0.169 1
1 1015 . 11 1 1 A 88 88 GLN C C 88 175.637 176.182 -0.545 1
1 1016 . 11 1 1 A 88 88 GLN CA C 88 55.336 58.052 -2.716 1
1 1017 . 11 1 1 A 88 88 GLN CB C 88 30.574 28.835 1.739 1
1 1019 . 11 1 1 A 88 88 GLN N N 88 122.280 122.119 0.161 1
1 1021 . 11 1 1 A 89 89 GLY H H 89 8.544 7.423 1.121 1
1 1022 . 11 1 1 A 89 89 GLY HA2 H 89 3.885 3.973 -0.088 1
1 1023 . 11 1 1 A 89 89 GLY HA3 H 89 3.885 3.974 -0.089 1
1 1024 . 11 1 1 A 89 89 GLY C C 89 172.861 174.515 -1.654 1
1 1025 . 11 1 1 A 89 89 GLY CA C 89 44.889 45.940 -1.051 1
1 1026 . 11 1 1 A 89 89 GLY N N 89 110.135 104.083 6.052 1
1 1027 . 11 1 1 A 90 90 ASN H H 90 8.451 8.195 0.256 1
1 1028 . 11 1 1 A 90 90 ASN HA H 90 4.222 4.870 -0.648 1
1 1033 . 11 1 1 A 90 90 ASN C C 90 174.926 173.789 1.137 1
1 1034 . 11 1 1 A 90 90 ASN CA C 90 54.613 52.361 2.252 1
1 1035 . 11 1 1 A 90 90 ASN CB C 90 37.852 36.708 1.144 1
1 1036 . 11 1 1 A 90 90 ASN N N 90 114.322 119.289 -4.967 1
1 1038 . 11 1 1 A 91 91 LEU H H 91 8.933 8.802 0.131 1
1 1039 . 11 1 1 A 91 91 LEU HA H 91 5.367 5.056 0.311 1
1 1049 . 11 1 1 A 91 91 LEU C C 91 178.732 175.627 3.105 1
1 1050 . 11 1 1 A 91 91 LEU CA C 91 55.160 53.504 1.656 1
1 1051 . 11 1 1 A 91 91 LEU CB C 91 45.461 43.368 2.093 1
1 1055 . 11 1 1 A 91 91 LEU N N 91 120.057 123.708 -3.651 1
1 1056 . 11 1 1 A 92 92 PHE H H 92 9.901 8.176 1.725 1
1 1057 . 11 1 1 A 92 92 PHE HA H 92 5.105 5.252 -0.147 1
1 1065 . 11 1 1 A 92 92 PHE C C 92 170.140 172.614 -2.474 1
1 1066 . 11 1 1 A 92 92 PHE CA C 92 56.236 56.136 0.100 1
1 1067 . 11 1 1 A 92 92 PHE CB C 92 42.664 40.984 1.680 1
1 1073 . 11 1 1 A 92 92 PHE N N 92 119.740 116.853 2.887 1
1 1074 . 11 1 1 A 93 93 LYS H H 93 9.154 8.991 0.163 1
1 1075 . 11 1 1 A 93 93 LYS HA H 93 5.584 5.209 0.375 1
1 1083 . 11 1 1 A 93 93 LYS C C 93 174.830 175.131 -0.301 1
1 1084 . 11 1 1 A 93 93 LYS CA C 93 53.148 53.905 -0.757 1
1 1085 . 11 1 1 A 93 93 LYS CB C 93 36.660 36.147 0.513 1
1 1089 . 11 1 1 A 93 93 LYS N N 93 117.710 118.501 -0.791 1
1 1090 . 11 1 1 A 94 94 VAL H H 94 8.507 8.896 -0.389 1
1 1091 . 11 1 1 A 94 94 VAL HA H 94 4.872 5.061 -0.189 1
1 1099 . 11 1 1 A 94 94 VAL C C 94 174.408 175.035 -0.627 1
1 1100 . 11 1 1 A 94 94 VAL CA C 94 60.525 61.683 -1.158 1
1 1101 . 11 1 1 A 94 94 VAL CB C 94 34.862 33.868 0.994 1
1 1104 . 11 1 1 A 94 94 VAL N N 94 121.741 120.665 1.076 1
1 1105 . 11 1 1 A 95 95 ILE H H 95 8.959 8.874 0.085 1
1 1106 . 11 1 1 A 95 95 ILE HA H 95 4.794 4.658 0.136 1
1 1116 . 11 1 1 A 95 95 ILE C C 95 177.642 176.117 1.525 1
1 1117 . 11 1 1 A 95 95 ILE CA C 95 59.713 60.327 -0.614 1
1 1118 . 11 1 1 A 95 95 ILE CB C 95 40.032 38.060 1.972 1
1 1122 . 11 1 1 A 95 95 ILE N N 95 126.794 128.452 -1.658 1
1 1123 . 11 1 1 A 96 96 THR H H 96 8.765 8.861 -0.096 1
1 1124 . 11 1 1 A 96 96 THR HA H 96 4.584 4.866 -0.282 1
1 1129 . 11 1 1 A 96 96 THR C C 96 177.023 176.121 0.902 1
1 1130 . 11 1 1 A 96 96 THR CA C 96 61.372 60.599 0.773 1
1 1131 . 11 1 1 A 96 96 THR CB C 96 70.794 71.459 -0.665 1
1 1133 . 11 1 1 A 96 96 THR N N 96 117.225 120.056 -2.831 1
1 1134 . 11 1 1 A 97 97 LYS H H 97 8.736 8.998 -0.262 1
1 1135 . 11 1 1 A 97 97 LYS HA H 97 4.101 4.111 -0.010 1
1 1144 . 11 1 1 A 97 97 LYS C C 97 176.490 176.843 -0.353 1
1 1145 . 11 1 1 A 97 97 LYS CA C 97 58.583 58.474 0.109 1
1 1146 . 11 1 1 A 97 97 LYS CB C 97 31.848 32.044 -0.196 1
1 1150 . 11 1 1 A 97 97 LYS N N 97 120.457 119.552 0.905 1
1 1151 . 11 1 1 A 98 98 ASP H H 98 7.762 7.967 -0.205 1
1 1152 . 11 1 1 A 98 98 ASP HA H 98 4.633 4.764 -0.131 1
1 1155 . 11 1 1 A 98 98 ASP C C 98 175.270 174.805 0.465 1
1 1156 . 11 1 1 A 98 98 ASP CA C 98 53.272 53.938 -0.666 1
1 1157 . 11 1 1 A 98 98 ASP CB C 98 39.909 40.868 -0.959 1
1 1158 . 11 1 1 A 98 98 ASP N N 98 116.281 118.520 -2.239 1
1 1159 . 11 1 1 A 99 99 ASP H H 99 8.340 8.057 0.283 1
1 1160 . 11 1 1 A 99 99 ASP HA H 99 4.245 4.597 -0.352 1
1 1163 . 11 1 1 A 99 99 ASP C C 99 175.315 175.839 -0.524 1
1 1164 . 11 1 1 A 99 99 ASP CA C 99 55.989 55.355 0.634 1
1 1165 . 11 1 1 A 99 99 ASP CB C 99 39.827 39.504 0.323 1
1 1166 . 11 1 1 A 99 99 ASP N N 99 116.687 117.492 -0.805 1
1 1167 . 11 1 1 A 100 100 THR H H 100 7.511 7.609 -0.098 1
1 1168 . 11 1 1 A 100 100 THR HA H 100 4.185 3.746 0.439 1
1 1173 . 11 1 1 A 100 100 THR C C 100 173.376 174.596 -1.220 1
1 1174 . 11 1 1 A 100 100 THR CA C 100 63.489 66.458 -2.969 1
1 1175 . 11 1 1 A 100 100 THR CB C 100 67.909 68.936 -1.027 1
1 1177 . 11 1 1 A 100 100 THR N N 100 116.525 111.255 5.270 1
1 1178 . 11 1 1 A 101 101 HIS H H 101 8.753 8.074 0.679 1
1 1179 . 11 1 1 A 101 101 HIS HA H 101 4.898 4.209 0.689 1
1 1184 . 11 1 1 A 101 101 HIS C C 101 174.345 173.593 0.752 1
1 1185 . 11 1 1 A 101 101 HIS CA C 101 55.072 56.082 -1.010 1
1 1186 . 11 1 1 A 101 101 HIS CB C 101 32.835 27.971 4.864 1
1 1189 . 11 1 1 A 101 101 HIS N N 101 125.953 116.857 9.096 1
1 1190 . 11 1 1 A 102 102 TYR H H 102 9.023 9.058 -0.035 1
1 1191 . 11 1 1 A 102 102 TYR HA H 102 4.545 5.034 -0.489 1
1 1198 . 11 1 1 A 102 102 TYR C C 102 174.126 175.036 -0.910 1
1 1199 . 11 1 1 A 102 102 TYR CA C 102 57.260 56.506 0.754 1
1 1200 . 11 1 1 A 102 102 TYR CB C 102 40.381 39.277 1.104 1
1 1205 . 11 1 1 A 102 102 TYR N N 102 121.975 122.583 -0.608 1
1 1206 . 11 1 1 A 103 103 TYR H H 103 8.899 9.057 -0.158 1
1 1207 . 11 1 1 A 103 103 TYR HA H 103 4.729 4.787 -0.058 1
1 1214 . 11 1 1 A 103 103 TYR C C 103 174.139 175.961 -1.822 1
1 1215 . 11 1 1 A 103 103 TYR CA C 103 58.036 58.174 -0.138 1
1 1216 . 11 1 1 A 103 103 TYR CB C 103 40.485 39.536 0.949 1
1 1221 . 11 1 1 A 103 103 TYR N N 103 122.012 123.558 -1.546 1
1 1222 . 11 1 1 A 104 104 ILE H H 104 8.605 8.575 0.030 1
1 1223 . 11 1 1 A 104 104 ILE HA H 104 4.859 4.903 -0.044 1
1 1233 . 11 1 1 A 104 104 ILE C C 104 172.769 174.300 -1.531 1
1 1234 . 11 1 1 A 104 104 ILE CA C 104 59.554 59.555 -0.001 1
1 1235 . 11 1 1 A 104 104 ILE CB C 104 40.631 42.264 -1.633 1
1 1239 . 11 1 1 A 104 104 ILE N N 104 123.443 123.119 0.324 1
1 1240 . 11 1 1 A 105 105 GLN H H 105 9.369 8.190 1.179 1
1 1241 . 11 1 1 A 105 105 GLN HA H 105 4.895 4.989 -0.094 1
1 1248 . 11 1 1 A 105 105 GLN C C 105 175.642 174.684 0.958 1
1 1249 . 11 1 1 A 105 105 GLN CA C 105 54.965 53.847 1.118 1
1 1250 . 11 1 1 A 105 105 GLN CB C 105 32.856 32.443 0.413 1
1 1252 . 11 1 1 A 105 105 GLN N N 105 125.079 124.466 0.613 1
1 1254 . 11 1 1 A 106 106 ALA H H 106 8.513 8.359 0.154 1
1 1255 . 11 1 1 A 106 106 ALA HA H 106 4.962 4.866 0.096 1
1 1259 . 11 1 1 A 106 106 ALA C C 106 175.854 178.088 -2.234 1
1 1260 . 11 1 1 A 106 106 ALA CA C 106 50.272 50.110 0.162 1
1 1261 . 11 1 1 A 106 106 ALA CB C 106 21.197 22.251 -1.054 1
1 1262 . 11 1 1 A 106 106 ALA N N 106 129.303 128.012 1.291 1
1 1263 . 11 1 1 A 107 107 SER H H 107 9.468 9.102 0.366 1
1 1264 . 11 1 1 A 107 107 SER HA H 107 4.447 4.313 0.134 1
1 1267 . 11 1 1 A 107 107 SER C C 107 173.785 173.629 0.156 1
1 1268 . 11 1 1 A 107 107 SER CA C 107 60.048 61.326 -1.278 1
1 1269 . 11 1 1 A 107 107 SER CB C 107 64.643 63.607 1.036 1
1 1270 . 11 1 1 A 107 107 SER N N 107 112.962 115.376 -2.414 1
1 1271 . 11 1 1 A 108 108 SER H H 108 7.555 7.877 -0.322 1
1 1272 . 11 1 1 A 108 108 SER HA H 108 4.665 4.903 -0.238 1
1 1275 . 11 1 1 A 108 108 SER C C 108 174.381 174.788 -0.407 1
1 1276 . 11 1 1 A 108 108 SER CA C 108 56.907 57.452 -0.545 1
1 1277 . 11 1 1 A 108 108 SER CB C 108 66.370 66.942 -0.572 1
1 1278 . 11 1 1 A 108 108 SER N N 108 112.243 112.604 -0.361 1
1 1279 . 11 1 1 A 109 109 LYS H H 109 8.978 8.693 0.285 1
1 1280 . 11 1 1 A 109 109 LYS HA H 109 4.777 3.962 0.815 1
1 1287 . 11 1 1 A 109 109 LYS C C 109 179.992 177.720 2.272 1
1 1288 . 11 1 1 A 109 109 LYS CA C 109 59.766 60.217 -0.451 1
1 1289 . 11 1 1 A 109 109 LYS CB C 109 32.342 32.043 0.299 1
1 1293 . 11 1 1 A 109 109 LYS N N 109 123.170 124.685 -1.515 1
1 1294 . 11 1 1 A 110 110 ALA H H 110 8.608 8.129 0.479 1
1 1295 . 11 1 1 A 110 110 ALA HA H 110 4.178 4.008 0.170 1
1 1299 . 11 1 1 A 110 110 ALA C C 110 179.895 179.296 0.599 1
1 1300 . 11 1 1 A 110 110 ALA CA C 110 54.871 55.471 -0.600 1
1 1301 . 11 1 1 A 110 110 ALA CB C 110 18.065 18.451 -0.386 1
1 1302 . 11 1 1 A 110 110 ALA N N 110 123.750 121.280 2.470 1
1 1303 . 11 1 1 A 111 111 GLU H H 111 8.185 8.278 -0.093 1
1 1304 . 11 1 1 A 111 111 GLU HA H 111 4.180 4.055 0.125 1
1 1309 . 11 1 1 A 111 111 GLU C C 111 178.587 178.945 -0.358 1
1 1310 . 11 1 1 A 111 111 GLU CA C 111 59.466 59.831 -0.365 1
1 1311 . 11 1 1 A 111 111 GLU CB C 111 31.067 29.399 1.668 1
1 1313 . 11 1 1 A 111 111 GLU N N 111 119.757 118.552 1.205 1
1 1314 . 11 1 1 A 112 112 ARG H H 112 8.008 7.952 0.056 1
1 1315 . 11 1 1 A 112 112 ARG HA H 112 3.642 4.264 -0.622 1
1 1322 . 11 1 1 A 112 112 ARG C C 112 176.481 178.132 -1.651 1
1 1323 . 11 1 1 A 112 112 ARG CA C 112 60.419 59.704 0.715 1
1 1324 . 11 1 1 A 112 112 ARG CB C 112 29.957 30.192 -0.235 1
1 1327 . 11 1 1 A 112 112 ARG N N 112 118.430 120.030 -1.600 1
1 1328 . 11 1 1 A 113 113 ALA H H 113 7.985 7.880 0.105 1
1 1329 . 11 1 1 A 113 113 ALA HA H 113 3.925 4.086 -0.161 1
1 1333 . 11 1 1 A 113 113 ALA C C 113 180.117 179.633 0.484 1
1 1334 . 11 1 1 A 113 113 ALA CA C 113 55.372 55.185 0.187 1
1 1335 . 11 1 1 A 113 113 ALA CB C 113 17.825 18.606 -0.781 1
1 1336 . 11 1 1 A 113 113 ALA N N 113 119.980 120.732 -0.752 1
1 1337 . 11 1 1 A 114 114 GLU H H 114 8.093 8.213 -0.120 1
1 1338 . 11 1 1 A 114 114 GLU HA H 114 3.936 3.941 -0.005 1
1 1343 . 11 1 1 A 114 114 GLU C C 114 180.586 179.277 1.309 1
1 1344 . 11 1 1 A 114 114 GLU CA C 114 59.148 59.158 -0.010 1
1 1345 . 11 1 1 A 114 114 GLU CB C 114 30.080 29.028 1.052 1
1 1347 . 11 1 1 A 114 114 GLU N N 114 117.168 117.340 -0.172 1
1 1348 . 11 1 1 A 115 115 TRP H H 115 7.980 8.561 -0.581 1
1 1349 . 11 1 1 A 115 115 TRP HA H 115 3.775 4.400 -0.625 1
1 1358 . 11 1 1 A 115 115 TRP C C 115 177.714 178.619 -0.905 1
1 1359 . 11 1 1 A 115 115 TRP CA C 115 62.696 59.566 3.130 1
1 1360 . 11 1 1 A 115 115 TRP CB C 115 29.052 29.128 -0.076 1
1 1366 . 11 1 1 A 115 115 TRP N N 115 120.974 120.706 0.268 1
1 1368 . 11 1 1 A 116 116 ILE H H 116 8.297 8.825 -0.528 1
1 1369 . 11 1 1 A 116 116 ILE HA H 116 3.270 3.471 -0.201 1
1 1379 . 11 1 1 A 116 116 ILE C C 116 177.568 177.721 -0.153 1
1 1380 . 11 1 1 A 116 116 ILE CA C 116 66.643 64.366 2.277 1
1 1381 . 11 1 1 A 116 116 ILE CB C 116 37.606 37.463 0.143 1
1 1385 . 11 1 1 A 116 116 ILE N N 116 118.408 120.327 -1.919 1
1 1386 . 11 1 1 A 117 117 GLU H H 117 8.026 9.095 -1.069 1
1 1387 . 11 1 1 A 117 117 GLU HA H 117 3.880 3.953 -0.073 1
1 1392 . 11 1 1 A 117 117 GLU C C 117 178.476 179.092 -0.616 1
1 1393 . 11 1 1 A 117 117 GLU CA C 117 59.219 59.647 -0.428 1
1 1394 . 11 1 1 A 117 117 GLU CB C 117 29.381 29.340 0.041 1
1 1396 . 11 1 1 A 117 117 GLU N N 117 117.096 120.302 -3.206 1
1 1397 . 11 1 1 A 118 118 ALA H H 118 7.555 8.181 -0.626 1
1 1398 . 11 1 1 A 118 118 ALA HA H 118 3.952 4.059 -0.107 1
1 1402 . 11 1 1 A 118 118 ALA C C 118 179.862 179.947 -0.085 1
1 1403 . 11 1 1 A 118 118 ALA CA C 118 54.772 55.065 -0.293 1
1 1404 . 11 1 1 A 118 118 ALA CB C 118 18.277 18.607 -0.330 1
1 1405 . 11 1 1 A 118 118 ALA N N 118 119.817 121.797 -1.980 1
1 1406 . 11 1 1 A 119 119 ILE H H 119 8.167 7.962 0.205 1
1 1407 . 11 1 1 A 119 119 ILE HA H 119 3.558 3.750 -0.192 1
1 1417 . 11 1 1 A 119 119 ILE C C 119 178.564 177.959 0.605 1
1 1418 . 11 1 1 A 119 119 ILE CA C 119 65.766 65.247 0.519 1
1 1419 . 11 1 1 A 119 119 ILE CB C 119 38.840 37.746 1.094 1
1 1423 . 11 1 1 A 119 119 ILE N N 119 116.280 118.012 -1.732 1
1 1424 . 11 1 1 A 120 120 LYS H H 120 8.790 8.092 0.698 1
1 1425 . 11 1 1 A 120 120 LYS HA H 120 3.965 4.101 -0.136 1
1 1434 . 11 1 1 A 120 120 LYS C C 120 179.673 179.434 0.239 1
1 1435 . 11 1 1 A 120 120 LYS CA C 120 60.031 60.275 -0.244 1
1 1436 . 11 1 1 A 120 120 LYS CB C 120 32.547 32.290 0.257 1
1 1440 . 11 1 1 A 120 120 LYS N N 120 119.650 119.002 0.648 1
1 1441 . 11 1 1 A 121 121 LYS H H 121 7.594 7.972 -0.378 1
1 1442 . 11 1 1 A 121 121 LYS HA H 121 4.095 3.967 0.128 1
1 1451 . 11 1 1 A 121 121 LYS C C 121 177.962 179.035 -1.073 1
1 1452 . 11 1 1 A 121 121 LYS CA C 121 58.848 59.176 -0.328 1
1 1453 . 11 1 1 A 121 121 LYS CB C 121 32.547 32.252 0.295 1
1 1457 . 11 1 1 A 121 121 LYS N N 121 117.197 119.728 -2.531 1
1 1458 . 11 1 1 A 122 122 LEU H H 122 7.586 7.787 -0.201 1
1 1459 . 11 1 1 A 122 122 LEU HA H 122 4.535 4.015 0.520 1
1 1469 . 11 1 1 A 122 122 LEU C C 122 177.902 178.150 -0.248 1
1 1470 . 11 1 1 A 122 122 LEU CA C 122 55.071 57.925 -2.854 1
1 1471 . 11 1 1 A 122 122 LEU CB C 122 42.888 41.870 1.018 1
1 1475 . 11 1 1 A 122 122 LEU N N 122 116.861 120.550 -3.689 1
1 1476 . 11 1 1 A 123 123 THR H H 123 7.636 7.813 -0.177 1
1 1477 . 11 1 1 A 123 123 THR HA H 123 4.445 4.391 0.054 1
1 1482 . 11 1 1 A 123 123 THR C C 123 175.714 174.208 1.506 1
1 1483 . 11 1 1 A 123 123 THR CA C 123 62.643 61.612 1.031 1
1 1484 . 11 1 1 A 123 123 THR CB C 123 70.259 68.118 2.141 1
1 1486 . 11 1 1 A 123 123 THR N N 123 108.963 109.258 -0.295 1
1 1487 . 11 1 1 A 124 124 SER H H 124 7.912 8.669 -0.757 1
1 1488 . 11 1 1 A 124 124 SER HA H 124 4.626 4.331 0.295 1
1 1491 . 11 1 1 A 124 124 SER C C 124 174.405 174.054 0.351 1
1 1492 . 11 1 1 A 124 124 SER CA C 124 58.390 59.777 -1.387 1
1 1493 . 11 1 1 A 124 124 SER CB C 124 64.255 63.068 1.187 1
1 1494 . 11 1 1 A 124 124 SER N N 124 116.876 122.578 -5.702 1
1 1495 . 11 1 1 A 125 125 GLY H H 125 8.307 8.230 0.077 1
1 1496 . 11 1 1 A 125 125 GLY HA2 H 125 4.166 4.231 -0.065 1
1 1497 . 11 1 1 A 125 125 GLY HA3 H 125 4.166 4.232 -0.066 1
1 1498 . 11 1 1 A 125 125 GLY C C 125 171.921 171.707 0.214 1
1 1499 . 11 1 1 A 125 125 GLY CA C 125 44.748 45.426 -0.678 1
1 1500 . 11 1 1 A 125 125 GLY N N 125 110.006 113.345 -3.339 1
1 1501 . 11 1 1 A 126 126 PRO HA H 126 4.510 4.778 -0.268 1
1 1508 . 11 1 1 A 126 126 PRO C C 126 177.471 176.309 1.162 1
1 1509 . 11 1 1 A 126 126 PRO CA C 126 63.419 62.661 0.758 1
1 1510 . 11 1 1 A 126 126 PRO CB C 126 32.106 31.731 0.375 1
1 1513 . 11 1 1 A 127 127 SER H H 127 8.607 8.745 -0.138 1
1 1514 . 11 1 1 A 127 127 SER C C 127 174.628 173.215 1.413 1
1 1515 . 11 1 1 A 127 127 SER CA C 127 58.513 57.443 1.070 1
1 1516 . 11 1 1 A 127 127 SER CB C 127 63.679 65.466 -1.787 1
1 1517 . 11 1 1 A 127 127 SER N N 127 116.390 119.774 -3.384 1
1 1518 . 11 1 1 A 128 128 SER H H 128 8.272 8.869 -0.597 1
1 1519 . 11 1 1 A 128 128 SER HA H 128 4.496 5.152 -0.656 1
1 1520 . 11 1 1 A 128 128 SER C C 128 173.921 173.252 0.669 1
1 1521 . 11 1 1 A 128 128 SER CA C 128 58.442 56.202 2.240 1
1 1522 . 11 1 1 A 128 128 SER CB C 128 64.173 65.237 -1.064 1
1 1523 . 11 1 1 A 128 128 SER N N 128 117.506 118.130 -0.624 1
1 1 . 12 1 1 A 7 7 GLY HA2 H 7 3.978 3.880 0.098 1
1 2 . 12 1 1 A 7 7 GLY HA3 H 7 3.978 3.881 0.097 1
1 3 . 12 1 1 A 7 7 GLY C C 7 174.274 173.377 0.897 1
1 4 . 12 1 1 A 7 7 GLY CA C 7 45.383 46.148 -0.765 1
1 5 . 12 1 1 A 8 8 SER H H 8 8.211 8.334 -0.123 1
1 6 . 12 1 1 A 8 8 SER HA H 8 4.425 5.339 -0.914 1
1 9 . 12 1 1 A 8 8 SER C C 8 174.635 172.722 1.913 1
1 10 . 12 1 1 A 8 8 SER CA C 8 58.425 57.519 0.906 1
1 11 . 12 1 1 A 8 8 SER CB C 8 63.885 66.960 -3.075 1
1 12 . 12 1 1 A 8 8 SER N N 8 115.732 118.022 -2.290 1
1 13 . 12 1 1 A 9 9 LEU H H 9 8.316 8.583 -0.267 1
1 14 . 12 1 1 A 9 9 LEU HA H 9 4.334 4.839 -0.505 1
1 24 . 12 1 1 A 9 9 LEU C C 9 177.447 175.124 2.323 1
1 25 . 12 1 1 A 9 9 LEU CA C 9 55.407 53.910 1.497 1
1 26 . 12 1 1 A 9 9 LEU CB C 9 42.171 46.042 -3.871 1
1 30 . 12 1 1 A 9 9 LEU N N 9 123.943 123.397 0.546 1
1 31 . 12 1 1 A 10 10 SER H H 10 8.304 8.789 -0.485 1
1 32 . 12 1 1 A 10 10 SER HA H 10 4.424 5.032 -0.608 1
1 35 . 12 1 1 A 10 10 SER C C 10 175.025 173.157 1.868 1
1 36 . 12 1 1 A 10 10 SER CA C 10 58.425 57.201 1.224 1
1 37 . 12 1 1 A 10 10 SER CB C 10 63.638 65.465 -1.827 1
1 38 . 12 1 1 A 10 10 SER N N 10 116.718 120.810 -4.092 1
1 39 . 12 1 1 A 11 11 THR H H 11 8.003 8.509 -0.506 1
1 40 . 12 1 1 A 11 11 THR HA H 11 4.196 5.041 -0.845 1
1 45 . 12 1 1 A 11 11 THR C C 11 176.296 174.156 2.140 1
1 46 . 12 1 1 A 11 11 THR CA C 11 62.483 61.554 0.929 1
1 47 . 12 1 1 A 11 11 THR CB C 11 69.266 71.451 -2.185 1
1 49 . 12 1 1 A 11 11 THR N N 11 114.902 117.437 -2.535 1
1 50 . 12 1 1 A 12 12 VAL H H 12 8.095 8.531 -0.436 1
1 51 . 12 1 1 A 12 12 VAL HA H 12 3.826 4.174 -0.348 1
1 59 . 12 1 1 A 12 12 VAL C C 12 178.501 176.957 1.544 1
1 60 . 12 1 1 A 12 12 VAL CA C 12 64.760 63.621 1.139 1
1 61 . 12 1 1 A 12 12 VAL CB C 12 32.013 33.603 -1.590 1
1 64 . 12 1 1 A 12 12 VAL N N 12 122.111 123.260 -1.149 1
1 65 . 12 1 1 A 13 13 GLU H H 13 8.151 8.700 -0.549 1
1 66 . 12 1 1 A 13 13 GLU HA H 13 3.244 3.192 0.052 1
1 71 . 12 1 1 A 13 13 GLU C C 13 175.702 178.519 -2.817 1
1 72 . 12 1 1 A 13 13 GLU CA C 13 58.354 58.964 -0.610 1
1 73 . 12 1 1 A 13 13 GLU CB C 13 28.843 28.624 0.219 1
1 75 . 12 1 1 A 13 13 GLU N N 13 120.316 121.781 -1.465 1
1 76 . 12 1 1 A 14 14 LEU H H 14 7.067 7.460 -0.393 1
1 77 . 12 1 1 A 14 14 LEU HA H 14 4.157 4.131 0.026 1
1 87 . 12 1 1 A 14 14 LEU C C 14 176.863 176.488 0.375 1
1 88 . 12 1 1 A 14 14 LEU CA C 14 53.324 54.993 -1.669 1
1 89 . 12 1 1 A 14 14 LEU CB C 14 41.636 41.481 0.155 1
1 93 . 12 1 1 A 14 14 LEU N N 14 117.035 119.381 -2.346 1
1 94 . 12 1 1 A 15 15 SER H H 15 7.645 7.750 -0.105 1
1 95 . 12 1 1 A 15 15 SER HA H 15 4.305 4.645 -0.340 1
1 98 . 12 1 1 A 15 15 SER C C 15 175.340 173.396 1.944 1
1 99 . 12 1 1 A 15 15 SER CA C 15 59.783 57.134 2.649 1
1 100 . 12 1 1 A 15 15 SER CB C 15 64.625 61.700 2.925 1
1 101 . 12 1 1 A 15 15 SER N N 15 114.216 116.222 -2.006 1
1 102 . 12 1 1 A 16 16 GLY H H 16 8.506 8.493 0.013 1
1 103 . 12 1 1 A 16 16 GLY HA2 H 16 4.237 4.382 -0.145 1
1 104 . 12 1 1 A 16 16 GLY HA3 H 16 3.927 4.405 -0.478 1
1 105 . 12 1 1 A 16 16 GLY C C 16 173.661 172.015 1.646 1
1 106 . 12 1 1 A 16 16 GLY CA C 16 44.995 44.335 0.660 1
1 107 . 12 1 1 A 16 16 GLY N N 16 111.838 111.615 0.223 1
1 108 . 12 1 1 A 17 17 THR H H 17 8.482 8.736 -0.254 1
1 109 . 12 1 1 A 17 17 THR HA H 17 4.319 4.344 -0.025 1
1 114 . 12 1 1 A 17 17 THR C C 17 174.758 174.545 0.213 1
1 115 . 12 1 1 A 17 17 THR CA C 17 62.272 63.663 -1.391 1
1 116 . 12 1 1 A 17 17 THR CB C 17 70.706 68.945 1.761 1
1 118 . 12 1 1 A 17 17 THR N N 17 116.679 115.508 1.171 1
1 119 . 12 1 1 A 18 18 VAL H H 18 8.948 8.805 0.143 1
1 120 . 12 1 1 A 18 18 VAL HA H 18 3.950 4.358 -0.408 1
1 128 . 12 1 1 A 18 18 VAL C C 18 176.669 177.045 -0.376 1
1 129 . 12 1 1 A 18 18 VAL CA C 18 64.813 63.718 1.095 1
1 130 . 12 1 1 A 18 18 VAL CB C 18 31.807 31.902 -0.095 1
1 133 . 12 1 1 A 18 18 VAL N N 18 127.156 127.801 -0.645 1
1 134 . 12 1 1 A 19 19 VAL H H 19 9.359 8.784 0.575 1
1 135 . 12 1 1 A 19 19 VAL HA H 19 4.234 4.388 -0.154 1
1 143 . 12 1 1 A 19 19 VAL C C 19 175.738 175.821 -0.083 1
1 144 . 12 1 1 A 19 19 VAL CA C 19 62.060 62.130 -0.070 1
1 145 . 12 1 1 A 19 19 VAL CB C 19 33.822 33.422 0.400 1
1 148 . 12 1 1 A 19 19 VAL N N 19 125.162 121.715 3.447 1
1 149 . 12 1 1 A 20 20 LYS H H 20 7.584 7.602 -0.018 1
1 150 . 12 1 1 A 20 20 LYS HA H 20 4.346 4.552 -0.206 1
1 159 . 12 1 1 A 20 20 LYS C C 20 172.818 174.009 -1.191 1
1 160 . 12 1 1 A 20 20 LYS CA C 20 56.801 55.481 1.320 1
1 161 . 12 1 1 A 20 20 LYS CB C 20 36.624 35.600 1.024 1
1 165 . 12 1 1 A 20 20 LYS N N 20 121.024 120.959 0.065 1
1 166 . 12 1 1 A 21 21 GLN H H 21 8.625 8.501 0.124 1
1 167 . 12 1 1 A 21 21 GLN HA H 21 6.003 5.353 0.650 1
1 174 . 12 1 1 A 21 21 GLN C C 21 174.914 174.888 0.026 1
1 175 . 12 1 1 A 21 21 GLN CA C 21 54.207 54.641 -0.434 1
1 176 . 12 1 1 A 21 21 GLN CB C 21 33.452 33.493 -0.041 1
1 178 . 12 1 1 A 21 21 GLN N N 21 122.108 124.267 -2.159 1
1 180 . 12 1 1 A 22 22 GLY H H 22 8.964 8.366 0.598 1
1 181 . 12 1 1 A 22 22 GLY HA2 H 22 4.665 4.406 0.259 1
1 182 . 12 1 1 A 22 22 GLY HA3 H 22 4.295 4.600 -0.305 1
1 183 . 12 1 1 A 22 22 GLY C C 22 170.879 171.608 -0.729 1
1 184 . 12 1 1 A 22 22 GLY CA C 22 45.683 45.850 -0.167 1
1 185 . 12 1 1 A 22 22 GLY N N 22 108.508 108.979 -0.471 1
1 186 . 12 1 1 A 23 23 TYR H H 23 9.145 8.719 0.426 1
1 187 . 12 1 1 A 23 23 TYR HA H 23 5.595 5.615 -0.020 1
1 194 . 12 1 1 A 23 23 TYR C C 23 175.824 175.404 0.420 1
1 195 . 12 1 1 A 23 23 TYR CA C 23 58.019 56.937 1.082 1
1 196 . 12 1 1 A 23 23 TYR CB C 23 39.251 40.393 -1.142 1
1 201 . 12 1 1 A 23 23 TYR N N 23 120.809 119.772 1.037 1
1 202 . 12 1 1 A 24 24 LEU H H 24 8.935 9.634 -0.699 1
1 203 . 12 1 1 A 24 24 LEU HA H 24 4.716 5.023 -0.307 1
1 213 . 12 1 1 A 24 24 LEU C C 24 174.648 175.916 -1.268 1
1 214 . 12 1 1 A 24 24 LEU CA C 24 53.907 53.336 0.571 1
1 215 . 12 1 1 A 24 24 LEU CB C 24 46.078 44.902 1.176 1
1 219 . 12 1 1 A 24 24 LEU N N 24 122.887 124.924 -2.037 1
1 220 . 12 1 1 A 25 25 ALA H H 25 8.145 8.919 -0.774 1
1 221 . 12 1 1 A 25 25 ALA HA H 25 5.477 5.359 0.118 1
1 225 . 12 1 1 A 25 25 ALA C C 25 175.751 175.782 -0.031 1
1 226 . 12 1 1 A 25 25 ALA CA C 25 50.719 50.448 0.271 1
1 227 . 12 1 1 A 25 25 ALA CB C 25 21.074 20.596 0.478 1
1 228 . 12 1 1 A 25 25 ALA N N 25 122.280 123.139 -0.859 1
1 229 . 12 1 1 A 26 26 LYS H H 26 9.167 8.453 0.714 1
1 230 . 12 1 1 A 26 26 LYS HA H 26 5.221 4.531 0.690 1
1 239 . 12 1 1 A 26 26 LYS C C 26 175.421 175.639 -0.218 1
1 240 . 12 1 1 A 26 26 LYS CA C 26 54.383 55.585 -1.202 1
1 241 . 12 1 1 A 26 26 LYS CB C 26 36.125 33.654 2.471 1
1 245 . 12 1 1 A 26 26 LYS N N 26 120.638 125.651 -5.013 1
1 246 . 12 1 1 A 27 27 GLN H H 27 7.866 7.956 -0.090 1
1 247 . 12 1 1 A 27 27 GLN HA H 27 3.525 4.339 -0.814 1
1 254 . 12 1 1 A 27 27 GLN C C 27 177.022 175.415 1.607 1
1 255 . 12 1 1 A 27 27 GLN CA C 27 55.778 54.239 1.539 1
1 256 . 12 1 1 A 27 27 GLN CB C 27 29.864 28.586 1.278 1
1 258 . 12 1 1 A 27 27 GLN N N 27 130.194 127.033 3.161 1
1 260 . 12 1 1 A 28 28 GLY H H 28 8.565 8.608 -0.043 1
1 261 . 12 1 1 A 28 28 GLY HA2 H 28 4.125 4.040 0.085 1
1 262 . 12 1 1 A 28 28 GLY HA3 H 28 4.034 4.061 -0.027 1
1 263 . 12 1 1 A 28 28 GLY C C 28 174.030 172.489 1.541 1
1 264 . 12 1 1 A 28 28 GLY CA C 28 45.665 44.212 1.453 1
1 265 . 12 1 1 A 28 28 GLY N N 28 115.528 112.922 2.606 1
1 266 . 12 1 1 A 29 29 HIS HA H 29 4.355 5.102 -0.747 1
1 271 . 12 1 1 A 29 29 HIS CA C 29 58.795 54.957 3.838 1
1 272 . 12 1 1 A 29 29 HIS CB C 29 31.283 32.958 -1.675 1
1 275 . 12 1 1 A 30 30 LYS HA H 30 4.096 3.980 0.116 1
1 284 . 12 1 1 A 30 30 LYS CA C 30 57.290 58.376 -1.086 1
1 285 . 12 1 1 A 30 30 LYS CB C 30 31.951 31.040 0.911 1
1 289 . 12 1 1 A 31 31 ARG HA H 31 3.975 3.894 0.081 1
1 296 . 12 1 1 A 31 31 ARG CA C 31 55.973 58.590 -2.617 1
1 297 . 12 1 1 A 31 31 ARG CB C 31 29.902 28.924 0.978 1
1 300 . 12 1 1 A 32 32 LYS HA H 32 4.160 4.713 -0.553 1
1 309 . 12 1 1 A 32 32 LYS C C 32 175.678 176.397 -0.719 1
1 310 . 12 1 1 A 32 32 LYS CA C 32 56.254 55.126 1.128 1
1 311 . 12 1 1 A 32 32 LYS CB C 32 31.602 36.157 -4.555 1
1 315 . 12 1 1 A 33 33 ASN H H 33 7.925 9.000 -1.075 1
1 316 . 12 1 1 A 33 33 ASN HA H 33 4.799 4.551 0.248 1
1 321 . 12 1 1 A 33 33 ASN C C 33 174.005 174.432 -0.427 1
1 322 . 12 1 1 A 33 33 ASN CA C 33 52.407 55.970 -3.563 1
1 323 . 12 1 1 A 33 33 ASN CB C 33 39.879 38.510 1.369 1
1 324 . 12 1 1 A 33 33 ASN N N 33 116.990 119.032 -2.042 1
1 326 . 12 1 1 A 34 34 TRP H H 34 8.798 7.673 1.125 1
1 327 . 12 1 1 A 34 34 TRP HA H 34 4.755 5.421 -0.666 1
1 336 . 12 1 1 A 34 34 TRP C C 34 176.090 175.136 0.954 1
1 337 . 12 1 1 A 34 34 TRP CA C 34 57.119 56.071 1.048 1
1 338 . 12 1 1 A 34 34 TRP CB C 34 30.596 33.164 -2.568 1
1 344 . 12 1 1 A 34 34 TRP N N 34 121.917 117.443 4.474 1
1 346 . 12 1 1 A 35 35 LYS H H 35 8.404 8.259 0.145 1
1 347 . 12 1 1 A 35 35 LYS HA H 35 4.846 4.938 -0.092 1
1 354 . 12 1 1 A 35 35 LYS C C 35 176.088 175.554 0.534 1
1 355 . 12 1 1 A 35 35 LYS CA C 35 54.418 55.007 -0.589 1
1 356 . 12 1 1 A 35 35 LYS CB C 35 36.125 35.421 0.704 1
1 360 . 12 1 1 A 35 35 LYS N N 35 120.864 122.928 -2.064 1
1 361 . 12 1 1 A 36 36 VAL H H 36 8.977 8.814 0.163 1
1 362 . 12 1 1 A 36 36 VAL HA H 36 4.274 4.277 -0.003 1
1 370 . 12 1 1 A 36 36 VAL C C 36 176.733 176.008 0.725 1
1 371 . 12 1 1 A 36 36 VAL CA C 36 64.319 63.624 0.695 1
1 372 . 12 1 1 A 36 36 VAL CB C 36 31.602 32.308 -0.706 1
1 375 . 12 1 1 A 36 36 VAL N N 36 124.314 124.718 -0.404 1
1 376 . 12 1 1 A 37 37 ARG H H 37 9.498 10.185 -0.687 1
1 377 . 12 1 1 A 37 37 ARG HA H 37 5.053 5.018 0.035 1
1 384 . 12 1 1 A 37 37 ARG C C 37 174.442 174.691 -0.249 1
1 385 . 12 1 1 A 37 37 ARG CA C 37 53.272 54.347 -1.075 1
1 386 . 12 1 1 A 37 37 ARG CB C 37 34.563 34.445 0.118 1
1 389 . 12 1 1 A 37 37 ARG N N 37 128.121 126.966 1.155 1
1 390 . 12 1 1 A 38 38 ARG H H 38 8.755 8.628 0.127 1
1 391 . 12 1 1 A 38 38 ARG HA H 38 4.626 4.338 0.288 1
1 398 . 12 1 1 A 38 38 ARG C C 38 175.514 174.906 0.608 1
1 399 . 12 1 1 A 38 38 ARG CA C 38 55.601 55.677 -0.076 1
1 400 . 12 1 1 A 38 38 ARG CB C 38 32.219 30.761 1.458 1
1 403 . 12 1 1 A 38 38 ARG N N 38 121.442 123.140 -1.698 1
1 404 . 12 1 1 A 39 39 PHE H H 39 9.865 9.065 0.800 1
1 405 . 12 1 1 A 39 39 PHE HA H 39 5.424 5.073 0.351 1
1 413 . 12 1 1 A 39 39 PHE C C 39 175.423 174.758 0.665 1
1 414 . 12 1 1 A 39 39 PHE CA C 39 57.419 57.008 0.411 1
1 415 . 12 1 1 A 39 39 PHE CB C 39 42.623 40.524 2.099 1
1 421 . 12 1 1 A 39 39 PHE N N 39 130.027 126.507 3.520 1
1 422 . 12 1 1 A 40 40 VAL H H 40 9.300 9.995 -0.695 1
1 423 . 12 1 1 A 40 40 VAL HA H 40 4.846 5.301 -0.455 1
1 431 . 12 1 1 A 40 40 VAL C C 40 174.477 173.697 0.780 1
1 432 . 12 1 1 A 40 40 VAL CA C 40 62.343 59.825 2.518 1
1 433 . 12 1 1 A 40 40 VAL CB C 40 35.755 34.908 0.847 1
1 436 . 12 1 1 A 40 40 VAL N N 40 119.369 123.209 -3.840 1
1 437 . 12 1 1 A 41 41 LEU H H 41 9.557 9.840 -0.283 1
1 438 . 12 1 1 A 41 41 LEU HA H 41 5.292 5.399 -0.107 1
1 448 . 12 1 1 A 41 41 LEU C C 41 174.632 175.489 -0.857 1
1 449 . 12 1 1 A 41 41 LEU CA C 41 53.571 53.632 -0.061 1
1 450 . 12 1 1 A 41 41 LEU CB C 41 45.337 46.181 -0.844 1
1 454 . 12 1 1 A 41 41 LEU N N 41 132.121 128.816 3.305 1
1 455 . 12 1 1 A 42 42 ARG H H 42 9.396 8.813 0.583 1
1 456 . 12 1 1 A 42 42 ARG HA H 42 5.366 5.287 0.079 1
1 464 . 12 1 1 A 42 42 ARG C C 42 173.997 174.776 -0.779 1
1 465 . 12 1 1 A 42 42 ARG CA C 42 54.631 54.195 0.436 1
1 466 . 12 1 1 A 42 42 ARG CB C 42 35.550 35.004 0.546 1
1 469 . 12 1 1 A 42 42 ARG N N 42 128.120 122.695 5.425 1
1 471 . 12 1 1 A 43 43 LYS H H 43 8.597 8.743 -0.146 1
1 472 . 12 1 1 A 43 43 LYS HA H 43 4.558 4.979 -0.421 1
1 481 . 12 1 1 A 43 43 LYS C C 43 174.648 175.249 -0.601 1
1 482 . 12 1 1 A 43 43 LYS CA C 43 53.378 54.880 -1.502 1
1 483 . 12 1 1 A 43 43 LYS CB C 43 37.303 35.951 1.352 1
1 487 . 12 1 1 A 43 43 LYS N N 43 114.484 118.372 -3.888 1
1 488 . 12 1 1 A 44 44 ASP H H 44 8.388 9.061 -0.673 1
1 489 . 12 1 1 A 44 44 ASP HA H 44 4.349 4.301 0.048 1
1 492 . 12 1 1 A 44 44 ASP C C 44 173.376 174.371 -0.995 1
1 493 . 12 1 1 A 44 44 ASP CA C 44 54.842 54.967 -0.125 1
1 494 . 12 1 1 A 44 44 ASP CB C 44 39.991 39.497 0.494 1
1 495 . 12 1 1 A 44 44 ASP N N 44 115.453 119.646 -4.193 1
1 496 . 12 1 1 A 45 45 PRO HA H 45 4.652 4.636 0.016 1
1 503 . 12 1 1 A 45 45 PRO C C 45 176.914 175.529 1.385 1
1 504 . 12 1 1 A 45 45 PRO CA C 45 63.490 62.655 0.835 1
1 505 . 12 1 1 A 45 45 PRO CB C 45 34.892 32.716 2.176 1
1 508 . 12 1 1 A 46 46 ALA H H 46 8.112 8.403 -0.291 1
1 509 . 12 1 1 A 46 46 ALA HA H 46 5.455 4.718 0.737 1
1 513 . 12 1 1 A 46 46 ALA C C 46 177.234 176.700 0.534 1
1 514 . 12 1 1 A 46 46 ALA CA C 46 51.560 50.656 0.904 1
1 515 . 12 1 1 A 46 46 ALA CB C 46 20.122 20.128 -0.006 1
1 516 . 12 1 1 A 46 46 ALA N N 46 120.155 123.215 -3.060 1
1 517 . 12 1 1 A 47 47 PHE H H 47 8.717 9.085 -0.368 1
1 518 . 12 1 1 A 47 47 PHE HA H 47 4.795 5.139 -0.344 1
1 526 . 12 1 1 A 47 47 PHE C C 47 172.588 174.414 -1.826 1
1 527 . 12 1 1 A 47 47 PHE CA C 47 57.348 56.304 1.044 1
1 528 . 12 1 1 A 47 47 PHE CB C 47 47.123 44.210 2.913 1
1 534 . 12 1 1 A 47 47 PHE N N 47 129.946 119.306 10.640 1
1 535 . 12 1 1 A 48 48 LEU H H 48 7.883 8.486 -0.603 1
1 536 . 12 1 1 A 48 48 LEU HA H 48 5.198 5.072 0.126 1
1 546 . 12 1 1 A 48 48 LEU C C 48 173.569 174.346 -0.777 1
1 547 . 12 1 1 A 48 48 LEU CA C 48 53.290 54.544 -1.254 1
1 548 . 12 1 1 A 48 48 LEU CB C 48 45.502 45.437 0.065 1
1 552 . 12 1 1 A 48 48 LEU N N 48 121.108 121.214 -0.106 1
1 553 . 12 1 1 A 49 49 HIS H H 49 8.606 8.967 -0.361 1
1 554 . 12 1 1 A 49 49 HIS HA H 49 5.035 4.949 0.086 1
1 559 . 12 1 1 A 49 49 HIS C C 49 173.993 173.509 0.484 1
1 560 . 12 1 1 A 49 49 HIS CA C 49 56.483 53.993 2.490 1
1 561 . 12 1 1 A 49 49 HIS CB C 49 35.919 33.593 2.326 1
1 564 . 12 1 1 A 49 49 HIS N N 49 121.199 125.148 -3.949 1
1 565 . 12 1 1 A 50 50 TYR H H 50 7.777 8.259 -0.482 1
1 566 . 12 1 1 A 50 50 TYR HA H 50 5.695 5.643 0.052 1
1 573 . 12 1 1 A 50 50 TYR C C 50 174.284 172.230 2.054 1
1 574 . 12 1 1 A 50 50 TYR CA C 50 53.430 55.089 -1.659 1
1 575 . 12 1 1 A 50 50 TYR CB C 50 38.552 41.146 -2.594 1
1 580 . 12 1 1 A 50 50 TYR N N 50 114.156 118.081 -3.925 1
1 581 . 12 1 1 A 51 51 TYR H H 51 9.323 9.623 -0.300 1
1 582 . 12 1 1 A 51 51 TYR HA H 51 4.600 5.113 -0.513 1
1 589 . 12 1 1 A 51 51 TYR C C 51 175.352 174.643 0.709 1
1 590 . 12 1 1 A 51 51 TYR CA C 51 57.330 56.237 1.093 1
1 591 . 12 1 1 A 51 51 TYR CB C 51 41.683 41.973 -0.290 1
1 596 . 12 1 1 A 51 51 TYR N N 51 119.100 120.119 -1.019 1
1 597 . 12 1 1 A 52 52 ASP H H 52 9.375 8.714 0.661 1
1 598 . 12 1 1 A 52 52 ASP HA H 52 5.064 4.972 0.092 1
1 601 . 12 1 1 A 52 52 ASP C C 52 175.484 175.596 -0.112 1
1 602 . 12 1 1 A 52 52 ASP CA C 52 51.313 51.148 0.165 1
1 603 . 12 1 1 A 52 52 ASP CB C 52 41.883 42.163 -0.280 1
1 604 . 12 1 1 A 52 52 ASP N N 52 124.636 123.086 1.550 1
1 605 . 12 1 1 A 53 53 PRO HA H 53 4.678 4.612 0.066 1
1 612 . 12 1 1 A 53 53 PRO C C 53 176.781 177.072 -0.291 1
1 613 . 12 1 1 A 53 53 PRO CA C 53 64.054 64.003 0.051 1
1 614 . 12 1 1 A 53 53 PRO CB C 53 32.589 32.086 0.503 1
1 617 . 12 1 1 A 54 54 SER H H 54 8.685 8.994 -0.309 1
1 618 . 12 1 1 A 54 54 SER HA H 54 4.483 4.599 -0.116 1
1 621 . 12 1 1 A 54 54 SER C C 54 174.006 174.889 -0.883 1
1 622 . 12 1 1 A 54 54 SER CA C 54 59.378 60.752 -1.374 1
1 623 . 12 1 1 A 54 54 SER CB C 54 64.132 64.582 -0.450 1
1 624 . 12 1 1 A 54 54 SER N N 54 113.769 113.249 0.520 1
1 625 . 12 1 1 A 55 55 LYS H H 55 7.706 7.967 -0.261 1
1 626 . 12 1 1 A 55 55 LYS HA H 55 4.580 4.457 0.123 1
1 635 . 12 1 1 A 55 55 LYS C C 55 175.969 175.437 0.532 1
1 636 . 12 1 1 A 55 55 LYS CA C 55 55.160 56.447 -1.287 1
1 637 . 12 1 1 A 55 55 LYS CB C 55 34.069 33.775 0.294 1
1 641 . 12 1 1 A 55 55 LYS N N 55 122.222 119.245 2.977 1
1 642 . 12 1 1 A 56 56 GLU H H 56 8.666 8.696 -0.030 1
1 643 . 12 1 1 A 56 56 GLU HA H 56 4.174 5.170 -0.996 1
1 648 . 12 1 1 A 56 56 GLU C C 56 177.084 174.741 2.343 1
1 649 . 12 1 1 A 56 56 GLU CA C 56 57.099 55.336 1.763 1
1 650 . 12 1 1 A 56 56 GLU CB C 56 29.694 31.545 -1.851 1
1 652 . 12 1 1 A 56 56 GLU N N 56 122.015 119.035 2.980 1
1 653 . 12 1 1 A 57 57 GLU H H 57 8.303 8.786 -0.483 1
1 654 . 12 1 1 A 57 57 GLU HA H 57 4.214 4.703 -0.489 1
1 659 . 12 1 1 A 57 57 GLU CA C 57 56.960 55.498 1.462 1
1 660 . 12 1 1 A 57 57 GLU CB C 57 30.264 34.059 -3.795 1
1 662 . 12 1 1 A 57 57 GLU N N 57 119.884 124.080 -4.196 1
1 663 . 12 1 1 A 58 58 ASN HA H 58 4.768 4.902 -0.134 1
1 668 . 12 1 1 A 58 58 ASN C C 58 174.902 173.792 1.110 1
1 669 . 12 1 1 A 58 58 ASN CA C 58 52.740 52.797 -0.057 1
1 670 . 12 1 1 A 58 58 ASN CB C 58 38.116 36.526 1.590 1
1 672 . 12 1 1 A 59 59 ARG H H 59 7.805 7.924 -0.119 1
1 673 . 12 1 1 A 59 59 ARG HA H 59 4.762 4.778 -0.016 1
1 680 . 12 1 1 A 59 59 ARG CA C 59 53.151 54.252 -1.101 1
1 681 . 12 1 1 A 59 59 ARG CB C 59 31.519 34.363 -2.844 1
1 684 . 12 1 1 A 59 59 ARG N N 59 121.060 120.769 0.291 1
1 685 . 12 1 1 A 60 60 PRO HA H 60 3.357 4.003 -0.646 1
1 692 . 12 1 1 A 60 60 PRO C C 60 176.817 176.276 0.541 1
1 693 . 12 1 1 A 60 60 PRO CA C 60 63.031 61.816 1.215 1
1 694 . 12 1 1 A 60 60 PRO CB C 60 31.273 32.376 -1.103 1
1 697 . 12 1 1 A 61 61 VAL H H 61 8.627 8.635 -0.008 1
1 698 . 12 1 1 A 61 61 VAL HA H 61 3.966 3.936 0.030 1
1 706 . 12 1 1 A 61 61 VAL C C 61 176.503 176.339 0.164 1
1 707 . 12 1 1 A 61 61 VAL CA C 61 63.154 64.266 -1.112 1
1 708 . 12 1 1 A 61 61 VAL CB C 61 32.048 32.373 -0.325 1
1 711 . 12 1 1 A 61 61 VAL N N 61 119.185 119.170 0.015 1
1 712 . 12 1 1 A 62 62 GLY H H 62 6.715 6.235 0.480 1
1 713 . 12 1 1 A 62 62 GLY HA2 H 62 3.940 3.818 0.122 1
1 714 . 12 1 1 A 62 62 GLY HA3 H 62 3.538 3.921 -0.383 1
1 715 . 12 1 1 A 62 62 GLY C C 62 169.983 172.467 -2.484 1
1 716 . 12 1 1 A 62 62 GLY CA C 62 44.465 45.325 -0.860 1
1 717 . 12 1 1 A 62 62 GLY N N 62 105.813 105.798 0.015 1
1 718 . 12 1 1 A 63 63 GLY H H 63 8.004 8.235 -0.231 1
1 719 . 12 1 1 A 63 63 GLY HA2 H 63 4.095 3.239 0.856 1
1 720 . 12 1 1 A 63 63 GLY HA3 H 63 3.813 3.631 0.182 1
1 721 . 12 1 1 A 63 63 GLY C C 63 171.870 172.645 -0.775 1
1 722 . 12 1 1 A 63 63 GLY CA C 63 47.148 44.028 3.120 1
1 723 . 12 1 1 A 63 63 GLY N N 63 105.089 107.439 -2.350 1
1 724 . 12 1 1 A 64 64 PHE H H 64 7.967 7.292 0.675 1
1 725 . 12 1 1 A 64 64 PHE HA H 64 4.934 5.614 -0.680 1
1 733 . 12 1 1 A 64 64 PHE C C 64 173.140 174.060 -0.920 1
1 734 . 12 1 1 A 64 64 PHE CA C 64 55.248 55.317 -0.069 1
1 735 . 12 1 1 A 64 64 PHE CB C 64 40.238 42.462 -2.224 1
1 741 . 12 1 1 A 64 64 PHE N N 64 113.387 119.663 -6.276 1
1 742 . 12 1 1 A 65 65 SER H H 65 8.518 9.016 -0.498 1
1 743 . 12 1 1 A 65 65 SER HA H 65 3.264 4.132 -0.868 1
1 746 . 12 1 1 A 65 65 SER C C 65 176.417 175.170 1.247 1
1 747 . 12 1 1 A 65 65 SER CA C 65 56.819 57.706 -0.887 1
1 748 . 12 1 1 A 65 65 SER CB C 65 63.391 63.428 -0.037 1
1 749 . 12 1 1 A 65 65 SER N N 65 114.674 115.724 -1.050 1
1 750 . 12 1 1 A 66 66 LEU H H 66 7.404 8.523 -1.119 1
1 751 . 12 1 1 A 66 66 LEU HA H 66 4.470 3.994 0.476 1
1 761 . 12 1 1 A 66 66 LEU C C 66 177.993 177.691 0.302 1
1 762 . 12 1 1 A 66 66 LEU CA C 66 54.242 58.118 -3.876 1
1 763 . 12 1 1 A 66 66 LEU CB C 66 42.787 41.459 1.328 1
1 767 . 12 1 1 A 66 66 LEU N N 66 123.988 125.888 -1.900 1
1 768 . 12 1 1 A 67 67 ARG H H 67 7.865 7.522 0.343 1
1 769 . 12 1 1 A 67 67 ARG HA H 67 4.175 4.053 0.122 1
1 776 . 12 1 1 A 67 67 ARG C C 67 178.562 177.177 1.385 1
1 777 . 12 1 1 A 67 67 ARG CA C 67 58.143 58.151 -0.008 1
1 778 . 12 1 1 A 67 67 ARG CB C 67 29.052 30.060 -1.008 1
1 781 . 12 1 1 A 67 67 ARG N N 67 122.494 118.167 4.327 1
1 782 . 12 1 1 A 68 68 GLY H H 68 9.398 8.794 0.604 1
1 783 . 12 1 1 A 68 68 GLY HA2 H 68 4.066 3.966 0.100 1
1 784 . 12 1 1 A 68 68 GLY HA3 H 68 3.908 3.966 -0.058 1
1 785 . 12 1 1 A 68 68 GLY C C 68 173.982 173.904 0.078 1
1 786 . 12 1 1 A 68 68 GLY CA C 68 46.230 46.163 0.067 1
1 787 . 12 1 1 A 68 68 GLY N N 68 117.548 113.665 3.883 1
1 788 . 12 1 1 A 69 69 SER H H 69 7.829 7.855 -0.026 1
1 789 . 12 1 1 A 69 69 SER HA H 69 4.807 4.984 -0.177 1
1 792 . 12 1 1 A 69 69 SER C C 69 172.854 173.026 -0.172 1
1 793 . 12 1 1 A 69 69 SER CA C 69 59.290 57.268 2.022 1
1 794 . 12 1 1 A 69 69 SER CB C 69 65.366 67.166 -1.800 1
1 795 . 12 1 1 A 69 69 SER N N 69 115.188 115.033 0.155 1
1 796 . 12 1 1 A 70 70 LEU H H 70 8.805 8.702 0.103 1
1 797 . 12 1 1 A 70 70 LEU HA H 70 4.846 4.824 0.022 1
1 807 . 12 1 1 A 70 70 LEU C C 70 175.775 174.233 1.542 1
1 808 . 12 1 1 A 70 70 LEU CA C 70 53.907 54.024 -0.117 1
1 809 . 12 1 1 A 70 70 LEU CB C 70 45.337 45.704 -0.367 1
1 813 . 12 1 1 A 70 70 LEU N N 70 121.265 122.863 -1.598 1
1 814 . 12 1 1 A 71 71 VAL H H 71 8.644 8.730 -0.086 1
1 815 . 12 1 1 A 71 71 VAL HA H 71 5.555 5.221 0.334 1
1 823 . 12 1 1 A 71 71 VAL C C 71 173.636 173.126 0.510 1
1 824 . 12 1 1 A 71 71 VAL CA C 71 58.760 59.952 -1.192 1
1 825 . 12 1 1 A 71 71 VAL CB C 71 34.891 35.602 -0.711 1
1 828 . 12 1 1 A 71 71 VAL N N 71 122.315 122.647 -0.332 1
1 829 . 12 1 1 A 72 72 SER H H 72 8.750 9.001 -0.251 1
1 830 . 12 1 1 A 72 72 SER HA H 72 4.742 5.008 -0.266 1
1 833 . 12 1 1 A 72 72 SER C C 72 173.058 172.622 0.436 1
1 834 . 12 1 1 A 72 72 SER CA C 72 57.190 57.713 -0.523 1
1 835 . 12 1 1 A 72 72 SER CB C 72 65.612 67.266 -1.654 1
1 836 . 12 1 1 A 72 72 SER N N 72 118.611 122.568 -3.957 1
1 837 . 12 1 1 A 73 73 ALA H H 73 9.009 8.566 0.443 1
1 838 . 12 1 1 A 73 73 ALA HA H 73 4.406 5.141 -0.735 1
1 842 . 12 1 1 A 73 73 ALA C C 73 176.708 177.328 -0.620 1
1 843 . 12 1 1 A 73 73 ALA CA C 73 52.672 50.506 2.166 1
1 844 . 12 1 1 A 73 73 ALA CB C 73 18.812 20.840 -2.028 1
1 845 . 12 1 1 A 73 73 ALA N N 73 125.694 125.682 0.012 1
1 846 . 12 1 1 A 74 74 LEU H H 74 7.800 8.547 -0.747 1
1 847 . 12 1 1 A 74 74 LEU HA H 74 4.716 4.865 -0.149 1
1 857 . 12 1 1 A 74 74 LEU C C 74 176.551 177.037 -0.486 1
1 858 . 12 1 1 A 74 74 LEU CA C 74 53.784 53.721 0.063 1
1 859 . 12 1 1 A 74 74 LEU CB C 74 43.446 42.447 0.999 1
1 863 . 12 1 1 A 74 74 LEU N N 74 122.271 120.816 1.455 1
1 864 . 12 1 1 A 75 75 GLU H H 75 8.855 8.554 0.301 1
1 865 . 12 1 1 A 75 75 GLU HA H 75 4.336 4.396 -0.060 1
1 870 . 12 1 1 A 75 75 GLU C C 75 176.465 175.564 0.901 1
1 871 . 12 1 1 A 75 75 GLU CA C 75 56.507 56.904 -0.397 1
1 872 . 12 1 1 A 75 75 GLU CB C 75 30.245 30.427 -0.182 1
1 874 . 12 1 1 A 75 75 GLU N N 75 122.678 120.455 2.223 1
1 875 . 12 1 1 A 76 76 ASP H H 76 8.542 8.885 -0.343 1
1 876 . 12 1 1 A 76 76 ASP HA H 76 4.665 5.003 -0.338 1
1 879 . 12 1 1 A 76 76 ASP C C 76 176.087 174.836 1.251 1
1 880 . 12 1 1 A 76 76 ASP CA C 76 55.107 53.165 1.942 1
1 881 . 12 1 1 A 76 76 ASP CB C 76 41.431 41.199 0.232 1
1 882 . 12 1 1 A 76 76 ASP N N 76 121.488 124.987 -3.499 1
1 883 . 12 1 1 A 77 77 ASN H H 77 8.322 8.596 -0.274 1
1 884 . 12 1 1 A 77 77 ASN HA H 77 4.729 4.848 -0.119 1
1 889 . 12 1 1 A 77 77 ASN C C 77 175.566 174.587 0.979 1
1 890 . 12 1 1 A 77 77 ASN CA C 77 53.131 52.394 0.737 1
1 891 . 12 1 1 A 77 77 ASN CB C 77 38.617 39.293 -0.676 1
1 892 . 12 1 1 A 77 77 ASN N N 77 118.676 123.282 -4.606 1
1 894 . 12 1 1 A 78 78 GLY H H 78 8.311 9.085 -0.774 1
1 895 . 12 1 1 A 78 78 GLY HA2 H 78 3.897 3.784 0.113 1
1 896 . 12 1 1 A 78 78 GLY HA3 H 78 3.897 3.790 0.107 1
1 897 . 12 1 1 A 78 78 GLY C C 78 173.376 174.195 -0.819 1
1 898 . 12 1 1 A 78 78 GLY CA C 78 45.224 47.039 -1.815 1
1 899 . 12 1 1 A 78 78 GLY N N 78 108.939 114.482 -5.543 1
1 900 . 12 1 1 A 79 79 VAL H H 79 7.882 8.394 -0.512 1
1 901 . 12 1 1 A 79 79 VAL HA H 79 4.345 4.273 0.072 1
1 909 . 12 1 1 A 79 79 VAL CA C 79 59.995 63.918 -3.923 1
1 910 . 12 1 1 A 79 79 VAL CB C 79 32.589 30.978 1.611 1
1 913 . 12 1 1 A 79 79 VAL N N 79 121.135 118.112 3.023 1
1 914 . 12 1 1 A 80 80 PRO HA H 80 4.461 4.404 0.057 1
1 921 . 12 1 1 A 80 80 PRO C C 80 176.979 177.398 -0.419 1
1 922 . 12 1 1 A 80 80 PRO CA C 80 63.101 66.236 -3.135 1
1 923 . 12 1 1 A 80 80 PRO CB C 80 32.177 31.591 0.586 1
1 926 . 12 1 1 A 81 81 THR H H 81 8.281 7.700 0.581 1
1 927 . 12 1 1 A 81 81 THR HA H 81 4.095 4.637 -0.542 1
1 932 . 12 1 1 A 81 81 THR C C 81 175.270 174.234 1.036 1
1 933 . 12 1 1 A 81 81 THR CA C 81 62.872 60.792 2.080 1
1 934 . 12 1 1 A 81 81 THR CB C 81 69.642 69.611 0.031 1
1 936 . 12 1 1 A 81 81 THR N N 81 114.684 109.111 5.573 1
1 937 . 12 1 1 A 82 82 GLY H H 82 8.338 8.528 -0.190 1
1 938 . 12 1 1 A 82 82 GLY HA2 H 82 4.095 3.872 0.223 1
1 939 . 12 1 1 A 82 82 GLY HA3 H 82 3.668 3.876 -0.208 1
1 940 . 12 1 1 A 82 82 GLY C C 82 174.139 173.952 0.187 1
1 941 . 12 1 1 A 82 82 GLY CA C 82 45.083 46.274 -1.191 1
1 942 . 12 1 1 A 82 82 GLY N N 82 111.289 108.713 2.576 1
1 943 . 12 1 1 A 83 83 VAL H H 83 7.668 7.315 0.353 1
1 944 . 12 1 1 A 83 83 VAL HA H 83 3.985 3.883 0.102 1
1 952 . 12 1 1 A 83 83 VAL C C 83 176.054 175.525 0.529 1
1 953 . 12 1 1 A 83 83 VAL CA C 83 62.431 61.725 0.706 1
1 954 . 12 1 1 A 83 83 VAL CB C 83 32.260 30.880 1.380 1
1 957 . 12 1 1 A 83 83 VAL N N 83 120.003 119.440 0.563 1
1 958 . 12 1 1 A 84 84 LYS H H 84 8.645 8.505 0.140 1
1 959 . 12 1 1 A 84 84 LYS HA H 84 4.276 4.094 0.182 1
1 968 . 12 1 1 A 84 84 LYS C C 84 176.832 176.490 0.342 1
1 969 . 12 1 1 A 84 84 LYS CA C 84 56.272 56.638 -0.366 1
1 970 . 12 1 1 A 84 84 LYS CB C 84 32.876 32.571 0.305 1
1 974 . 12 1 1 A 84 84 LYS N N 84 126.447 127.492 -1.045 1
1 975 . 12 1 1 A 85 85 GLY H H 85 8.410 8.613 -0.203 1
1 976 . 12 1 1 A 85 85 GLY HA2 H 85 4.066 4.033 0.033 1
1 977 . 12 1 1 A 85 85 GLY HA3 H 85 3.781 4.070 -0.289 1
1 978 . 12 1 1 A 85 85 GLY C C 85 173.969 174.446 -0.477 1
1 979 . 12 1 1 A 85 85 GLY CA C 85 45.146 44.948 0.198 1
1 980 . 12 1 1 A 85 85 GLY N N 85 109.957 109.612 0.345 1
1 981 . 12 1 1 A 86 86 ASN H H 86 8.298 8.642 -0.344 1
1 982 . 12 1 1 A 86 86 ASN HA H 86 4.665 4.869 -0.204 1
1 987 . 12 1 1 A 86 86 ASN C C 86 174.987 175.889 -0.902 1
1 988 . 12 1 1 A 86 86 ASN CA C 86 52.989 53.751 -0.762 1
1 989 . 12 1 1 A 86 86 ASN CB C 86 38.376 41.261 -2.885 1
1 990 . 12 1 1 A 86 86 ASN N N 86 118.457 123.692 -5.235 1
1 992 . 12 1 1 A 87 87 VAL H H 87 7.660 7.740 -0.080 1
1 993 . 12 1 1 A 87 87 VAL HA H 87 3.946 3.802 0.144 1
1 1001 . 12 1 1 A 87 87 VAL C C 87 174.902 174.319 0.583 1
1 1002 . 12 1 1 A 87 87 VAL CA C 87 62.307 63.457 -1.150 1
1 1003 . 12 1 1 A 87 87 VAL CB C 87 32.548 31.167 1.381 1
1 1006 . 12 1 1 A 87 87 VAL N N 87 120.557 118.856 1.701 1
1 1007 . 12 1 1 A 88 88 GLN H H 88 8.115 8.247 -0.132 1
1 1008 . 12 1 1 A 88 88 GLN HA H 88 4.302 4.503 -0.201 1
1 1015 . 12 1 1 A 88 88 GLN C C 88 175.637 175.729 -0.092 1
1 1016 . 12 1 1 A 88 88 GLN CA C 88 55.336 55.103 0.233 1
1 1017 . 12 1 1 A 88 88 GLN CB C 88 30.574 30.434 0.140 1
1 1019 . 12 1 1 A 88 88 GLN N N 88 122.280 123.844 -1.564 1
1 1021 . 12 1 1 A 89 89 GLY H H 89 8.544 8.323 0.221 1
1 1022 . 12 1 1 A 89 89 GLY HA2 H 89 3.885 4.052 -0.167 1
1 1023 . 12 1 1 A 89 89 GLY HA3 H 89 3.885 4.053 -0.168 1
1 1024 . 12 1 1 A 89 89 GLY C C 89 172.861 174.526 -1.665 1
1 1025 . 12 1 1 A 89 89 GLY CA C 89 44.889 45.993 -1.104 1
1 1026 . 12 1 1 A 89 89 GLY N N 89 110.135 109.843 0.292 1
1 1027 . 12 1 1 A 90 90 ASN H H 90 8.451 7.880 0.571 1
1 1028 . 12 1 1 A 90 90 ASN HA H 90 4.222 5.063 -0.841 1
1 1033 . 12 1 1 A 90 90 ASN C C 90 174.926 175.145 -0.219 1
1 1034 . 12 1 1 A 90 90 ASN CA C 90 54.613 52.258 2.355 1
1 1035 . 12 1 1 A 90 90 ASN CB C 90 37.852 38.448 -0.596 1
1 1036 . 12 1 1 A 90 90 ASN N N 90 114.322 116.220 -1.898 1
1 1038 . 12 1 1 A 91 91 LEU H H 91 8.933 7.786 1.147 1
1 1039 . 12 1 1 A 91 91 LEU HA H 91 5.367 5.036 0.331 1
1 1049 . 12 1 1 A 91 91 LEU C C 91 178.732 175.690 3.042 1
1 1050 . 12 1 1 A 91 91 LEU CA C 91 55.160 53.216 1.944 1
1 1051 . 12 1 1 A 91 91 LEU CB C 91 45.461 43.953 1.508 1
1 1055 . 12 1 1 A 91 91 LEU N N 91 120.057 121.314 -1.257 1
1 1056 . 12 1 1 A 92 92 PHE H H 92 9.901 8.271 1.630 1
1 1057 . 12 1 1 A 92 92 PHE HA H 92 5.105 5.607 -0.502 1
1 1065 . 12 1 1 A 92 92 PHE C C 92 170.140 172.863 -2.723 1
1 1066 . 12 1 1 A 92 92 PHE CA C 92 56.236 55.811 0.425 1
1 1067 . 12 1 1 A 92 92 PHE CB C 92 42.664 42.404 0.260 1
1 1073 . 12 1 1 A 92 92 PHE N N 92 119.740 116.762 2.978 1
1 1074 . 12 1 1 A 93 93 LYS H H 93 9.154 9.612 -0.458 1
1 1075 . 12 1 1 A 93 93 LYS HA H 93 5.584 5.246 0.338 1
1 1083 . 12 1 1 A 93 93 LYS C C 93 174.830 174.155 0.675 1
1 1084 . 12 1 1 A 93 93 LYS CA C 93 53.148 54.407 -1.259 1
1 1085 . 12 1 1 A 93 93 LYS CB C 93 36.660 36.599 0.061 1
1 1089 . 12 1 1 A 93 93 LYS N N 93 117.710 117.662 0.048 1
1 1090 . 12 1 1 A 94 94 VAL H H 94 8.507 8.790 -0.283 1
1 1091 . 12 1 1 A 94 94 VAL HA H 94 4.872 5.198 -0.326 1
1 1099 . 12 1 1 A 94 94 VAL C C 94 174.408 174.611 -0.203 1
1 1100 . 12 1 1 A 94 94 VAL CA C 94 60.525 61.103 -0.578 1
1 1101 . 12 1 1 A 94 94 VAL CB C 94 34.862 34.042 0.820 1
1 1104 . 12 1 1 A 94 94 VAL N N 94 121.741 120.902 0.839 1
1 1105 . 12 1 1 A 95 95 ILE H H 95 8.959 9.567 -0.608 1
1 1106 . 12 1 1 A 95 95 ILE HA H 95 4.794 4.834 -0.040 1
1 1116 . 12 1 1 A 95 95 ILE C C 95 177.642 176.211 1.431 1
1 1117 . 12 1 1 A 95 95 ILE CA C 95 59.713 60.499 -0.786 1
1 1118 . 12 1 1 A 95 95 ILE CB C 95 40.032 37.907 2.125 1
1 1122 . 12 1 1 A 95 95 ILE N N 95 126.794 129.216 -2.422 1
1 1123 . 12 1 1 A 96 96 THR H H 96 8.765 8.957 -0.192 1
1 1124 . 12 1 1 A 96 96 THR HA H 96 4.584 4.677 -0.093 1
1 1129 . 12 1 1 A 96 96 THR C C 96 177.023 176.313 0.710 1
1 1130 . 12 1 1 A 96 96 THR CA C 96 61.372 60.863 0.509 1
1 1131 . 12 1 1 A 96 96 THR CB C 96 70.794 71.160 -0.366 1
1 1133 . 12 1 1 A 96 96 THR N N 96 117.225 121.352 -4.127 1
1 1134 . 12 1 1 A 97 97 LYS H H 97 8.736 8.879 -0.143 1
1 1135 . 12 1 1 A 97 97 LYS HA H 97 4.101 4.107 -0.006 1
1 1144 . 12 1 1 A 97 97 LYS C C 97 176.490 176.771 -0.281 1
1 1145 . 12 1 1 A 97 97 LYS CA C 97 58.583 58.416 0.167 1
1 1146 . 12 1 1 A 97 97 LYS CB C 97 31.848 31.798 0.050 1
1 1150 . 12 1 1 A 97 97 LYS N N 97 120.457 119.532 0.925 1
1 1151 . 12 1 1 A 98 98 ASP H H 98 7.762 7.865 -0.103 1
1 1152 . 12 1 1 A 98 98 ASP HA H 98 4.633 4.760 -0.127 1
1 1155 . 12 1 1 A 98 98 ASP C C 98 175.270 174.753 0.517 1
1 1156 . 12 1 1 A 98 98 ASP CA C 98 53.272 53.769 -0.497 1
1 1157 . 12 1 1 A 98 98 ASP CB C 98 39.909 40.591 -0.682 1
1 1158 . 12 1 1 A 98 98 ASP N N 98 116.281 118.877 -2.596 1
1 1159 . 12 1 1 A 99 99 ASP H H 99 8.340 8.000 0.340 1
1 1160 . 12 1 1 A 99 99 ASP HA H 99 4.245 4.516 -0.271 1
1 1163 . 12 1 1 A 99 99 ASP C C 99 175.315 175.612 -0.297 1
1 1164 . 12 1 1 A 99 99 ASP CA C 99 55.989 55.474 0.515 1
1 1165 . 12 1 1 A 99 99 ASP CB C 99 39.827 38.860 0.967 1
1 1166 . 12 1 1 A 99 99 ASP N N 99 116.687 116.429 0.258 1
1 1167 . 12 1 1 A 100 100 THR H H 100 7.511 7.733 -0.222 1
1 1168 . 12 1 1 A 100 100 THR HA H 100 4.185 3.826 0.359 1
1 1173 . 12 1 1 A 100 100 THR C C 100 173.376 174.322 -0.946 1
1 1174 . 12 1 1 A 100 100 THR CA C 100 63.489 65.690 -2.201 1
1 1175 . 12 1 1 A 100 100 THR CB C 100 67.909 69.262 -1.353 1
1 1177 . 12 1 1 A 100 100 THR N N 100 116.525 111.429 5.096 1
1 1178 . 12 1 1 A 101 101 HIS H H 101 8.753 8.152 0.601 1
1 1179 . 12 1 1 A 101 101 HIS HA H 101 4.898 4.379 0.519 1
1 1184 . 12 1 1 A 101 101 HIS C C 101 174.345 173.711 0.634 1
1 1185 . 12 1 1 A 101 101 HIS CA C 101 55.072 56.314 -1.242 1
1 1186 . 12 1 1 A 101 101 HIS CB C 101 32.835 27.478 5.357 1
1 1189 . 12 1 1 A 101 101 HIS N N 101 125.953 116.652 9.301 1
1 1190 . 12 1 1 A 102 102 TYR H H 102 9.023 9.050 -0.027 1
1 1191 . 12 1 1 A 102 102 TYR HA H 102 4.545 4.819 -0.274 1
1 1198 . 12 1 1 A 102 102 TYR C C 102 174.126 175.137 -1.011 1
1 1199 . 12 1 1 A 102 102 TYR CA C 102 57.260 56.617 0.643 1
1 1200 . 12 1 1 A 102 102 TYR CB C 102 40.381 38.945 1.436 1
1 1205 . 12 1 1 A 102 102 TYR N N 102 121.975 119.339 2.636 1
1 1206 . 12 1 1 A 103 103 TYR H H 103 8.899 9.087 -0.188 1
1 1207 . 12 1 1 A 103 103 TYR HA H 103 4.729 4.839 -0.110 1
1 1214 . 12 1 1 A 103 103 TYR C C 103 174.139 175.813 -1.674 1
1 1215 . 12 1 1 A 103 103 TYR CA C 103 58.036 58.050 -0.014 1
1 1216 . 12 1 1 A 103 103 TYR CB C 103 40.485 38.922 1.563 1
1 1221 . 12 1 1 A 103 103 TYR N N 103 122.012 124.047 -2.035 1
1 1222 . 12 1 1 A 104 104 ILE H H 104 8.605 8.659 -0.054 1
1 1223 . 12 1 1 A 104 104 ILE HA H 104 4.859 4.725 0.134 1
1 1233 . 12 1 1 A 104 104 ILE C C 104 172.769 174.197 -1.428 1
1 1234 . 12 1 1 A 104 104 ILE CA C 104 59.554 59.692 -0.138 1
1 1235 . 12 1 1 A 104 104 ILE CB C 104 40.631 41.624 -0.993 1
1 1239 . 12 1 1 A 104 104 ILE N N 104 123.443 123.812 -0.369 1
1 1240 . 12 1 1 A 105 105 GLN H H 105 9.369 8.619 0.750 1
1 1241 . 12 1 1 A 105 105 GLN HA H 105 4.895 4.998 -0.103 1
1 1248 . 12 1 1 A 105 105 GLN C C 105 175.642 174.488 1.154 1
1 1249 . 12 1 1 A 105 105 GLN CA C 105 54.965 53.903 1.062 1
1 1250 . 12 1 1 A 105 105 GLN CB C 105 32.856 32.245 0.611 1
1 1252 . 12 1 1 A 105 105 GLN N N 105 125.079 123.761 1.318 1
1 1254 . 12 1 1 A 106 106 ALA H H 106 8.513 8.348 0.165 1
1 1255 . 12 1 1 A 106 106 ALA HA H 106 4.962 4.844 0.118 1
1 1259 . 12 1 1 A 106 106 ALA C C 106 175.854 178.091 -2.237 1
1 1260 . 12 1 1 A 106 106 ALA CA C 106 50.272 50.093 0.179 1
1 1261 . 12 1 1 A 106 106 ALA CB C 106 21.197 22.256 -1.059 1
1 1262 . 12 1 1 A 106 106 ALA N N 106 129.303 127.632 1.671 1
1 1263 . 12 1 1 A 107 107 SER H H 107 9.468 9.121 0.347 1
1 1264 . 12 1 1 A 107 107 SER HA H 107 4.447 4.392 0.055 1
1 1267 . 12 1 1 A 107 107 SER C C 107 173.785 173.604 0.181 1
1 1268 . 12 1 1 A 107 107 SER CA C 107 60.048 61.387 -1.339 1
1 1269 . 12 1 1 A 107 107 SER CB C 107 64.643 63.465 1.178 1
1 1270 . 12 1 1 A 107 107 SER N N 107 112.962 116.351 -3.389 1
1 1271 . 12 1 1 A 108 108 SER H H 108 7.555 7.952 -0.397 1
1 1272 . 12 1 1 A 108 108 SER HA H 108 4.665 4.931 -0.266 1
1 1275 . 12 1 1 A 108 108 SER C C 108 174.381 174.596 -0.215 1
1 1276 . 12 1 1 A 108 108 SER CA C 108 56.907 56.314 0.593 1
1 1277 . 12 1 1 A 108 108 SER CB C 108 66.370 66.297 0.073 1
1 1278 . 12 1 1 A 108 108 SER N N 108 112.243 114.282 -2.039 1
1 1279 . 12 1 1 A 109 109 LYS H H 109 8.978 9.212 -0.234 1
1 1280 . 12 1 1 A 109 109 LYS HA H 109 4.777 3.923 0.854 1
1 1287 . 12 1 1 A 109 109 LYS C C 109 179.992 178.558 1.434 1
1 1288 . 12 1 1 A 109 109 LYS CA C 109 59.766 60.451 -0.685 1
1 1289 . 12 1 1 A 109 109 LYS CB C 109 32.342 32.355 -0.013 1
1 1293 . 12 1 1 A 109 109 LYS N N 109 123.170 125.903 -2.733 1
1 1294 . 12 1 1 A 110 110 ALA H H 110 8.608 8.081 0.527 1
1 1295 . 12 1 1 A 110 110 ALA HA H 110 4.178 4.123 0.055 1
1 1299 . 12 1 1 A 110 110 ALA C C 110 179.895 179.209 0.686 1
1 1300 . 12 1 1 A 110 110 ALA CA C 110 54.871 55.311 -0.440 1
1 1301 . 12 1 1 A 110 110 ALA CB C 110 18.065 18.244 -0.179 1
1 1302 . 12 1 1 A 110 110 ALA N N 110 123.750 121.513 2.237 1
1 1303 . 12 1 1 A 111 111 GLU H H 111 8.185 8.317 -0.132 1
1 1304 . 12 1 1 A 111 111 GLU HA H 111 4.180 4.046 0.134 1
1 1309 . 12 1 1 A 111 111 GLU C C 111 178.587 179.068 -0.481 1
1 1310 . 12 1 1 A 111 111 GLU CA C 111 59.466 59.804 -0.338 1
1 1311 . 12 1 1 A 111 111 GLU CB C 111 31.067 29.330 1.737 1
1 1313 . 12 1 1 A 111 111 GLU N N 111 119.757 118.716 1.041 1
1 1314 . 12 1 1 A 112 112 ARG H H 112 8.008 8.134 -0.126 1
1 1315 . 12 1 1 A 112 112 ARG HA H 112 3.642 4.205 -0.563 1
1 1322 . 12 1 1 A 112 112 ARG C C 112 176.481 178.366 -1.885 1
1 1323 . 12 1 1 A 112 112 ARG CA C 112 60.419 59.562 0.857 1
1 1324 . 12 1 1 A 112 112 ARG CB C 112 29.957 29.914 0.043 1
1 1327 . 12 1 1 A 112 112 ARG N N 112 118.430 119.986 -1.556 1
1 1328 . 12 1 1 A 113 113 ALA H H 113 7.985 7.714 0.271 1
1 1329 . 12 1 1 A 113 113 ALA HA H 113 3.925 4.053 -0.128 1
1 1333 . 12 1 1 A 113 113 ALA C C 113 180.117 180.111 0.006 1
1 1334 . 12 1 1 A 113 113 ALA CA C 113 55.372 55.082 0.290 1
1 1335 . 12 1 1 A 113 113 ALA CB C 113 17.825 18.371 -0.546 1
1 1336 . 12 1 1 A 113 113 ALA N N 113 119.980 120.785 -0.805 1
1 1337 . 12 1 1 A 114 114 GLU H H 114 8.093 8.550 -0.457 1
1 1338 . 12 1 1 A 114 114 GLU HA H 114 3.936 3.916 0.020 1
1 1343 . 12 1 1 A 114 114 GLU C C 114 180.586 179.194 1.392 1
1 1344 . 12 1 1 A 114 114 GLU CA C 114 59.148 59.429 -0.281 1
1 1345 . 12 1 1 A 114 114 GLU CB C 114 30.080 29.304 0.776 1
1 1347 . 12 1 1 A 114 114 GLU N N 114 117.168 117.513 -0.345 1
1 1348 . 12 1 1 A 115 115 TRP H H 115 7.980 8.612 -0.632 1
1 1349 . 12 1 1 A 115 115 TRP HA H 115 3.775 4.357 -0.582 1
1 1358 . 12 1 1 A 115 115 TRP C C 115 177.714 178.599 -0.885 1
1 1359 . 12 1 1 A 115 115 TRP CA C 115 62.696 59.659 3.037 1
1 1360 . 12 1 1 A 115 115 TRP CB C 115 29.052 29.297 -0.245 1
1 1366 . 12 1 1 A 115 115 TRP N N 115 120.974 120.926 0.048 1
1 1368 . 12 1 1 A 116 116 ILE H H 116 8.297 8.626 -0.329 1
1 1369 . 12 1 1 A 116 116 ILE HA H 116 3.270 3.357 -0.087 1
1 1379 . 12 1 1 A 116 116 ILE C C 116 177.568 177.691 -0.123 1
1 1380 . 12 1 1 A 116 116 ILE CA C 116 66.643 64.882 1.761 1
1 1381 . 12 1 1 A 116 116 ILE CB C 116 37.606 37.339 0.267 1
1 1385 . 12 1 1 A 116 116 ILE N N 116 118.408 119.722 -1.314 1
1 1386 . 12 1 1 A 117 117 GLU H H 117 8.026 9.114 -1.088 1
1 1387 . 12 1 1 A 117 117 GLU HA H 117 3.880 3.977 -0.097 1
1 1392 . 12 1 1 A 117 117 GLU C C 117 178.476 178.697 -0.221 1
1 1393 . 12 1 1 A 117 117 GLU CA C 117 59.219 59.778 -0.559 1
1 1394 . 12 1 1 A 117 117 GLU CB C 117 29.381 29.565 -0.184 1
1 1396 . 12 1 1 A 117 117 GLU N N 117 117.096 120.624 -3.528 1
1 1397 . 12 1 1 A 118 118 ALA H H 118 7.555 8.734 -1.179 1
1 1398 . 12 1 1 A 118 118 ALA HA H 118 3.952 4.030 -0.078 1
1 1402 . 12 1 1 A 118 118 ALA C C 118 179.862 180.014 -0.152 1
1 1403 . 12 1 1 A 118 118 ALA CA C 118 54.772 55.138 -0.366 1
1 1404 . 12 1 1 A 118 118 ALA CB C 118 18.277 18.515 -0.238 1
1 1405 . 12 1 1 A 118 118 ALA N N 118 119.817 121.641 -1.824 1
1 1406 . 12 1 1 A 119 119 ILE H H 119 8.167 8.203 -0.036 1
1 1407 . 12 1 1 A 119 119 ILE HA H 119 3.558 3.701 -0.143 1
1 1417 . 12 1 1 A 119 119 ILE C C 119 178.564 178.038 0.526 1
1 1418 . 12 1 1 A 119 119 ILE CA C 119 65.766 65.357 0.409 1
1 1419 . 12 1 1 A 119 119 ILE CB C 119 38.840 38.238 0.602 1
1 1423 . 12 1 1 A 119 119 ILE N N 119 116.280 118.093 -1.813 1
1 1424 . 12 1 1 A 120 120 LYS H H 120 8.790 7.938 0.852 1
1 1425 . 12 1 1 A 120 120 LYS HA H 120 3.965 4.281 -0.316 1
1 1434 . 12 1 1 A 120 120 LYS C C 120 179.673 179.284 0.389 1
1 1435 . 12 1 1 A 120 120 LYS CA C 120 60.031 60.441 -0.410 1
1 1436 . 12 1 1 A 120 120 LYS CB C 120 32.547 32.197 0.350 1
1 1440 . 12 1 1 A 120 120 LYS N N 120 119.650 118.919 0.731 1
1 1441 . 12 1 1 A 121 121 LYS H H 121 7.594 9.060 -1.466 1
1 1442 . 12 1 1 A 121 121 LYS HA H 121 4.095 3.934 0.161 1
1 1451 . 12 1 1 A 121 121 LYS C C 121 177.962 179.125 -1.163 1
1 1452 . 12 1 1 A 121 121 LYS CA C 121 58.848 59.604 -0.756 1
1 1453 . 12 1 1 A 121 121 LYS CB C 121 32.547 32.311 0.236 1
1 1457 . 12 1 1 A 121 121 LYS N N 121 117.197 119.578 -2.381 1
1 1458 . 12 1 1 A 122 122 LEU H H 122 7.586 7.901 -0.315 1
1 1459 . 12 1 1 A 122 122 LEU HA H 122 4.535 3.991 0.544 1
1 1469 . 12 1 1 A 122 122 LEU C C 122 177.902 178.211 -0.309 1
1 1470 . 12 1 1 A 122 122 LEU CA C 122 55.071 57.961 -2.890 1
1 1471 . 12 1 1 A 122 122 LEU CB C 122 42.888 41.764 1.124 1
1 1475 . 12 1 1 A 122 122 LEU N N 122 116.861 120.155 -3.294 1
1 1476 . 12 1 1 A 123 123 THR H H 123 7.636 8.100 -0.464 1
1 1477 . 12 1 1 A 123 123 THR HA H 123 4.445 4.258 0.187 1
1 1482 . 12 1 1 A 123 123 THR C C 123 175.714 174.006 1.708 1
1 1483 . 12 1 1 A 123 123 THR CA C 123 62.643 61.872 0.771 1
1 1484 . 12 1 1 A 123 123 THR CB C 123 70.259 68.025 2.234 1
1 1486 . 12 1 1 A 123 123 THR N N 123 108.963 107.524 1.439 1
1 1487 . 12 1 1 A 124 124 SER H H 124 7.912 8.867 -0.955 1
1 1488 . 12 1 1 A 124 124 SER HA H 124 4.626 4.608 0.018 1
1 1491 . 12 1 1 A 124 124 SER C C 124 174.405 174.916 -0.511 1
1 1492 . 12 1 1 A 124 124 SER CA C 124 58.390 59.471 -1.081 1
1 1493 . 12 1 1 A 124 124 SER CB C 124 64.255 64.924 -0.669 1
1 1494 . 12 1 1 A 124 124 SER N N 124 116.876 119.406 -2.530 1
1 1495 . 12 1 1 A 125 125 GLY H H 125 8.307 8.047 0.260 1
1 1496 . 12 1 1 A 125 125 GLY HA2 H 125 4.166 3.939 0.227 1
1 1497 . 12 1 1 A 125 125 GLY HA3 H 125 4.166 3.939 0.227 1
1 1498 . 12 1 1 A 125 125 GLY C C 125 171.921 175.297 -3.376 1
1 1499 . 12 1 1 A 125 125 GLY CA C 125 44.748 46.739 -1.991 1
1 1500 . 12 1 1 A 125 125 GLY N N 125 110.006 108.694 1.312 1
1 1501 . 12 1 1 A 126 126 PRO HA H 126 4.510 4.468 0.042 1
1 1508 . 12 1 1 A 126 126 PRO C C 126 177.471 176.560 0.911 1
1 1509 . 12 1 1 A 126 126 PRO CA C 126 63.419 64.860 -1.441 1
1 1510 . 12 1 1 A 126 126 PRO CB C 126 32.106 32.054 0.052 1
1 1513 . 12 1 1 A 127 127 SER H H 127 8.607 7.813 0.794 1
1 1514 . 12 1 1 A 127 127 SER C C 127 174.628 173.720 0.908 1
1 1515 . 12 1 1 A 127 127 SER CA C 127 58.513 57.592 0.921 1
1 1516 . 12 1 1 A 127 127 SER CB C 127 63.679 66.811 -3.132 1
1 1517 . 12 1 1 A 127 127 SER N N 127 116.390 113.167 3.223 1
1 1518 . 12 1 1 A 128 128 SER H H 128 8.272 8.722 -0.450 1
1 1519 . 12 1 1 A 128 128 SER HA H 128 4.496 4.077 0.419 1
1 1520 . 12 1 1 A 128 128 SER C C 128 173.921 173.750 0.171 1
1 1521 . 12 1 1 A 128 128 SER CA C 128 58.442 59.010 -0.568 1
1 1522 . 12 1 1 A 128 128 SER CB C 128 64.173 61.860 2.313 1
1 1523 . 12 1 1 A 128 128 SER N N 128 117.506 115.653 1.853 1
1 1 . 13 1 1 A 7 7 GLY HA2 H 7 3.978 4.168 -0.190 1
1 2 . 13 1 1 A 7 7 GLY HA3 H 7 3.978 4.173 -0.195 1
1 3 . 13 1 1 A 7 7 GLY C C 7 174.274 174.224 0.050 1
1 4 . 13 1 1 A 7 7 GLY CA C 7 45.383 44.045 1.338 1
1 5 . 13 1 1 A 8 8 SER H H 8 8.211 8.636 -0.425 1
1 6 . 13 1 1 A 8 8 SER HA H 8 4.425 4.595 -0.170 1
1 9 . 13 1 1 A 8 8 SER C C 8 174.635 173.750 0.885 1
1 10 . 13 1 1 A 8 8 SER CA C 8 58.425 59.415 -0.990 1
1 11 . 13 1 1 A 8 8 SER CB C 8 63.885 65.736 -1.851 1
1 12 . 13 1 1 A 8 8 SER N N 8 115.732 114.027 1.705 1
1 13 . 13 1 1 A 9 9 LEU H H 9 8.316 7.928 0.388 1
1 14 . 13 1 1 A 9 9 LEU HA H 9 4.334 4.538 -0.204 1
1 24 . 13 1 1 A 9 9 LEU C C 9 177.447 175.183 2.264 1
1 25 . 13 1 1 A 9 9 LEU CA C 9 55.407 53.517 1.890 1
1 26 . 13 1 1 A 9 9 LEU CB C 9 42.171 42.434 -0.263 1
1 30 . 13 1 1 A 9 9 LEU N N 9 123.943 121.900 2.043 1
1 31 . 13 1 1 A 10 10 SER H H 10 8.304 7.744 0.560 1
1 32 . 13 1 1 A 10 10 SER HA H 10 4.424 5.228 -0.804 1
1 35 . 13 1 1 A 10 10 SER C C 10 175.025 172.619 2.406 1
1 36 . 13 1 1 A 10 10 SER CA C 10 58.425 57.395 1.030 1
1 37 . 13 1 1 A 10 10 SER CB C 10 63.638 64.469 -0.831 1
1 38 . 13 1 1 A 10 10 SER N N 10 116.718 112.977 3.741 1
1 39 . 13 1 1 A 11 11 THR H H 11 8.003 9.060 -1.057 1
1 40 . 13 1 1 A 11 11 THR HA H 11 4.196 4.556 -0.360 1
1 45 . 13 1 1 A 11 11 THR C C 11 176.296 174.236 2.060 1
1 46 . 13 1 1 A 11 11 THR CA C 11 62.483 62.226 0.257 1
1 47 . 13 1 1 A 11 11 THR CB C 11 69.266 70.080 -0.814 1
1 49 . 13 1 1 A 11 11 THR N N 11 114.902 120.778 -5.876 1
1 50 . 13 1 1 A 12 12 VAL H H 12 8.095 8.496 -0.401 1
1 51 . 13 1 1 A 12 12 VAL HA H 12 3.826 4.180 -0.354 1
1 59 . 13 1 1 A 12 12 VAL C C 12 178.501 176.924 1.577 1
1 60 . 13 1 1 A 12 12 VAL CA C 12 64.760 63.674 1.086 1
1 61 . 13 1 1 A 12 12 VAL CB C 12 32.013 33.280 -1.267 1
1 64 . 13 1 1 A 12 12 VAL N N 12 122.111 122.205 -0.094 1
1 65 . 13 1 1 A 13 13 GLU H H 13 8.151 8.746 -0.595 1
1 66 . 13 1 1 A 13 13 GLU HA H 13 3.244 3.338 -0.094 1
1 71 . 13 1 1 A 13 13 GLU C C 13 175.702 178.802 -3.100 1
1 72 . 13 1 1 A 13 13 GLU CA C 13 58.354 59.025 -0.671 1
1 73 . 13 1 1 A 13 13 GLU CB C 13 28.843 28.470 0.373 1
1 75 . 13 1 1 A 13 13 GLU N N 13 120.316 122.201 -1.885 1
1 76 . 13 1 1 A 14 14 LEU H H 14 7.067 7.711 -0.644 1
1 77 . 13 1 1 A 14 14 LEU HA H 14 4.157 4.063 0.094 1
1 87 . 13 1 1 A 14 14 LEU C C 14 176.863 177.558 -0.695 1
1 88 . 13 1 1 A 14 14 LEU CA C 14 53.324 55.612 -2.288 1
1 89 . 13 1 1 A 14 14 LEU CB C 14 41.636 41.664 -0.028 1
1 93 . 13 1 1 A 14 14 LEU N N 14 117.035 120.054 -3.019 1
1 94 . 13 1 1 A 15 15 SER H H 15 7.645 7.885 -0.240 1
1 95 . 13 1 1 A 15 15 SER HA H 15 4.305 4.516 -0.211 1
1 98 . 13 1 1 A 15 15 SER C C 15 175.340 173.180 2.160 1
1 99 . 13 1 1 A 15 15 SER CA C 15 59.783 57.801 1.982 1
1 100 . 13 1 1 A 15 15 SER CB C 15 64.625 61.149 3.476 1
1 101 . 13 1 1 A 15 15 SER N N 15 114.216 113.277 0.939 1
1 102 . 13 1 1 A 16 16 GLY H H 16 8.506 7.953 0.553 1
1 103 . 13 1 1 A 16 16 GLY HA2 H 16 4.237 4.252 -0.015 1
1 104 . 13 1 1 A 16 16 GLY HA3 H 16 3.927 4.273 -0.346 1
1 105 . 13 1 1 A 16 16 GLY C C 16 173.661 172.319 1.342 1
1 106 . 13 1 1 A 16 16 GLY CA C 16 44.995 43.570 1.425 1
1 107 . 13 1 1 A 16 16 GLY N N 16 111.838 109.807 2.031 1
1 108 . 13 1 1 A 17 17 THR H H 17 8.482 8.812 -0.330 1
1 109 . 13 1 1 A 17 17 THR HA H 17 4.319 4.415 -0.096 1
1 114 . 13 1 1 A 17 17 THR C C 17 174.758 174.404 0.354 1
1 115 . 13 1 1 A 17 17 THR CA C 17 62.272 63.517 -1.245 1
1 116 . 13 1 1 A 17 17 THR CB C 17 70.706 69.051 1.655 1
1 118 . 13 1 1 A 17 17 THR N N 17 116.679 115.305 1.374 1
1 119 . 13 1 1 A 18 18 VAL H H 18 8.948 8.759 0.189 1
1 120 . 13 1 1 A 18 18 VAL HA H 18 3.950 4.382 -0.432 1
1 128 . 13 1 1 A 18 18 VAL C C 18 176.669 176.909 -0.240 1
1 129 . 13 1 1 A 18 18 VAL CA C 18 64.813 63.610 1.203 1
1 130 . 13 1 1 A 18 18 VAL CB C 18 31.807 31.605 0.202 1
1 133 . 13 1 1 A 18 18 VAL N N 18 127.156 127.535 -0.379 1
1 134 . 13 1 1 A 19 19 VAL H H 19 9.359 8.914 0.445 1
1 135 . 13 1 1 A 19 19 VAL HA H 19 4.234 4.388 -0.154 1
1 143 . 13 1 1 A 19 19 VAL C C 19 175.738 175.817 -0.079 1
1 144 . 13 1 1 A 19 19 VAL CA C 19 62.060 62.092 -0.032 1
1 145 . 13 1 1 A 19 19 VAL CB C 19 33.822 33.443 0.379 1
1 148 . 13 1 1 A 19 19 VAL N N 19 125.162 121.916 3.246 1
1 149 . 13 1 1 A 20 20 LYS H H 20 7.584 7.201 0.383 1
1 150 . 13 1 1 A 20 20 LYS HA H 20 4.346 4.607 -0.261 1
1 159 . 13 1 1 A 20 20 LYS C C 20 172.818 174.017 -1.199 1
1 160 . 13 1 1 A 20 20 LYS CA C 20 56.801 55.594 1.207 1
1 161 . 13 1 1 A 20 20 LYS CB C 20 36.624 35.487 1.137 1
1 165 . 13 1 1 A 20 20 LYS N N 20 121.024 120.879 0.145 1
1 166 . 13 1 1 A 21 21 GLN H H 21 8.625 8.470 0.155 1
1 167 . 13 1 1 A 21 21 GLN HA H 21 6.003 5.365 0.638 1
1 174 . 13 1 1 A 21 21 GLN C C 21 174.914 174.811 0.103 1
1 175 . 13 1 1 A 21 21 GLN CA C 21 54.207 54.647 -0.440 1
1 176 . 13 1 1 A 21 21 GLN CB C 21 33.452 33.476 -0.024 1
1 178 . 13 1 1 A 21 21 GLN N N 21 122.108 124.073 -1.965 1
1 180 . 13 1 1 A 22 22 GLY H H 22 8.964 8.370 0.594 1
1 181 . 13 1 1 A 22 22 GLY HA2 H 22 4.665 4.408 0.257 1
1 182 . 13 1 1 A 22 22 GLY HA3 H 22 4.295 4.608 -0.313 1
1 183 . 13 1 1 A 22 22 GLY C C 22 170.879 171.693 -0.814 1
1 184 . 13 1 1 A 22 22 GLY CA C 22 45.683 45.648 0.035 1
1 185 . 13 1 1 A 22 22 GLY N N 22 108.508 109.076 -0.568 1
1 186 . 13 1 1 A 23 23 TYR H H 23 9.145 8.727 0.418 1
1 187 . 13 1 1 A 23 23 TYR HA H 23 5.595 5.673 -0.078 1
1 194 . 13 1 1 A 23 23 TYR C C 23 175.824 175.224 0.600 1
1 195 . 13 1 1 A 23 23 TYR CA C 23 58.019 56.618 1.401 1
1 196 . 13 1 1 A 23 23 TYR CB C 23 39.251 40.970 -1.719 1
1 201 . 13 1 1 A 23 23 TYR N N 23 120.809 119.799 1.010 1
1 202 . 13 1 1 A 24 24 LEU H H 24 8.935 9.916 -0.981 1
1 203 . 13 1 1 A 24 24 LEU HA H 24 4.716 5.021 -0.305 1
1 213 . 13 1 1 A 24 24 LEU C C 24 174.648 175.458 -0.810 1
1 214 . 13 1 1 A 24 24 LEU CA C 24 53.907 53.312 0.595 1
1 215 . 13 1 1 A 24 24 LEU CB C 24 46.078 45.791 0.287 1
1 219 . 13 1 1 A 24 24 LEU N N 24 122.887 124.121 -1.234 1
1 220 . 13 1 1 A 25 25 ALA H H 25 8.145 8.732 -0.587 1
1 221 . 13 1 1 A 25 25 ALA HA H 25 5.477 5.927 -0.450 1
1 225 . 13 1 1 A 25 25 ALA C C 25 175.751 175.619 0.132 1
1 226 . 13 1 1 A 25 25 ALA CA C 25 50.719 50.196 0.523 1
1 227 . 13 1 1 A 25 25 ALA CB C 25 21.074 21.761 -0.687 1
1 228 . 13 1 1 A 25 25 ALA N N 25 122.280 123.377 -1.097 1
1 229 . 13 1 1 A 26 26 LYS H H 26 9.167 8.601 0.566 1
1 230 . 13 1 1 A 26 26 LYS HA H 26 5.221 4.815 0.406 1
1 239 . 13 1 1 A 26 26 LYS C C 26 175.421 175.828 -0.407 1
1 240 . 13 1 1 A 26 26 LYS CA C 26 54.383 54.836 -0.453 1
1 241 . 13 1 1 A 26 26 LYS CB C 26 36.125 34.145 1.980 1
1 245 . 13 1 1 A 26 26 LYS N N 26 120.638 123.407 -2.769 1
1 246 . 13 1 1 A 27 27 GLN H H 27 7.866 7.937 -0.071 1
1 247 . 13 1 1 A 27 27 GLN HA H 27 3.525 3.482 0.043 1
1 254 . 13 1 1 A 27 27 GLN C C 27 177.022 175.323 1.699 1
1 255 . 13 1 1 A 27 27 GLN CA C 27 55.778 55.967 -0.189 1
1 256 . 13 1 1 A 27 27 GLN CB C 27 29.864 28.144 1.720 1
1 258 . 13 1 1 A 27 27 GLN N N 27 130.194 127.226 2.968 1
1 260 . 13 1 1 A 28 28 GLY H H 28 8.565 8.257 0.308 1
1 261 . 13 1 1 A 28 28 GLY HA2 H 28 4.125 4.012 0.113 1
1 262 . 13 1 1 A 28 28 GLY HA3 H 28 4.034 4.092 -0.058 1
1 263 . 13 1 1 A 28 28 GLY C C 28 174.030 173.693 0.337 1
1 264 . 13 1 1 A 28 28 GLY CA C 28 45.665 45.939 -0.274 1
1 265 . 13 1 1 A 28 28 GLY N N 28 115.528 113.545 1.983 1
1 266 . 13 1 1 A 29 29 HIS HA H 29 4.355 4.842 -0.487 1
1 271 . 13 1 1 A 29 29 HIS CA C 29 58.795 56.205 2.590 1
1 272 . 13 1 1 A 29 29 HIS CB C 29 31.283 32.821 -1.538 1
1 275 . 13 1 1 A 30 30 LYS HA H 30 4.096 4.431 -0.335 1
1 284 . 13 1 1 A 30 30 LYS CA C 30 57.290 55.356 1.934 1
1 285 . 13 1 1 A 30 30 LYS CB C 30 31.951 35.568 -3.617 1
1 289 . 13 1 1 A 31 31 ARG HA H 31 3.975 3.858 0.117 1
1 296 . 13 1 1 A 31 31 ARG CA C 31 55.973 59.726 -3.753 1
1 297 . 13 1 1 A 31 31 ARG CB C 31 29.902 30.301 -0.399 1
1 300 . 13 1 1 A 32 32 LYS HA H 32 4.160 4.427 -0.267 1
1 309 . 13 1 1 A 32 32 LYS C C 32 175.678 176.398 -0.720 1
1 310 . 13 1 1 A 32 32 LYS CA C 32 56.254 57.096 -0.842 1
1 311 . 13 1 1 A 32 32 LYS CB C 32 31.602 33.490 -1.888 1
1 315 . 13 1 1 A 33 33 ASN H H 33 7.925 7.813 0.112 1
1 316 . 13 1 1 A 33 33 ASN HA H 33 4.799 4.731 0.068 1
1 321 . 13 1 1 A 33 33 ASN C C 33 174.005 174.895 -0.890 1
1 322 . 13 1 1 A 33 33 ASN CA C 33 52.407 52.084 0.323 1
1 323 . 13 1 1 A 33 33 ASN CB C 33 39.879 39.197 0.682 1
1 324 . 13 1 1 A 33 33 ASN N N 33 116.990 114.905 2.085 1
1 326 . 13 1 1 A 34 34 TRP H H 34 8.798 8.182 0.616 1
1 327 . 13 1 1 A 34 34 TRP HA H 34 4.755 4.765 -0.010 1
1 336 . 13 1 1 A 34 34 TRP C C 34 176.090 176.083 0.007 1
1 337 . 13 1 1 A 34 34 TRP CA C 34 57.119 56.961 0.158 1
1 338 . 13 1 1 A 34 34 TRP CB C 34 30.596 30.829 -0.233 1
1 344 . 13 1 1 A 34 34 TRP N N 34 121.917 119.955 1.962 1
1 346 . 13 1 1 A 35 35 LYS H H 35 8.404 8.656 -0.252 1
1 347 . 13 1 1 A 35 35 LYS HA H 35 4.846 5.033 -0.187 1
1 354 . 13 1 1 A 35 35 LYS C C 35 176.088 175.378 0.710 1
1 355 . 13 1 1 A 35 35 LYS CA C 35 54.418 54.844 -0.426 1
1 356 . 13 1 1 A 35 35 LYS CB C 35 36.125 35.026 1.099 1
1 360 . 13 1 1 A 35 35 LYS N N 35 120.864 120.126 0.738 1
1 361 . 13 1 1 A 36 36 VAL H H 36 8.977 8.440 0.537 1
1 362 . 13 1 1 A 36 36 VAL HA H 36 4.274 4.775 -0.501 1
1 370 . 13 1 1 A 36 36 VAL C C 36 176.733 175.310 1.423 1
1 371 . 13 1 1 A 36 36 VAL CA C 36 64.319 61.097 3.222 1
1 372 . 13 1 1 A 36 36 VAL CB C 36 31.602 33.208 -1.606 1
1 375 . 13 1 1 A 36 36 VAL N N 36 124.314 121.355 2.959 1
1 376 . 13 1 1 A 37 37 ARG H H 37 9.498 10.385 -0.887 1
1 377 . 13 1 1 A 37 37 ARG HA H 37 5.053 5.108 -0.055 1
1 384 . 13 1 1 A 37 37 ARG C C 37 174.442 174.574 -0.132 1
1 385 . 13 1 1 A 37 37 ARG CA C 37 53.272 54.063 -0.791 1
1 386 . 13 1 1 A 37 37 ARG CB C 37 34.563 34.550 0.013 1
1 389 . 13 1 1 A 37 37 ARG N N 37 128.121 126.113 2.008 1
1 390 . 13 1 1 A 38 38 ARG H H 38 8.755 8.515 0.240 1
1 391 . 13 1 1 A 38 38 ARG HA H 38 4.626 4.387 0.239 1
1 398 . 13 1 1 A 38 38 ARG C C 38 175.514 174.950 0.564 1
1 399 . 13 1 1 A 38 38 ARG CA C 38 55.601 55.563 0.038 1
1 400 . 13 1 1 A 38 38 ARG CB C 38 32.219 30.816 1.403 1
1 403 . 13 1 1 A 38 38 ARG N N 38 121.442 123.279 -1.837 1
1 404 . 13 1 1 A 39 39 PHE H H 39 9.865 9.130 0.735 1
1 405 . 13 1 1 A 39 39 PHE HA H 39 5.424 5.040 0.384 1
1 413 . 13 1 1 A 39 39 PHE C C 39 175.423 174.775 0.648 1
1 414 . 13 1 1 A 39 39 PHE CA C 39 57.419 56.917 0.502 1
1 415 . 13 1 1 A 39 39 PHE CB C 39 42.623 40.748 1.875 1
1 421 . 13 1 1 A 39 39 PHE N N 39 130.027 126.490 3.537 1
1 422 . 13 1 1 A 40 40 VAL H H 40 9.300 9.746 -0.446 1
1 423 . 13 1 1 A 40 40 VAL HA H 40 4.846 5.333 -0.487 1
1 431 . 13 1 1 A 40 40 VAL C C 40 174.477 173.234 1.243 1
1 432 . 13 1 1 A 40 40 VAL CA C 40 62.343 59.822 2.521 1
1 433 . 13 1 1 A 40 40 VAL CB C 40 35.755 34.842 0.913 1
1 436 . 13 1 1 A 40 40 VAL N N 40 119.369 122.387 -3.018 1
1 437 . 13 1 1 A 41 41 LEU H H 41 9.557 9.976 -0.419 1
1 438 . 13 1 1 A 41 41 LEU HA H 41 5.292 5.582 -0.290 1
1 448 . 13 1 1 A 41 41 LEU C C 41 174.632 175.640 -1.008 1
1 449 . 13 1 1 A 41 41 LEU CA C 41 53.571 53.774 -0.203 1
1 450 . 13 1 1 A 41 41 LEU CB C 41 45.337 45.008 0.329 1
1 454 . 13 1 1 A 41 41 LEU N N 41 132.121 129.170 2.951 1
1 455 . 13 1 1 A 42 42 ARG H H 42 9.396 8.915 0.481 1
1 456 . 13 1 1 A 42 42 ARG HA H 42 5.366 5.348 0.018 1
1 464 . 13 1 1 A 42 42 ARG C C 42 173.997 174.659 -0.662 1
1 465 . 13 1 1 A 42 42 ARG CA C 42 54.631 54.094 0.537 1
1 466 . 13 1 1 A 42 42 ARG CB C 42 35.550 34.475 1.075 1
1 469 . 13 1 1 A 42 42 ARG N N 42 128.120 123.949 4.171 1
1 471 . 13 1 1 A 43 43 LYS H H 43 8.597 8.855 -0.258 1
1 472 . 13 1 1 A 43 43 LYS HA H 43 4.558 4.949 -0.391 1
1 481 . 13 1 1 A 43 43 LYS C C 43 174.648 174.959 -0.311 1
1 482 . 13 1 1 A 43 43 LYS CA C 43 53.378 54.798 -1.420 1
1 483 . 13 1 1 A 43 43 LYS CB C 43 37.303 35.925 1.378 1
1 487 . 13 1 1 A 43 43 LYS N N 43 114.484 118.623 -4.139 1
1 488 . 13 1 1 A 44 44 ASP H H 44 8.388 8.882 -0.494 1
1 489 . 13 1 1 A 44 44 ASP HA H 44 4.349 4.140 0.209 1
1 492 . 13 1 1 A 44 44 ASP C C 44 173.376 174.608 -1.232 1
1 493 . 13 1 1 A 44 44 ASP CA C 44 54.842 54.803 0.039 1
1 494 . 13 1 1 A 44 44 ASP CB C 44 39.991 39.470 0.521 1
1 495 . 13 1 1 A 44 44 ASP N N 44 115.453 117.989 -2.536 1
1 496 . 13 1 1 A 45 45 PRO HA H 45 4.652 4.644 0.008 1
1 503 . 13 1 1 A 45 45 PRO C C 45 176.914 175.539 1.375 1
1 504 . 13 1 1 A 45 45 PRO CA C 45 63.490 62.628 0.862 1
1 505 . 13 1 1 A 45 45 PRO CB C 45 34.892 32.979 1.913 1
1 508 . 13 1 1 A 46 46 ALA H H 46 8.112 8.460 -0.348 1
1 509 . 13 1 1 A 46 46 ALA HA H 46 5.455 4.796 0.659 1
1 513 . 13 1 1 A 46 46 ALA C C 46 177.234 176.821 0.413 1
1 514 . 13 1 1 A 46 46 ALA CA C 46 51.560 50.696 0.864 1
1 515 . 13 1 1 A 46 46 ALA CB C 46 20.122 19.909 0.213 1
1 516 . 13 1 1 A 46 46 ALA N N 46 120.155 123.345 -3.190 1
1 517 . 13 1 1 A 47 47 PHE H H 47 8.717 9.045 -0.328 1
1 518 . 13 1 1 A 47 47 PHE HA H 47 4.795 5.069 -0.274 1
1 526 . 13 1 1 A 47 47 PHE C C 47 172.588 174.358 -1.770 1
1 527 . 13 1 1 A 47 47 PHE CA C 47 57.348 56.331 1.017 1
1 528 . 13 1 1 A 47 47 PHE CB C 47 47.123 44.179 2.944 1
1 534 . 13 1 1 A 47 47 PHE N N 47 129.946 119.710 10.236 1
1 535 . 13 1 1 A 48 48 LEU H H 48 7.883 8.155 -0.272 1
1 536 . 13 1 1 A 48 48 LEU HA H 48 5.198 5.053 0.145 1
1 546 . 13 1 1 A 48 48 LEU C C 48 173.569 174.330 -0.761 1
1 547 . 13 1 1 A 48 48 LEU CA C 48 53.290 54.317 -1.027 1
1 548 . 13 1 1 A 48 48 LEU CB C 48 45.502 45.575 -0.073 1
1 552 . 13 1 1 A 48 48 LEU N N 48 121.108 121.552 -0.444 1
1 553 . 13 1 1 A 49 49 HIS H H 49 8.606 8.913 -0.307 1
1 554 . 13 1 1 A 49 49 HIS HA H 49 5.035 5.090 -0.055 1
1 559 . 13 1 1 A 49 49 HIS C C 49 173.993 173.738 0.255 1
1 560 . 13 1 1 A 49 49 HIS CA C 49 56.483 54.154 2.329 1
1 561 . 13 1 1 A 49 49 HIS CB C 49 35.919 33.553 2.366 1
1 564 . 13 1 1 A 49 49 HIS N N 49 121.199 125.692 -4.493 1
1 565 . 13 1 1 A 50 50 TYR H H 50 7.777 8.316 -0.539 1
1 566 . 13 1 1 A 50 50 TYR HA H 50 5.695 5.507 0.188 1
1 573 . 13 1 1 A 50 50 TYR C C 50 174.284 172.079 2.205 1
1 574 . 13 1 1 A 50 50 TYR CA C 50 53.430 55.498 -2.068 1
1 575 . 13 1 1 A 50 50 TYR CB C 50 38.552 41.105 -2.553 1
1 580 . 13 1 1 A 50 50 TYR N N 50 114.156 117.393 -3.237 1
1 581 . 13 1 1 A 51 51 TYR H H 51 9.323 9.568 -0.245 1
1 582 . 13 1 1 A 51 51 TYR HA H 51 4.600 5.130 -0.530 1
1 589 . 13 1 1 A 51 51 TYR C C 51 175.352 174.610 0.742 1
1 590 . 13 1 1 A 51 51 TYR CA C 51 57.330 56.203 1.127 1
1 591 . 13 1 1 A 51 51 TYR CB C 51 41.683 41.919 -0.236 1
1 596 . 13 1 1 A 51 51 TYR N N 51 119.100 120.028 -0.928 1
1 597 . 13 1 1 A 52 52 ASP H H 52 9.375 8.713 0.662 1
1 598 . 13 1 1 A 52 52 ASP HA H 52 5.064 4.957 0.107 1
1 601 . 13 1 1 A 52 52 ASP C C 52 175.484 175.702 -0.218 1
1 602 . 13 1 1 A 52 52 ASP CA C 52 51.313 51.245 0.068 1
1 603 . 13 1 1 A 52 52 ASP CB C 52 41.883 42.124 -0.241 1
1 604 . 13 1 1 A 52 52 ASP N N 52 124.636 123.191 1.445 1
1 605 . 13 1 1 A 53 53 PRO HA H 53 4.678 4.653 0.025 1
1 612 . 13 1 1 A 53 53 PRO C C 53 176.781 178.196 -1.415 1
1 613 . 13 1 1 A 53 53 PRO CA C 53 64.054 64.083 -0.029 1
1 614 . 13 1 1 A 53 53 PRO CB C 53 32.589 32.085 0.504 1
1 617 . 13 1 1 A 54 54 SER H H 54 8.685 8.151 0.534 1
1 618 . 13 1 1 A 54 54 SER HA H 54 4.483 4.472 0.011 1
1 621 . 13 1 1 A 54 54 SER C C 54 174.006 174.569 -0.563 1
1 622 . 13 1 1 A 54 54 SER CA C 54 59.378 61.007 -1.629 1
1 623 . 13 1 1 A 54 54 SER CB C 54 64.132 64.079 0.053 1
1 624 . 13 1 1 A 54 54 SER N N 54 113.769 112.262 1.507 1
1 625 . 13 1 1 A 55 55 LYS H H 55 7.706 8.735 -1.029 1
1 626 . 13 1 1 A 55 55 LYS HA H 55 4.580 4.503 0.077 1
1 635 . 13 1 1 A 55 55 LYS C C 55 175.969 175.456 0.513 1
1 636 . 13 1 1 A 55 55 LYS CA C 55 55.160 56.230 -1.070 1
1 637 . 13 1 1 A 55 55 LYS CB C 55 34.069 33.903 0.166 1
1 641 . 13 1 1 A 55 55 LYS N N 55 122.222 120.199 2.023 1
1 642 . 13 1 1 A 56 56 GLU H H 56 8.666 8.704 -0.038 1
1 643 . 13 1 1 A 56 56 GLU HA H 56 4.174 5.079 -0.905 1
1 648 . 13 1 1 A 56 56 GLU C C 56 177.084 174.864 2.220 1
1 649 . 13 1 1 A 56 56 GLU CA C 56 57.099 55.747 1.352 1
1 650 . 13 1 1 A 56 56 GLU CB C 56 29.694 31.990 -2.296 1
1 652 . 13 1 1 A 56 56 GLU N N 56 122.015 118.482 3.533 1
1 653 . 13 1 1 A 57 57 GLU H H 57 8.303 8.808 -0.505 1
1 654 . 13 1 1 A 57 57 GLU HA H 57 4.214 4.686 -0.472 1
1 659 . 13 1 1 A 57 57 GLU CA C 57 56.960 55.571 1.389 1
1 660 . 13 1 1 A 57 57 GLU CB C 57 30.264 34.158 -3.894 1
1 662 . 13 1 1 A 57 57 GLU N N 57 119.884 124.809 -4.925 1
1 663 . 13 1 1 A 58 58 ASN HA H 58 4.768 4.881 -0.113 1
1 668 . 13 1 1 A 58 58 ASN C C 58 174.902 173.854 1.048 1
1 669 . 13 1 1 A 58 58 ASN CA C 58 52.740 52.789 -0.049 1
1 670 . 13 1 1 A 58 58 ASN CB C 58 38.116 36.492 1.624 1
1 672 . 13 1 1 A 59 59 ARG H H 59 7.805 8.028 -0.223 1
1 673 . 13 1 1 A 59 59 ARG HA H 59 4.762 4.642 0.120 1
1 680 . 13 1 1 A 59 59 ARG CA C 59 53.151 54.749 -1.598 1
1 681 . 13 1 1 A 59 59 ARG CB C 59 31.519 33.735 -2.216 1
1 684 . 13 1 1 A 59 59 ARG N N 59 121.060 120.738 0.322 1
1 685 . 13 1 1 A 60 60 PRO HA H 60 3.357 4.146 -0.789 1
1 692 . 13 1 1 A 60 60 PRO C C 60 176.817 176.306 0.511 1
1 693 . 13 1 1 A 60 60 PRO CA C 60 63.031 61.965 1.066 1
1 694 . 13 1 1 A 60 60 PRO CB C 60 31.273 32.575 -1.302 1
1 697 . 13 1 1 A 61 61 VAL H H 61 8.627 8.622 0.005 1
1 698 . 13 1 1 A 61 61 VAL HA H 61 3.966 4.026 -0.060 1
1 706 . 13 1 1 A 61 61 VAL C C 61 176.503 176.261 0.242 1
1 707 . 13 1 1 A 61 61 VAL CA C 61 63.154 63.704 -0.550 1
1 708 . 13 1 1 A 61 61 VAL CB C 61 32.048 32.774 -0.726 1
1 711 . 13 1 1 A 61 61 VAL N N 61 119.185 119.063 0.122 1
1 712 . 13 1 1 A 62 62 GLY H H 62 6.715 6.256 0.459 1
1 713 . 13 1 1 A 62 62 GLY HA2 H 62 3.940 3.824 0.116 1
1 714 . 13 1 1 A 62 62 GLY HA3 H 62 3.538 3.930 -0.392 1
1 715 . 13 1 1 A 62 62 GLY C C 62 169.983 172.397 -2.414 1
1 716 . 13 1 1 A 62 62 GLY CA C 62 44.465 45.221 -0.756 1
1 717 . 13 1 1 A 62 62 GLY N N 62 105.813 105.798 0.015 1
1 718 . 13 1 1 A 63 63 GLY H H 63 8.004 8.380 -0.376 1
1 719 . 13 1 1 A 63 63 GLY HA2 H 63 4.095 3.200 0.895 1
1 720 . 13 1 1 A 63 63 GLY HA3 H 63 3.813 3.769 0.044 1
1 721 . 13 1 1 A 63 63 GLY C C 63 171.870 172.512 -0.642 1
1 722 . 13 1 1 A 63 63 GLY CA C 63 47.148 44.092 3.056 1
1 723 . 13 1 1 A 63 63 GLY N N 63 105.089 107.952 -2.863 1
1 724 . 13 1 1 A 64 64 PHE H H 64 7.967 7.735 0.232 1
1 725 . 13 1 1 A 64 64 PHE HA H 64 4.934 5.564 -0.630 1
1 733 . 13 1 1 A 64 64 PHE C C 64 173.140 173.246 -0.106 1
1 734 . 13 1 1 A 64 64 PHE CA C 64 55.248 55.322 -0.074 1
1 735 . 13 1 1 A 64 64 PHE CB C 64 40.238 42.211 -1.973 1
1 741 . 13 1 1 A 64 64 PHE N N 64 113.387 119.257 -5.870 1
1 742 . 13 1 1 A 65 65 SER H H 65 8.518 8.677 -0.159 1
1 743 . 13 1 1 A 65 65 SER HA H 65 3.264 4.055 -0.791 1
1 746 . 13 1 1 A 65 65 SER C C 65 176.417 174.290 2.127 1
1 747 . 13 1 1 A 65 65 SER CA C 65 56.819 58.264 -1.445 1
1 748 . 13 1 1 A 65 65 SER CB C 65 63.391 63.476 -0.085 1
1 749 . 13 1 1 A 65 65 SER N N 65 114.674 116.163 -1.489 1
1 750 . 13 1 1 A 66 66 LEU H H 66 7.404 7.567 -0.163 1
1 751 . 13 1 1 A 66 66 LEU HA H 66 4.470 4.688 -0.218 1
1 761 . 13 1 1 A 66 66 LEU C C 66 177.993 178.262 -0.269 1
1 762 . 13 1 1 A 66 66 LEU CA C 66 54.242 55.858 -1.616 1
1 763 . 13 1 1 A 66 66 LEU CB C 66 42.787 42.182 0.605 1
1 767 . 13 1 1 A 66 66 LEU N N 66 123.988 129.625 -5.637 1
1 768 . 13 1 1 A 67 67 ARG H H 67 7.865 7.889 -0.024 1
1 769 . 13 1 1 A 67 67 ARG HA H 67 4.175 3.954 0.221 1
1 776 . 13 1 1 A 67 67 ARG C C 67 178.562 177.871 0.691 1
1 777 . 13 1 1 A 67 67 ARG CA C 67 58.143 59.130 -0.987 1
1 778 . 13 1 1 A 67 67 ARG CB C 67 29.052 30.077 -1.025 1
1 781 . 13 1 1 A 67 67 ARG N N 67 122.494 117.902 4.592 1
1 782 . 13 1 1 A 68 68 GLY H H 68 9.398 7.515 1.883 1
1 783 . 13 1 1 A 68 68 GLY HA2 H 68 4.066 3.910 0.156 1
1 784 . 13 1 1 A 68 68 GLY HA3 H 68 3.908 3.910 -0.002 1
1 785 . 13 1 1 A 68 68 GLY C C 68 173.982 173.990 -0.008 1
1 786 . 13 1 1 A 68 68 GLY CA C 68 46.230 46.330 -0.100 1
1 787 . 13 1 1 A 68 68 GLY N N 68 117.548 107.899 9.649 1
1 788 . 13 1 1 A 69 69 SER H H 69 7.829 7.971 -0.142 1
1 789 . 13 1 1 A 69 69 SER HA H 69 4.807 5.166 -0.359 1
1 792 . 13 1 1 A 69 69 SER C C 69 172.854 172.816 0.038 1
1 793 . 13 1 1 A 69 69 SER CA C 69 59.290 56.614 2.676 1
1 794 . 13 1 1 A 69 69 SER CB C 69 65.366 67.007 -1.641 1
1 795 . 13 1 1 A 69 69 SER N N 69 115.188 113.224 1.964 1
1 796 . 13 1 1 A 70 70 LEU H H 70 8.805 8.734 0.071 1
1 797 . 13 1 1 A 70 70 LEU HA H 70 4.846 4.874 -0.028 1
1 807 . 13 1 1 A 70 70 LEU C C 70 175.775 174.212 1.563 1
1 808 . 13 1 1 A 70 70 LEU CA C 70 53.907 53.926 -0.019 1
1 809 . 13 1 1 A 70 70 LEU CB C 70 45.337 46.282 -0.945 1
1 813 . 13 1 1 A 70 70 LEU N N 70 121.265 122.876 -1.611 1
1 814 . 13 1 1 A 71 71 VAL H H 71 8.644 8.871 -0.227 1
1 815 . 13 1 1 A 71 71 VAL HA H 71 5.555 5.165 0.390 1
1 823 . 13 1 1 A 71 71 VAL C C 71 173.636 173.871 -0.235 1
1 824 . 13 1 1 A 71 71 VAL CA C 71 58.760 59.742 -0.982 1
1 825 . 13 1 1 A 71 71 VAL CB C 71 34.891 35.864 -0.973 1
1 828 . 13 1 1 A 71 71 VAL N N 71 122.315 122.663 -0.348 1
1 829 . 13 1 1 A 72 72 SER H H 72 8.750 9.242 -0.492 1
1 830 . 13 1 1 A 72 72 SER HA H 72 4.742 5.116 -0.374 1
1 833 . 13 1 1 A 72 72 SER C C 72 173.058 172.423 0.635 1
1 834 . 13 1 1 A 72 72 SER CA C 72 57.190 56.857 0.333 1
1 835 . 13 1 1 A 72 72 SER CB C 72 65.612 66.590 -0.978 1
1 836 . 13 1 1 A 72 72 SER N N 72 118.611 121.468 -2.857 1
1 837 . 13 1 1 A 73 73 ALA H H 73 9.009 8.837 0.172 1
1 838 . 13 1 1 A 73 73 ALA HA H 73 4.406 5.288 -0.882 1
1 842 . 13 1 1 A 73 73 ALA C C 73 176.708 175.846 0.862 1
1 843 . 13 1 1 A 73 73 ALA CA C 73 52.672 49.999 2.673 1
1 844 . 13 1 1 A 73 73 ALA CB C 73 18.812 22.767 -3.955 1
1 845 . 13 1 1 A 73 73 ALA N N 73 125.694 124.415 1.279 1
1 846 . 13 1 1 A 74 74 LEU H H 74 7.800 8.167 -0.367 1
1 847 . 13 1 1 A 74 74 LEU HA H 74 4.716 4.923 -0.207 1
1 857 . 13 1 1 A 74 74 LEU C C 74 176.551 176.454 0.097 1
1 858 . 13 1 1 A 74 74 LEU CA C 74 53.784 53.269 0.515 1
1 859 . 13 1 1 A 74 74 LEU CB C 74 43.446 43.972 -0.526 1
1 863 . 13 1 1 A 74 74 LEU N N 74 122.271 120.671 1.600 1
1 864 . 13 1 1 A 75 75 GLU H H 75 8.855 8.754 0.101 1
1 865 . 13 1 1 A 75 75 GLU HA H 75 4.336 4.627 -0.291 1
1 870 . 13 1 1 A 75 75 GLU C C 75 176.465 175.683 0.782 1
1 871 . 13 1 1 A 75 75 GLU CA C 75 56.507 55.163 1.344 1
1 872 . 13 1 1 A 75 75 GLU CB C 75 30.245 31.918 -1.673 1
1 874 . 13 1 1 A 75 75 GLU N N 75 122.678 121.363 1.315 1
1 875 . 13 1 1 A 76 76 ASP H H 76 8.542 8.748 -0.206 1
1 876 . 13 1 1 A 76 76 ASP HA H 76 4.665 4.621 0.044 1
1 879 . 13 1 1 A 76 76 ASP C C 76 176.087 176.650 -0.563 1
1 880 . 13 1 1 A 76 76 ASP CA C 76 55.107 56.309 -1.202 1
1 881 . 13 1 1 A 76 76 ASP CB C 76 41.431 40.138 1.293 1
1 882 . 13 1 1 A 76 76 ASP N N 76 121.488 118.435 3.053 1
1 883 . 13 1 1 A 77 77 ASN H H 77 8.322 8.458 -0.136 1
1 884 . 13 1 1 A 77 77 ASN HA H 77 4.729 5.100 -0.371 1
1 889 . 13 1 1 A 77 77 ASN C C 77 175.566 175.002 0.564 1
1 890 . 13 1 1 A 77 77 ASN CA C 77 53.131 51.026 2.105 1
1 891 . 13 1 1 A 77 77 ASN CB C 77 38.617 40.364 -1.747 1
1 892 . 13 1 1 A 77 77 ASN N N 77 118.676 120.161 -1.485 1
1 894 . 13 1 1 A 78 78 GLY H H 78 8.311 8.716 -0.405 1
1 895 . 13 1 1 A 78 78 GLY HA2 H 78 3.897 3.860 0.037 1
1 896 . 13 1 1 A 78 78 GLY HA3 H 78 3.897 3.861 0.036 1
1 897 . 13 1 1 A 78 78 GLY C C 78 173.376 174.296 -0.920 1
1 898 . 13 1 1 A 78 78 GLY CA C 78 45.224 46.965 -1.741 1
1 899 . 13 1 1 A 78 78 GLY N N 78 108.939 108.667 0.272 1
1 900 . 13 1 1 A 79 79 VAL H H 79 7.882 8.212 -0.330 1
1 901 . 13 1 1 A 79 79 VAL HA H 79 4.345 4.178 0.167 1
1 909 . 13 1 1 A 79 79 VAL CA C 79 59.995 63.233 -3.238 1
1 910 . 13 1 1 A 79 79 VAL CB C 79 32.589 30.773 1.816 1
1 913 . 13 1 1 A 79 79 VAL N N 79 121.135 111.175 9.960 1
1 914 . 13 1 1 A 80 80 PRO HA H 80 4.461 4.476 -0.015 1
1 921 . 13 1 1 A 80 80 PRO C C 80 176.979 176.528 0.451 1
1 922 . 13 1 1 A 80 80 PRO CA C 80 63.101 66.245 -3.144 1
1 923 . 13 1 1 A 80 80 PRO CB C 80 32.177 31.607 0.570 1
1 926 . 13 1 1 A 81 81 THR H H 81 8.281 7.861 0.420 1
1 927 . 13 1 1 A 81 81 THR HA H 81 4.095 4.577 -0.482 1
1 932 . 13 1 1 A 81 81 THR C C 81 175.270 175.071 0.199 1
1 933 . 13 1 1 A 81 81 THR CA C 81 62.872 60.933 1.939 1
1 934 . 13 1 1 A 81 81 THR CB C 81 69.642 70.797 -1.155 1
1 936 . 13 1 1 A 81 81 THR N N 81 114.684 109.782 4.902 1
1 937 . 13 1 1 A 82 82 GLY H H 82 8.338 8.756 -0.418 1
1 938 . 13 1 1 A 82 82 GLY HA2 H 82 4.095 3.876 0.219 1
1 939 . 13 1 1 A 82 82 GLY HA3 H 82 3.668 3.892 -0.224 1
1 940 . 13 1 1 A 82 82 GLY C C 82 174.139 174.410 -0.271 1
1 941 . 13 1 1 A 82 82 GLY CA C 82 45.083 47.117 -2.034 1
1 942 . 13 1 1 A 82 82 GLY N N 82 111.289 115.641 -4.352 1
1 943 . 13 1 1 A 83 83 VAL H H 83 7.668 7.723 -0.055 1
1 944 . 13 1 1 A 83 83 VAL HA H 83 3.985 4.483 -0.498 1
1 952 . 13 1 1 A 83 83 VAL C C 83 176.054 175.352 0.702 1
1 953 . 13 1 1 A 83 83 VAL CA C 83 62.431 60.715 1.716 1
1 954 . 13 1 1 A 83 83 VAL CB C 83 32.260 34.501 -2.241 1
1 957 . 13 1 1 A 83 83 VAL N N 83 120.003 119.415 0.588 1
1 958 . 13 1 1 A 84 84 LYS H H 84 8.645 8.536 0.109 1
1 959 . 13 1 1 A 84 84 LYS HA H 84 4.276 3.971 0.305 1
1 968 . 13 1 1 A 84 84 LYS C C 84 176.832 177.479 -0.647 1
1 969 . 13 1 1 A 84 84 LYS CA C 84 56.272 58.245 -1.973 1
1 970 . 13 1 1 A 84 84 LYS CB C 84 32.876 32.991 -0.115 1
1 974 . 13 1 1 A 84 84 LYS N N 84 126.447 124.239 2.208 1
1 975 . 13 1 1 A 85 85 GLY H H 85 8.410 9.040 -0.630 1
1 976 . 13 1 1 A 85 85 GLY HA2 H 85 4.066 3.873 0.193 1
1 977 . 13 1 1 A 85 85 GLY HA3 H 85 3.781 3.886 -0.105 1
1 978 . 13 1 1 A 85 85 GLY C C 85 173.969 174.862 -0.893 1
1 979 . 13 1 1 A 85 85 GLY CA C 85 45.146 46.869 -1.723 1
1 980 . 13 1 1 A 85 85 GLY N N 85 109.957 110.640 -0.683 1
1 981 . 13 1 1 A 86 86 ASN H H 86 8.298 8.598 -0.300 1
1 982 . 13 1 1 A 86 86 ASN HA H 86 4.665 4.966 -0.301 1
1 987 . 13 1 1 A 86 86 ASN C C 86 174.987 175.270 -0.283 1
1 988 . 13 1 1 A 86 86 ASN CA C 86 52.989 52.294 0.695 1
1 989 . 13 1 1 A 86 86 ASN CB C 86 38.376 39.398 -1.022 1
1 990 . 13 1 1 A 86 86 ASN N N 86 118.457 124.191 -5.734 1
1 992 . 13 1 1 A 87 87 VAL H H 87 7.660 8.032 -0.372 1
1 993 . 13 1 1 A 87 87 VAL HA H 87 3.946 3.710 0.236 1
1 1001 . 13 1 1 A 87 87 VAL C C 87 174.902 176.559 -1.657 1
1 1002 . 13 1 1 A 87 87 VAL CA C 87 62.307 62.663 -0.356 1
1 1003 . 13 1 1 A 87 87 VAL CB C 87 32.548 31.920 0.628 1
1 1006 . 13 1 1 A 87 87 VAL N N 87 120.557 118.924 1.633 1
1 1007 . 13 1 1 A 88 88 GLN H H 88 8.115 8.650 -0.535 1
1 1008 . 13 1 1 A 88 88 GLN HA H 88 4.302 4.236 0.066 1
1 1015 . 13 1 1 A 88 88 GLN C C 88 175.637 175.832 -0.195 1
1 1016 . 13 1 1 A 88 88 GLN CA C 88 55.336 56.856 -1.520 1
1 1017 . 13 1 1 A 88 88 GLN CB C 88 30.574 29.862 0.712 1
1 1019 . 13 1 1 A 88 88 GLN N N 88 122.280 120.874 1.406 1
1 1021 . 13 1 1 A 89 89 GLY H H 89 8.544 7.989 0.555 1
1 1022 . 13 1 1 A 89 89 GLY HA2 H 89 3.885 4.022 -0.137 1
1 1023 . 13 1 1 A 89 89 GLY HA3 H 89 3.885 4.030 -0.145 1
1 1024 . 13 1 1 A 89 89 GLY C C 89 172.861 174.541 -1.680 1
1 1025 . 13 1 1 A 89 89 GLY CA C 89 44.889 45.363 -0.474 1
1 1026 . 13 1 1 A 89 89 GLY N N 89 110.135 106.889 3.246 1
1 1027 . 13 1 1 A 90 90 ASN H H 90 8.451 8.039 0.412 1
1 1028 . 13 1 1 A 90 90 ASN HA H 90 4.222 4.995 -0.773 1
1 1033 . 13 1 1 A 90 90 ASN C C 90 174.926 174.735 0.191 1
1 1034 . 13 1 1 A 90 90 ASN CA C 90 54.613 52.208 2.405 1
1 1035 . 13 1 1 A 90 90 ASN CB C 90 37.852 39.384 -1.532 1
1 1036 . 13 1 1 A 90 90 ASN N N 90 114.322 118.733 -4.411 1
1 1038 . 13 1 1 A 91 91 LEU H H 91 8.933 7.594 1.339 1
1 1039 . 13 1 1 A 91 91 LEU HA H 91 5.367 4.673 0.694 1
1 1049 . 13 1 1 A 91 91 LEU C C 91 178.732 175.783 2.949 1
1 1050 . 13 1 1 A 91 91 LEU CA C 91 55.160 54.399 0.761 1
1 1051 . 13 1 1 A 91 91 LEU CB C 91 45.461 42.624 2.837 1
1 1055 . 13 1 1 A 91 91 LEU N N 91 120.057 121.768 -1.711 1
1 1056 . 13 1 1 A 92 92 PHE H H 92 9.901 8.307 1.594 1
1 1057 . 13 1 1 A 92 92 PHE HA H 92 5.105 4.919 0.186 1
1 1065 . 13 1 1 A 92 92 PHE C C 92 170.140 172.539 -2.399 1
1 1066 . 13 1 1 A 92 92 PHE CA C 92 56.236 56.260 -0.024 1
1 1067 . 13 1 1 A 92 92 PHE CB C 92 42.664 41.068 1.596 1
1 1073 . 13 1 1 A 92 92 PHE N N 92 119.740 116.654 3.086 1
1 1074 . 13 1 1 A 93 93 LYS H H 93 9.154 8.384 0.770 1
1 1075 . 13 1 1 A 93 93 LYS HA H 93 5.584 5.004 0.580 1
1 1083 . 13 1 1 A 93 93 LYS C C 93 174.830 175.170 -0.340 1
1 1084 . 13 1 1 A 93 93 LYS CA C 93 53.148 54.315 -1.167 1
1 1085 . 13 1 1 A 93 93 LYS CB C 93 36.660 35.039 1.621 1
1 1089 . 13 1 1 A 93 93 LYS N N 93 117.710 118.794 -1.084 1
1 1090 . 13 1 1 A 94 94 VAL H H 94 8.507 8.600 -0.093 1
1 1091 . 13 1 1 A 94 94 VAL HA H 94 4.872 5.078 -0.206 1
1 1099 . 13 1 1 A 94 94 VAL C C 94 174.408 174.855 -0.447 1
1 1100 . 13 1 1 A 94 94 VAL CA C 94 60.525 61.688 -1.163 1
1 1101 . 13 1 1 A 94 94 VAL CB C 94 34.862 34.408 0.454 1
1 1104 . 13 1 1 A 94 94 VAL N N 94 121.741 120.028 1.713 1
1 1105 . 13 1 1 A 95 95 ILE H H 95 8.959 8.792 0.167 1
1 1106 . 13 1 1 A 95 95 ILE HA H 95 4.794 5.054 -0.260 1
1 1116 . 13 1 1 A 95 95 ILE C C 95 177.642 176.203 1.439 1
1 1117 . 13 1 1 A 95 95 ILE CA C 95 59.713 60.604 -0.891 1
1 1118 . 13 1 1 A 95 95 ILE CB C 95 40.032 37.950 2.082 1
1 1122 . 13 1 1 A 95 95 ILE N N 95 126.794 128.351 -1.557 1
1 1123 . 13 1 1 A 96 96 THR H H 96 8.765 8.744 0.021 1
1 1124 . 13 1 1 A 96 96 THR HA H 96 4.584 4.884 -0.300 1
1 1129 . 13 1 1 A 96 96 THR C C 96 177.023 175.692 1.331 1
1 1130 . 13 1 1 A 96 96 THR CA C 96 61.372 60.480 0.892 1
1 1131 . 13 1 1 A 96 96 THR CB C 96 70.794 71.776 -0.982 1
1 1133 . 13 1 1 A 96 96 THR N N 96 117.225 119.750 -2.525 1
1 1134 . 13 1 1 A 97 97 LYS H H 97 8.736 8.818 -0.082 1
1 1135 . 13 1 1 A 97 97 LYS HA H 97 4.101 3.998 0.103 1
1 1144 . 13 1 1 A 97 97 LYS C C 97 176.490 177.989 -1.499 1
1 1145 . 13 1 1 A 97 97 LYS CA C 97 58.583 59.132 -0.549 1
1 1146 . 13 1 1 A 97 97 LYS CB C 97 31.848 32.485 -0.637 1
1 1150 . 13 1 1 A 97 97 LYS N N 97 120.457 122.681 -2.224 1
1 1151 . 13 1 1 A 98 98 ASP H H 98 7.762 7.606 0.156 1
1 1152 . 13 1 1 A 98 98 ASP HA H 98 4.633 4.805 -0.172 1
1 1155 . 13 1 1 A 98 98 ASP C C 98 175.270 175.202 0.068 1
1 1156 . 13 1 1 A 98 98 ASP CA C 98 53.272 53.901 -0.629 1
1 1157 . 13 1 1 A 98 98 ASP CB C 98 39.909 40.861 -0.952 1
1 1158 . 13 1 1 A 98 98 ASP N N 98 116.281 117.048 -0.767 1
1 1159 . 13 1 1 A 99 99 ASP H H 99 8.340 8.409 -0.069 1
1 1160 . 13 1 1 A 99 99 ASP HA H 99 4.245 4.364 -0.119 1
1 1163 . 13 1 1 A 99 99 ASP C C 99 175.315 174.962 0.353 1
1 1164 . 13 1 1 A 99 99 ASP CA C 99 55.989 55.012 0.977 1
1 1165 . 13 1 1 A 99 99 ASP CB C 99 39.827 38.517 1.310 1
1 1166 . 13 1 1 A 99 99 ASP N N 99 116.687 117.674 -0.987 1
1 1167 . 13 1 1 A 100 100 THR H H 100 7.511 7.324 0.187 1
1 1168 . 13 1 1 A 100 100 THR HA H 100 4.185 4.428 -0.243 1
1 1173 . 13 1 1 A 100 100 THR C C 100 173.376 173.639 -0.263 1
1 1174 . 13 1 1 A 100 100 THR CA C 100 63.489 61.764 1.725 1
1 1175 . 13 1 1 A 100 100 THR CB C 100 67.909 69.384 -1.475 1
1 1177 . 13 1 1 A 100 100 THR N N 100 116.525 114.565 1.960 1
1 1178 . 13 1 1 A 101 101 HIS H H 101 8.753 9.000 -0.247 1
1 1179 . 13 1 1 A 101 101 HIS HA H 101 4.898 4.980 -0.082 1
1 1184 . 13 1 1 A 101 101 HIS C C 101 174.345 174.030 0.315 1
1 1185 . 13 1 1 A 101 101 HIS CA C 101 55.072 54.961 0.111 1
1 1186 . 13 1 1 A 101 101 HIS CB C 101 32.835 29.282 3.553 1
1 1189 . 13 1 1 A 101 101 HIS N N 101 125.953 125.906 0.047 1
1 1190 . 13 1 1 A 102 102 TYR H H 102 9.023 9.365 -0.342 1
1 1191 . 13 1 1 A 102 102 TYR HA H 102 4.545 4.786 -0.241 1
1 1198 . 13 1 1 A 102 102 TYR C C 102 174.126 174.873 -0.747 1
1 1199 . 13 1 1 A 102 102 TYR CA C 102 57.260 56.888 0.372 1
1 1200 . 13 1 1 A 102 102 TYR CB C 102 40.381 37.668 2.713 1
1 1205 . 13 1 1 A 102 102 TYR N N 102 121.975 124.857 -2.882 1
1 1206 . 13 1 1 A 103 103 TYR H H 103 8.899 8.937 -0.038 1
1 1207 . 13 1 1 A 103 103 TYR HA H 103 4.729 4.594 0.135 1
1 1214 . 13 1 1 A 103 103 TYR C C 103 174.139 175.356 -1.217 1
1 1215 . 13 1 1 A 103 103 TYR CA C 103 58.036 58.198 -0.162 1
1 1216 . 13 1 1 A 103 103 TYR CB C 103 40.485 38.238 2.247 1
1 1221 . 13 1 1 A 103 103 TYR N N 103 122.012 124.890 -2.878 1
1 1222 . 13 1 1 A 104 104 ILE H H 104 8.605 9.007 -0.402 1
1 1223 . 13 1 1 A 104 104 ILE HA H 104 4.859 5.030 -0.171 1
1 1233 . 13 1 1 A 104 104 ILE C C 104 172.769 174.081 -1.312 1
1 1234 . 13 1 1 A 104 104 ILE CA C 104 59.554 59.485 0.069 1
1 1235 . 13 1 1 A 104 104 ILE CB C 104 40.631 40.586 0.045 1
1 1239 . 13 1 1 A 104 104 ILE N N 104 123.443 123.876 -0.433 1
1 1240 . 13 1 1 A 105 105 GLN H H 105 9.369 8.582 0.787 1
1 1241 . 13 1 1 A 105 105 GLN HA H 105 4.895 5.104 -0.209 1
1 1248 . 13 1 1 A 105 105 GLN C C 105 175.642 174.902 0.740 1
1 1249 . 13 1 1 A 105 105 GLN CA C 105 54.965 53.851 1.114 1
1 1250 . 13 1 1 A 105 105 GLN CB C 105 32.856 32.150 0.706 1
1 1252 . 13 1 1 A 105 105 GLN N N 105 125.079 123.700 1.379 1
1 1254 . 13 1 1 A 106 106 ALA H H 106 8.513 8.558 -0.045 1
1 1255 . 13 1 1 A 106 106 ALA HA H 106 4.962 4.835 0.127 1
1 1259 . 13 1 1 A 106 106 ALA C C 106 175.854 177.915 -2.061 1
1 1260 . 13 1 1 A 106 106 ALA CA C 106 50.272 50.439 -0.167 1
1 1261 . 13 1 1 A 106 106 ALA CB C 106 21.197 21.376 -0.179 1
1 1262 . 13 1 1 A 106 106 ALA N N 106 129.303 129.180 0.123 1
1 1263 . 13 1 1 A 107 107 SER H H 107 9.468 8.704 0.764 1
1 1264 . 13 1 1 A 107 107 SER HA H 107 4.447 4.303 0.144 1
1 1267 . 13 1 1 A 107 107 SER C C 107 173.785 174.348 -0.563 1
1 1268 . 13 1 1 A 107 107 SER CA C 107 60.048 61.983 -1.935 1
1 1269 . 13 1 1 A 107 107 SER CB C 107 64.643 63.121 1.522 1
1 1270 . 13 1 1 A 107 107 SER N N 107 112.962 116.773 -3.811 1
1 1271 . 13 1 1 A 108 108 SER H H 108 7.555 7.860 -0.305 1
1 1272 . 13 1 1 A 108 108 SER HA H 108 4.665 4.774 -0.109 1
1 1275 . 13 1 1 A 108 108 SER C C 108 174.381 174.362 0.019 1
1 1276 . 13 1 1 A 108 108 SER CA C 108 56.907 56.062 0.845 1
1 1277 . 13 1 1 A 108 108 SER CB C 108 66.370 65.945 0.425 1
1 1278 . 13 1 1 A 108 108 SER N N 108 112.243 112.447 -0.204 1
1 1279 . 13 1 1 A 109 109 LYS H H 109 8.978 8.656 0.322 1
1 1280 . 13 1 1 A 109 109 LYS HA H 109 4.777 3.952 0.825 1
1 1287 . 13 1 1 A 109 109 LYS C C 109 179.992 177.600 2.392 1
1 1288 . 13 1 1 A 109 109 LYS CA C 109 59.766 59.842 -0.076 1
1 1289 . 13 1 1 A 109 109 LYS CB C 109 32.342 32.018 0.324 1
1 1293 . 13 1 1 A 109 109 LYS N N 109 123.170 125.425 -2.255 1
1 1294 . 13 1 1 A 110 110 ALA H H 110 8.608 8.088 0.520 1
1 1295 . 13 1 1 A 110 110 ALA HA H 110 4.178 3.992 0.186 1
1 1299 . 13 1 1 A 110 110 ALA C C 110 179.895 179.344 0.551 1
1 1300 . 13 1 1 A 110 110 ALA CA C 110 54.871 55.454 -0.583 1
1 1301 . 13 1 1 A 110 110 ALA CB C 110 18.065 18.835 -0.770 1
1 1302 . 13 1 1 A 110 110 ALA N N 110 123.750 121.669 2.081 1
1 1303 . 13 1 1 A 111 111 GLU H H 111 8.185 8.232 -0.047 1
1 1304 . 13 1 1 A 111 111 GLU HA H 111 4.180 4.034 0.146 1
1 1309 . 13 1 1 A 111 111 GLU C C 111 178.587 178.727 -0.140 1
1 1310 . 13 1 1 A 111 111 GLU CA C 111 59.466 59.750 -0.284 1
1 1311 . 13 1 1 A 111 111 GLU CB C 111 31.067 29.524 1.543 1
1 1313 . 13 1 1 A 111 111 GLU N N 111 119.757 118.689 1.068 1
1 1314 . 13 1 1 A 112 112 ARG H H 112 8.008 7.891 0.117 1
1 1315 . 13 1 1 A 112 112 ARG HA H 112 3.642 4.092 -0.450 1
1 1322 . 13 1 1 A 112 112 ARG C C 112 176.481 178.164 -1.683 1
1 1323 . 13 1 1 A 112 112 ARG CA C 112 60.419 59.604 0.815 1
1 1324 . 13 1 1 A 112 112 ARG CB C 112 29.957 30.128 -0.171 1
1 1327 . 13 1 1 A 112 112 ARG N N 112 118.430 119.875 -1.445 1
1 1328 . 13 1 1 A 113 113 ALA H H 113 7.985 7.797 0.188 1
1 1329 . 13 1 1 A 113 113 ALA HA H 113 3.925 4.056 -0.131 1
1 1333 . 13 1 1 A 113 113 ALA C C 113 180.117 179.680 0.437 1
1 1334 . 13 1 1 A 113 113 ALA CA C 113 55.372 55.154 0.218 1
1 1335 . 13 1 1 A 113 113 ALA CB C 113 17.825 18.535 -0.710 1
1 1336 . 13 1 1 A 113 113 ALA N N 113 119.980 120.662 -0.682 1
1 1337 . 13 1 1 A 114 114 GLU H H 114 8.093 8.201 -0.108 1
1 1338 . 13 1 1 A 114 114 GLU HA H 114 3.936 3.914 0.022 1
1 1343 . 13 1 1 A 114 114 GLU C C 114 180.586 179.192 1.394 1
1 1344 . 13 1 1 A 114 114 GLU CA C 114 59.148 59.018 0.130 1
1 1345 . 13 1 1 A 114 114 GLU CB C 114 30.080 29.493 0.587 1
1 1347 . 13 1 1 A 114 114 GLU N N 114 117.168 117.816 -0.648 1
1 1348 . 13 1 1 A 115 115 TRP H H 115 7.980 8.791 -0.811 1
1 1349 . 13 1 1 A 115 115 TRP HA H 115 3.775 4.354 -0.579 1
1 1358 . 13 1 1 A 115 115 TRP C C 115 177.714 178.829 -1.115 1
1 1359 . 13 1 1 A 115 115 TRP CA C 115 62.696 59.755 2.941 1
1 1360 . 13 1 1 A 115 115 TRP CB C 115 29.052 28.931 0.121 1
1 1366 . 13 1 1 A 115 115 TRP N N 115 120.974 120.624 0.350 1
1 1368 . 13 1 1 A 116 116 ILE H H 116 8.297 8.231 0.066 1
1 1369 . 13 1 1 A 116 116 ILE HA H 116 3.270 3.703 -0.433 1
1 1379 . 13 1 1 A 116 116 ILE C C 116 177.568 177.934 -0.366 1
1 1380 . 13 1 1 A 116 116 ILE CA C 116 66.643 64.238 2.405 1
1 1381 . 13 1 1 A 116 116 ILE CB C 116 37.606 37.534 0.072 1
1 1385 . 13 1 1 A 116 116 ILE N N 116 118.408 121.181 -2.773 1
1 1386 . 13 1 1 A 117 117 GLU H H 117 8.026 8.868 -0.842 1
1 1387 . 13 1 1 A 117 117 GLU HA H 117 3.880 3.982 -0.102 1
1 1392 . 13 1 1 A 117 117 GLU C C 117 178.476 179.165 -0.689 1
1 1393 . 13 1 1 A 117 117 GLU CA C 117 59.219 59.708 -0.489 1
1 1394 . 13 1 1 A 117 117 GLU CB C 117 29.381 29.365 0.016 1
1 1396 . 13 1 1 A 117 117 GLU N N 117 117.096 120.349 -3.253 1
1 1397 . 13 1 1 A 118 118 ALA H H 118 7.555 8.058 -0.503 1
1 1398 . 13 1 1 A 118 118 ALA HA H 118 3.952 4.052 -0.100 1
1 1402 . 13 1 1 A 118 118 ALA C C 118 179.862 179.958 -0.096 1
1 1403 . 13 1 1 A 118 118 ALA CA C 118 54.772 55.054 -0.282 1
1 1404 . 13 1 1 A 118 118 ALA CB C 118 18.277 18.547 -0.270 1
1 1405 . 13 1 1 A 118 118 ALA N N 118 119.817 121.934 -2.117 1
1 1406 . 13 1 1 A 119 119 ILE H H 119 8.167 7.792 0.375 1
1 1407 . 13 1 1 A 119 119 ILE HA H 119 3.558 3.757 -0.199 1
1 1417 . 13 1 1 A 119 119 ILE C C 119 178.564 178.015 0.549 1
1 1418 . 13 1 1 A 119 119 ILE CA C 119 65.766 65.282 0.484 1
1 1419 . 13 1 1 A 119 119 ILE CB C 119 38.840 37.804 1.036 1
1 1423 . 13 1 1 A 119 119 ILE N N 119 116.280 118.005 -1.725 1
1 1424 . 13 1 1 A 120 120 LYS H H 120 8.790 8.075 0.715 1
1 1425 . 13 1 1 A 120 120 LYS HA H 120 3.965 4.350 -0.385 1
1 1434 . 13 1 1 A 120 120 LYS C C 120 179.673 179.413 0.260 1
1 1435 . 13 1 1 A 120 120 LYS CA C 120 60.031 60.103 -0.072 1
1 1436 . 13 1 1 A 120 120 LYS CB C 120 32.547 32.363 0.184 1
1 1440 . 13 1 1 A 120 120 LYS N N 120 119.650 118.999 0.651 1
1 1441 . 13 1 1 A 121 121 LYS H H 121 7.594 8.122 -0.528 1
1 1442 . 13 1 1 A 121 121 LYS HA H 121 4.095 3.994 0.101 1
1 1451 . 13 1 1 A 121 121 LYS C C 121 177.962 179.236 -1.274 1
1 1452 . 13 1 1 A 121 121 LYS CA C 121 58.848 59.120 -0.272 1
1 1453 . 13 1 1 A 121 121 LYS CB C 121 32.547 32.306 0.241 1
1 1457 . 13 1 1 A 121 121 LYS N N 121 117.197 119.852 -2.655 1
1 1458 . 13 1 1 A 122 122 LEU H H 122 7.586 7.937 -0.351 1
1 1459 . 13 1 1 A 122 122 LEU HA H 122 4.535 3.929 0.606 1
1 1469 . 13 1 1 A 122 122 LEU C C 122 177.902 179.022 -1.120 1
1 1470 . 13 1 1 A 122 122 LEU CA C 122 55.071 57.985 -2.914 1
1 1471 . 13 1 1 A 122 122 LEU CB C 122 42.888 41.949 0.939 1
1 1475 . 13 1 1 A 122 122 LEU N N 122 116.861 119.870 -3.009 1
1 1476 . 13 1 1 A 123 123 THR H H 123 7.636 8.462 -0.826 1
1 1477 . 13 1 1 A 123 123 THR HA H 123 4.445 4.053 0.392 1
1 1482 . 13 1 1 A 123 123 THR C C 123 175.714 176.971 -1.257 1
1 1483 . 13 1 1 A 123 123 THR CA C 123 62.643 65.069 -2.426 1
1 1484 . 13 1 1 A 123 123 THR CB C 123 70.259 68.101 2.158 1
1 1486 . 13 1 1 A 123 123 THR N N 123 108.963 110.943 -1.980 1
1 1487 . 13 1 1 A 124 124 SER H H 124 7.912 8.022 -0.110 1
1 1488 . 13 1 1 A 124 124 SER HA H 124 4.626 4.195 0.431 1
1 1491 . 13 1 1 A 124 124 SER C C 124 174.405 174.847 -0.442 1
1 1492 . 13 1 1 A 124 124 SER CA C 124 58.390 61.400 -3.010 1
1 1493 . 13 1 1 A 124 124 SER CB C 124 64.255 63.640 0.615 1
1 1494 . 13 1 1 A 124 124 SER N N 124 116.876 117.505 -0.629 1
1 1495 . 13 1 1 A 125 125 GLY H H 125 8.307 7.224 1.083 1
1 1496 . 13 1 1 A 125 125 GLY HA2 H 125 4.166 4.029 0.137 1
1 1497 . 13 1 1 A 125 125 GLY HA3 H 125 4.166 4.030 0.136 1
1 1498 . 13 1 1 A 125 125 GLY C C 125 171.921 172.358 -0.437 1
1 1499 . 13 1 1 A 125 125 GLY CA C 125 44.748 44.568 0.180 1
1 1500 . 13 1 1 A 125 125 GLY N N 125 110.006 105.729 4.277 1
1 1501 . 13 1 1 A 126 126 PRO HA H 126 4.510 4.459 0.051 1
1 1508 . 13 1 1 A 126 126 PRO C C 126 177.471 177.198 0.273 1
1 1509 . 13 1 1 A 126 126 PRO CA C 126 63.419 62.538 0.881 1
1 1510 . 13 1 1 A 126 126 PRO CB C 126 32.106 32.505 -0.399 1
1 1513 . 13 1 1 A 127 127 SER H H 127 8.607 8.816 -0.209 1
1 1514 . 13 1 1 A 127 127 SER C C 127 174.628 174.292 0.336 1
1 1515 . 13 1 1 A 127 127 SER CA C 127 58.513 58.770 -0.257 1
1 1516 . 13 1 1 A 127 127 SER CB C 127 63.679 61.582 2.097 1
1 1517 . 13 1 1 A 127 127 SER N N 127 116.390 116.914 -0.524 1
1 1518 . 13 1 1 A 128 128 SER H H 128 8.272 8.201 0.071 1
1 1519 . 13 1 1 A 128 128 SER HA H 128 4.496 4.654 -0.158 1
1 1520 . 13 1 1 A 128 128 SER C C 128 173.921 173.996 -0.075 1
1 1521 . 13 1 1 A 128 128 SER CA C 128 58.442 59.660 -1.218 1
1 1522 . 13 1 1 A 128 128 SER CB C 128 64.173 65.607 -1.434 1
1 1523 . 13 1 1 A 128 128 SER N N 128 117.506 120.550 -3.044 1
1 1 . 14 1 1 A 7 7 GLY HA2 H 7 3.978 4.220 -0.242 1
1 2 . 14 1 1 A 7 7 GLY HA3 H 7 3.978 4.221 -0.243 1
1 3 . 14 1 1 A 7 7 GLY C C 7 174.274 173.856 0.418 1
1 4 . 14 1 1 A 7 7 GLY CA C 7 45.383 44.771 0.612 1
1 5 . 14 1 1 A 8 8 SER H H 8 8.211 8.822 -0.611 1
1 6 . 14 1 1 A 8 8 SER HA H 8 4.425 4.662 -0.237 1
1 9 . 14 1 1 A 8 8 SER C C 8 174.635 174.653 -0.018 1
1 10 . 14 1 1 A 8 8 SER CA C 8 58.425 59.309 -0.884 1
1 11 . 14 1 1 A 8 8 SER CB C 8 63.885 65.779 -1.894 1
1 12 . 14 1 1 A 8 8 SER N N 8 115.732 120.051 -4.319 1
1 13 . 14 1 1 A 9 9 LEU H H 9 8.316 8.096 0.220 1
1 14 . 14 1 1 A 9 9 LEU HA H 9 4.334 3.813 0.521 1
1 24 . 14 1 1 A 9 9 LEU C C 9 177.447 175.387 2.060 1
1 25 . 14 1 1 A 9 9 LEU CA C 9 55.407 55.917 -0.510 1
1 26 . 14 1 1 A 9 9 LEU CB C 9 42.171 40.421 1.750 1
1 30 . 14 1 1 A 9 9 LEU N N 9 123.943 120.507 3.436 1
1 31 . 14 1 1 A 10 10 SER H H 10 8.304 7.541 0.763 1
1 32 . 14 1 1 A 10 10 SER HA H 10 4.424 5.194 -0.770 1
1 35 . 14 1 1 A 10 10 SER C C 10 175.025 172.848 2.177 1
1 36 . 14 1 1 A 10 10 SER CA C 10 58.425 57.249 1.176 1
1 37 . 14 1 1 A 10 10 SER CB C 10 63.638 65.674 -2.036 1
1 38 . 14 1 1 A 10 10 SER N N 10 116.718 110.506 6.212 1
1 39 . 14 1 1 A 11 11 THR H H 11 8.003 8.841 -0.838 1
1 40 . 14 1 1 A 11 11 THR HA H 11 4.196 5.320 -1.124 1
1 45 . 14 1 1 A 11 11 THR C C 11 176.296 173.940 2.356 1
1 46 . 14 1 1 A 11 11 THR CA C 11 62.483 60.728 1.755 1
1 47 . 14 1 1 A 11 11 THR CB C 11 69.266 72.300 -3.034 1
1 49 . 14 1 1 A 11 11 THR N N 11 114.902 119.109 -4.207 1
1 50 . 14 1 1 A 12 12 VAL H H 12 8.095 8.580 -0.485 1
1 51 . 14 1 1 A 12 12 VAL HA H 12 3.826 4.209 -0.383 1
1 59 . 14 1 1 A 12 12 VAL C C 12 178.501 177.000 1.501 1
1 60 . 14 1 1 A 12 12 VAL CA C 12 64.760 63.697 1.063 1
1 61 . 14 1 1 A 12 12 VAL CB C 12 32.013 33.478 -1.465 1
1 64 . 14 1 1 A 12 12 VAL N N 12 122.111 122.591 -0.480 1
1 65 . 14 1 1 A 13 13 GLU H H 13 8.151 8.737 -0.586 1
1 66 . 14 1 1 A 13 13 GLU HA H 13 3.244 3.768 -0.524 1
1 71 . 14 1 1 A 13 13 GLU C C 13 175.702 178.266 -2.564 1
1 72 . 14 1 1 A 13 13 GLU CA C 13 58.354 59.099 -0.745 1
1 73 . 14 1 1 A 13 13 GLU CB C 13 28.843 28.361 0.482 1
1 75 . 14 1 1 A 13 13 GLU N N 13 120.316 122.014 -1.698 1
1 76 . 14 1 1 A 14 14 LEU H H 14 7.067 7.714 -0.647 1
1 77 . 14 1 1 A 14 14 LEU HA H 14 4.157 4.203 -0.046 1
1 87 . 14 1 1 A 14 14 LEU C C 14 176.863 177.732 -0.869 1
1 88 . 14 1 1 A 14 14 LEU CA C 14 53.324 54.907 -1.583 1
1 89 . 14 1 1 A 14 14 LEU CB C 14 41.636 41.362 0.274 1
1 93 . 14 1 1 A 14 14 LEU N N 14 117.035 119.783 -2.748 1
1 94 . 14 1 1 A 15 15 SER H H 15 7.645 7.986 -0.341 1
1 95 . 14 1 1 A 15 15 SER HA H 15 4.305 4.495 -0.190 1
1 98 . 14 1 1 A 15 15 SER C C 15 175.340 175.247 0.093 1
1 99 . 14 1 1 A 15 15 SER CA C 15 59.783 59.093 0.690 1
1 100 . 14 1 1 A 15 15 SER CB C 15 64.625 63.852 0.773 1
1 101 . 14 1 1 A 15 15 SER N N 15 114.216 113.912 0.304 1
1 102 . 14 1 1 A 16 16 GLY H H 16 8.506 7.889 0.617 1
1 103 . 14 1 1 A 16 16 GLY HA2 H 16 4.237 4.088 0.149 1
1 104 . 14 1 1 A 16 16 GLY HA3 H 16 3.927 4.117 -0.190 1
1 105 . 14 1 1 A 16 16 GLY C C 16 173.661 173.174 0.487 1
1 106 . 14 1 1 A 16 16 GLY CA C 16 44.995 45.429 -0.434 1
1 107 . 14 1 1 A 16 16 GLY N N 16 111.838 109.378 2.460 1
1 108 . 14 1 1 A 17 17 THR H H 17 8.482 8.702 -0.220 1
1 109 . 14 1 1 A 17 17 THR HA H 17 4.319 4.368 -0.049 1
1 114 . 14 1 1 A 17 17 THR C C 17 174.758 174.381 0.377 1
1 115 . 14 1 1 A 17 17 THR CA C 17 62.272 63.618 -1.346 1
1 116 . 14 1 1 A 17 17 THR CB C 17 70.706 68.994 1.712 1
1 118 . 14 1 1 A 17 17 THR N N 17 116.679 115.293 1.386 1
1 119 . 14 1 1 A 18 18 VAL H H 18 8.948 8.754 0.194 1
1 120 . 14 1 1 A 18 18 VAL HA H 18 3.950 4.299 -0.349 1
1 128 . 14 1 1 A 18 18 VAL C C 18 176.669 176.901 -0.232 1
1 129 . 14 1 1 A 18 18 VAL CA C 18 64.813 63.610 1.203 1
1 130 . 14 1 1 A 18 18 VAL CB C 18 31.807 31.588 0.219 1
1 133 . 14 1 1 A 18 18 VAL N N 18 127.156 127.457 -0.301 1
1 134 . 14 1 1 A 19 19 VAL H H 19 9.359 8.912 0.447 1
1 135 . 14 1 1 A 19 19 VAL HA H 19 4.234 4.379 -0.145 1
1 143 . 14 1 1 A 19 19 VAL C C 19 175.738 175.813 -0.075 1
1 144 . 14 1 1 A 19 19 VAL CA C 19 62.060 62.120 -0.060 1
1 145 . 14 1 1 A 19 19 VAL CB C 19 33.822 33.444 0.378 1
1 148 . 14 1 1 A 19 19 VAL N N 19 125.162 121.900 3.262 1
1 149 . 14 1 1 A 20 20 LYS H H 20 7.584 7.237 0.347 1
1 150 . 14 1 1 A 20 20 LYS HA H 20 4.346 4.593 -0.247 1
1 159 . 14 1 1 A 20 20 LYS C C 20 172.818 173.919 -1.101 1
1 160 . 14 1 1 A 20 20 LYS CA C 20 56.801 55.565 1.236 1
1 161 . 14 1 1 A 20 20 LYS CB C 20 36.624 35.509 1.115 1
1 165 . 14 1 1 A 20 20 LYS N N 20 121.024 120.958 0.066 1
1 166 . 14 1 1 A 21 21 GLN H H 21 8.625 8.534 0.091 1
1 167 . 14 1 1 A 21 21 GLN HA H 21 6.003 5.400 0.603 1
1 174 . 14 1 1 A 21 21 GLN C C 21 174.914 174.936 -0.022 1
1 175 . 14 1 1 A 21 21 GLN CA C 21 54.207 54.753 -0.546 1
1 176 . 14 1 1 A 21 21 GLN CB C 21 33.452 33.309 0.143 1
1 178 . 14 1 1 A 21 21 GLN N N 21 122.108 124.114 -2.006 1
1 180 . 14 1 1 A 22 22 GLY H H 22 8.964 8.333 0.631 1
1 181 . 14 1 1 A 22 22 GLY HA2 H 22 4.665 4.487 0.178 1
1 182 . 14 1 1 A 22 22 GLY HA3 H 22 4.295 4.632 -0.337 1
1 183 . 14 1 1 A 22 22 GLY C C 22 170.879 171.848 -0.969 1
1 184 . 14 1 1 A 22 22 GLY CA C 22 45.683 45.974 -0.291 1
1 185 . 14 1 1 A 22 22 GLY N N 22 108.508 108.940 -0.432 1
1 186 . 14 1 1 A 23 23 TYR H H 23 9.145 8.787 0.358 1
1 187 . 14 1 1 A 23 23 TYR HA H 23 5.595 5.514 0.081 1
1 194 . 14 1 1 A 23 23 TYR C C 23 175.824 175.326 0.498 1
1 195 . 14 1 1 A 23 23 TYR CA C 23 58.019 56.585 1.434 1
1 196 . 14 1 1 A 23 23 TYR CB C 23 39.251 41.294 -2.043 1
1 201 . 14 1 1 A 23 23 TYR N N 23 120.809 120.281 0.528 1
1 202 . 14 1 1 A 24 24 LEU H H 24 8.935 9.691 -0.756 1
1 203 . 14 1 1 A 24 24 LEU HA H 24 4.716 5.227 -0.511 1
1 213 . 14 1 1 A 24 24 LEU C C 24 174.648 175.948 -1.300 1
1 214 . 14 1 1 A 24 24 LEU CA C 24 53.907 53.365 0.542 1
1 215 . 14 1 1 A 24 24 LEU CB C 24 46.078 45.172 0.906 1
1 219 . 14 1 1 A 24 24 LEU N N 24 122.887 124.575 -1.688 1
1 220 . 14 1 1 A 25 25 ALA H H 25 8.145 8.820 -0.675 1
1 221 . 14 1 1 A 25 25 ALA HA H 25 5.477 5.353 0.124 1
1 225 . 14 1 1 A 25 25 ALA C C 25 175.751 175.285 0.466 1
1 226 . 14 1 1 A 25 25 ALA CA C 25 50.719 50.460 0.259 1
1 227 . 14 1 1 A 25 25 ALA CB C 25 21.074 20.745 0.329 1
1 228 . 14 1 1 A 25 25 ALA N N 25 122.280 123.362 -1.082 1
1 229 . 14 1 1 A 26 26 LYS H H 26 9.167 8.773 0.394 1
1 230 . 14 1 1 A 26 26 LYS HA H 26 5.221 4.705 0.516 1
1 239 . 14 1 1 A 26 26 LYS C C 26 175.421 176.007 -0.586 1
1 240 . 14 1 1 A 26 26 LYS CA C 26 54.383 54.965 -0.582 1
1 241 . 14 1 1 A 26 26 LYS CB C 26 36.125 33.892 2.233 1
1 245 . 14 1 1 A 26 26 LYS N N 26 120.638 125.392 -4.754 1
1 246 . 14 1 1 A 27 27 GLN H H 27 7.866 7.892 -0.026 1
1 247 . 14 1 1 A 27 27 GLN HA H 27 3.525 3.786 -0.261 1
1 254 . 14 1 1 A 27 27 GLN C C 27 177.022 175.354 1.668 1
1 255 . 14 1 1 A 27 27 GLN CA C 27 55.778 55.680 0.098 1
1 256 . 14 1 1 A 27 27 GLN CB C 27 29.864 28.433 1.431 1
1 258 . 14 1 1 A 27 27 GLN N N 27 130.194 127.495 2.699 1
1 260 . 14 1 1 A 28 28 GLY H H 28 8.565 7.764 0.801 1
1 261 . 14 1 1 A 28 28 GLY HA2 H 28 4.125 3.842 0.283 1
1 262 . 14 1 1 A 28 28 GLY HA3 H 28 4.034 3.975 0.059 1
1 263 . 14 1 1 A 28 28 GLY C C 28 174.030 172.924 1.106 1
1 264 . 14 1 1 A 28 28 GLY CA C 28 45.665 44.041 1.624 1
1 265 . 14 1 1 A 28 28 GLY N N 28 115.528 112.272 3.256 1
1 266 . 14 1 1 A 29 29 HIS HA H 29 4.355 4.914 -0.559 1
1 271 . 14 1 1 A 29 29 HIS CA C 29 58.795 54.726 4.069 1
1 272 . 14 1 1 A 29 29 HIS CB C 29 31.283 31.762 -0.479 1
1 275 . 14 1 1 A 30 30 LYS HA H 30 4.096 4.006 0.090 1
1 284 . 14 1 1 A 30 30 LYS CA C 30 57.290 58.541 -1.251 1
1 285 . 14 1 1 A 30 30 LYS CB C 30 31.951 32.160 -0.209 1
1 289 . 14 1 1 A 31 31 ARG HA H 31 3.975 4.573 -0.598 1
1 296 . 14 1 1 A 31 31 ARG CA C 31 55.973 55.236 0.737 1
1 297 . 14 1 1 A 31 31 ARG CB C 31 29.902 31.235 -1.333 1
1 300 . 14 1 1 A 32 32 LYS HA H 32 4.160 4.166 -0.006 1
1 309 . 14 1 1 A 32 32 LYS C C 32 175.678 177.357 -1.679 1
1 310 . 14 1 1 A 32 32 LYS CA C 32 56.254 58.636 -2.382 1
1 311 . 14 1 1 A 32 32 LYS CB C 32 31.602 31.579 0.023 1
1 315 . 14 1 1 A 33 33 ASN H H 33 7.925 8.825 -0.900 1
1 316 . 14 1 1 A 33 33 ASN HA H 33 4.799 4.901 -0.102 1
1 321 . 14 1 1 A 33 33 ASN C C 33 174.005 175.130 -1.125 1
1 322 . 14 1 1 A 33 33 ASN CA C 33 52.407 54.913 -2.506 1
1 323 . 14 1 1 A 33 33 ASN CB C 33 39.879 40.694 -0.815 1
1 324 . 14 1 1 A 33 33 ASN N N 33 116.990 118.693 -1.703 1
1 326 . 14 1 1 A 34 34 TRP H H 34 8.798 7.817 0.981 1
1 327 . 14 1 1 A 34 34 TRP HA H 34 4.755 5.426 -0.671 1
1 336 . 14 1 1 A 34 34 TRP C C 34 176.090 175.101 0.989 1
1 337 . 14 1 1 A 34 34 TRP CA C 34 57.119 55.966 1.153 1
1 338 . 14 1 1 A 34 34 TRP CB C 34 30.596 32.712 -2.116 1
1 344 . 14 1 1 A 34 34 TRP N N 34 121.917 116.372 5.545 1
1 346 . 14 1 1 A 35 35 LYS H H 35 8.404 8.636 -0.232 1
1 347 . 14 1 1 A 35 35 LYS HA H 35 4.846 4.873 -0.027 1
1 354 . 14 1 1 A 35 35 LYS C C 35 176.088 176.010 0.078 1
1 355 . 14 1 1 A 35 35 LYS CA C 35 54.418 54.763 -0.345 1
1 356 . 14 1 1 A 35 35 LYS CB C 35 36.125 35.689 0.436 1
1 360 . 14 1 1 A 35 35 LYS N N 35 120.864 123.524 -2.660 1
1 361 . 14 1 1 A 36 36 VAL H H 36 8.977 8.697 0.280 1
1 362 . 14 1 1 A 36 36 VAL HA H 36 4.274 4.481 -0.207 1
1 370 . 14 1 1 A 36 36 VAL C C 36 176.733 175.987 0.746 1
1 371 . 14 1 1 A 36 36 VAL CA C 36 64.319 63.221 1.098 1
1 372 . 14 1 1 A 36 36 VAL CB C 36 31.602 32.363 -0.761 1
1 375 . 14 1 1 A 36 36 VAL N N 36 124.314 123.960 0.354 1
1 376 . 14 1 1 A 37 37 ARG H H 37 9.498 9.989 -0.491 1
1 377 . 14 1 1 A 37 37 ARG HA H 37 5.053 4.943 0.110 1
1 384 . 14 1 1 A 37 37 ARG C C 37 174.442 174.530 -0.088 1
1 385 . 14 1 1 A 37 37 ARG CA C 37 53.272 54.788 -1.516 1
1 386 . 14 1 1 A 37 37 ARG CB C 37 34.563 34.402 0.161 1
1 389 . 14 1 1 A 37 37 ARG N N 37 128.121 126.198 1.923 1
1 390 . 14 1 1 A 38 38 ARG H H 38 8.755 8.226 0.529 1
1 391 . 14 1 1 A 38 38 ARG HA H 38 4.626 4.171 0.455 1
1 398 . 14 1 1 A 38 38 ARG C C 38 175.514 175.323 0.191 1
1 399 . 14 1 1 A 38 38 ARG CA C 38 55.601 55.926 -0.325 1
1 400 . 14 1 1 A 38 38 ARG CB C 38 32.219 30.440 1.779 1
1 403 . 14 1 1 A 38 38 ARG N N 38 121.442 127.888 -6.446 1
1 404 . 14 1 1 A 39 39 PHE H H 39 9.865 8.797 1.068 1
1 405 . 14 1 1 A 39 39 PHE HA H 39 5.424 5.252 0.172 1
1 413 . 14 1 1 A 39 39 PHE C C 39 175.423 174.740 0.683 1
1 414 . 14 1 1 A 39 39 PHE CA C 39 57.419 57.233 0.186 1
1 415 . 14 1 1 A 39 39 PHE CB C 39 42.623 41.252 1.371 1
1 421 . 14 1 1 A 39 39 PHE N N 39 130.027 126.316 3.711 1
1 422 . 14 1 1 A 40 40 VAL H H 40 9.300 9.413 -0.113 1
1 423 . 14 1 1 A 40 40 VAL HA H 40 4.846 5.222 -0.376 1
1 431 . 14 1 1 A 40 40 VAL C C 40 174.477 173.441 1.036 1
1 432 . 14 1 1 A 40 40 VAL CA C 40 62.343 60.405 1.938 1
1 433 . 14 1 1 A 40 40 VAL CB C 40 35.755 35.518 0.237 1
1 436 . 14 1 1 A 40 40 VAL N N 40 119.369 120.300 -0.931 1
1 437 . 14 1 1 A 41 41 LEU H H 41 9.557 10.224 -0.667 1
1 438 . 14 1 1 A 41 41 LEU HA H 41 5.292 5.501 -0.209 1
1 448 . 14 1 1 A 41 41 LEU C C 41 174.632 175.707 -1.075 1
1 449 . 14 1 1 A 41 41 LEU CA C 41 53.571 53.478 0.093 1
1 450 . 14 1 1 A 41 41 LEU CB C 41 45.337 45.362 -0.025 1
1 454 . 14 1 1 A 41 41 LEU N N 41 132.121 130.159 1.962 1
1 455 . 14 1 1 A 42 42 ARG H H 42 9.396 8.788 0.608 1
1 456 . 14 1 1 A 42 42 ARG HA H 42 5.366 5.446 -0.080 1
1 464 . 14 1 1 A 42 42 ARG C C 42 173.997 174.675 -0.678 1
1 465 . 14 1 1 A 42 42 ARG CA C 42 54.631 54.097 0.534 1
1 466 . 14 1 1 A 42 42 ARG CB C 42 35.550 34.856 0.694 1
1 469 . 14 1 1 A 42 42 ARG N N 42 128.120 122.873 5.247 1
1 471 . 14 1 1 A 43 43 LYS H H 43 8.597 8.808 -0.211 1
1 472 . 14 1 1 A 43 43 LYS HA H 43 4.558 4.894 -0.336 1
1 481 . 14 1 1 A 43 43 LYS C C 43 174.648 175.358 -0.710 1
1 482 . 14 1 1 A 43 43 LYS CA C 43 53.378 54.710 -1.332 1
1 483 . 14 1 1 A 43 43 LYS CB C 43 37.303 36.047 1.256 1
1 487 . 14 1 1 A 43 43 LYS N N 43 114.484 117.470 -2.986 1
1 488 . 14 1 1 A 44 44 ASP H H 44 8.388 9.195 -0.807 1
1 489 . 14 1 1 A 44 44 ASP HA H 44 4.349 4.329 0.020 1
1 492 . 14 1 1 A 44 44 ASP C C 44 173.376 177.030 -3.654 1
1 493 . 14 1 1 A 44 44 ASP CA C 44 54.842 54.878 -0.036 1
1 494 . 14 1 1 A 44 44 ASP CB C 44 39.991 39.348 0.643 1
1 495 . 14 1 1 A 44 44 ASP N N 44 115.453 119.829 -4.376 1
1 496 . 14 1 1 A 45 45 PRO HA H 45 4.652 4.508 0.144 1
1 503 . 14 1 1 A 45 45 PRO C C 45 176.914 176.684 0.230 1
1 504 . 14 1 1 A 45 45 PRO CA C 45 63.490 63.785 -0.295 1
1 505 . 14 1 1 A 45 45 PRO CB C 45 34.892 32.282 2.610 1
1 508 . 14 1 1 A 46 46 ALA H H 46 8.112 8.008 0.104 1
1 509 . 14 1 1 A 46 46 ALA HA H 46 5.455 4.228 1.227 1
1 513 . 14 1 1 A 46 46 ALA C C 46 177.234 176.104 1.130 1
1 514 . 14 1 1 A 46 46 ALA CA C 46 51.560 53.147 -1.587 1
1 515 . 14 1 1 A 46 46 ALA CB C 46 20.122 18.197 1.925 1
1 516 . 14 1 1 A 46 46 ALA N N 46 120.155 120.103 0.052 1
1 517 . 14 1 1 A 47 47 PHE H H 47 8.717 9.485 -0.768 1
1 518 . 14 1 1 A 47 47 PHE HA H 47 4.795 4.990 -0.195 1
1 526 . 14 1 1 A 47 47 PHE C C 47 172.588 174.252 -1.664 1
1 527 . 14 1 1 A 47 47 PHE CA C 47 57.348 56.401 0.947 1
1 528 . 14 1 1 A 47 47 PHE CB C 47 47.123 43.589 3.534 1
1 534 . 14 1 1 A 47 47 PHE N N 47 129.946 119.967 9.979 1
1 535 . 14 1 1 A 48 48 LEU H H 48 7.883 8.311 -0.428 1
1 536 . 14 1 1 A 48 48 LEU HA H 48 5.198 5.496 -0.298 1
1 546 . 14 1 1 A 48 48 LEU C C 48 173.569 174.440 -0.871 1
1 547 . 14 1 1 A 48 48 LEU CA C 48 53.290 53.593 -0.303 1
1 548 . 14 1 1 A 48 48 LEU CB C 48 45.502 44.664 0.838 1
1 552 . 14 1 1 A 48 48 LEU N N 48 121.108 123.091 -1.983 1
1 553 . 14 1 1 A 49 49 HIS H H 49 8.606 9.144 -0.538 1
1 554 . 14 1 1 A 49 49 HIS HA H 49 5.035 5.185 -0.150 1
1 559 . 14 1 1 A 49 49 HIS C C 49 173.993 173.673 0.320 1
1 560 . 14 1 1 A 49 49 HIS CA C 49 56.483 54.159 2.324 1
1 561 . 14 1 1 A 49 49 HIS CB C 49 35.919 33.766 2.153 1
1 564 . 14 1 1 A 49 49 HIS N N 49 121.199 125.265 -4.066 1
1 565 . 14 1 1 A 50 50 TYR H H 50 7.777 8.329 -0.552 1
1 566 . 14 1 1 A 50 50 TYR HA H 50 5.695 5.625 0.070 1
1 573 . 14 1 1 A 50 50 TYR C C 50 174.284 172.543 1.741 1
1 574 . 14 1 1 A 50 50 TYR CA C 50 53.430 54.864 -1.434 1
1 575 . 14 1 1 A 50 50 TYR CB C 50 38.552 40.864 -2.312 1
1 580 . 14 1 1 A 50 50 TYR N N 50 114.156 117.943 -3.787 1
1 581 . 14 1 1 A 51 51 TYR H H 51 9.323 8.590 0.733 1
1 582 . 14 1 1 A 51 51 TYR HA H 51 4.600 4.878 -0.278 1
1 589 . 14 1 1 A 51 51 TYR C C 51 175.352 174.029 1.323 1
1 590 . 14 1 1 A 51 51 TYR CA C 51 57.330 56.426 0.904 1
1 591 . 14 1 1 A 51 51 TYR CB C 51 41.683 42.706 -1.023 1
1 596 . 14 1 1 A 51 51 TYR N N 51 119.100 117.658 1.442 1
1 597 . 14 1 1 A 52 52 ASP H H 52 9.375 8.713 0.662 1
1 598 . 14 1 1 A 52 52 ASP HA H 52 5.064 4.976 0.088 1
1 601 . 14 1 1 A 52 52 ASP C C 52 175.484 175.347 0.137 1
1 602 . 14 1 1 A 52 52 ASP CA C 52 51.313 50.893 0.420 1
1 603 . 14 1 1 A 52 52 ASP CB C 52 41.883 42.107 -0.224 1
1 604 . 14 1 1 A 52 52 ASP N N 52 124.636 123.933 0.703 1
1 605 . 14 1 1 A 53 53 PRO HA H 53 4.678 4.630 0.048 1
1 612 . 14 1 1 A 53 53 PRO C C 53 176.781 177.711 -0.930 1
1 613 . 14 1 1 A 53 53 PRO CA C 53 64.054 63.885 0.169 1
1 614 . 14 1 1 A 53 53 PRO CB C 53 32.589 32.132 0.457 1
1 617 . 14 1 1 A 54 54 SER H H 54 8.685 8.997 -0.312 1
1 618 . 14 1 1 A 54 54 SER HA H 54 4.483 4.634 -0.151 1
1 621 . 14 1 1 A 54 54 SER C C 54 174.006 173.908 0.098 1
1 622 . 14 1 1 A 54 54 SER CA C 54 59.378 59.271 0.107 1
1 623 . 14 1 1 A 54 54 SER CB C 54 64.132 64.028 0.104 1
1 624 . 14 1 1 A 54 54 SER N N 54 113.769 113.260 0.509 1
1 625 . 14 1 1 A 55 55 LYS H H 55 7.706 7.263 0.443 1
1 626 . 14 1 1 A 55 55 LYS HA H 55 4.580 4.850 -0.270 1
1 635 . 14 1 1 A 55 55 LYS C C 55 175.969 175.615 0.354 1
1 636 . 14 1 1 A 55 55 LYS CA C 55 55.160 54.457 0.703 1
1 637 . 14 1 1 A 55 55 LYS CB C 55 34.069 36.013 -1.944 1
1 641 . 14 1 1 A 55 55 LYS N N 55 122.222 119.230 2.992 1
1 642 . 14 1 1 A 56 56 GLU H H 56 8.666 8.710 -0.044 1
1 643 . 14 1 1 A 56 56 GLU HA H 56 4.174 4.530 -0.356 1
1 648 . 14 1 1 A 56 56 GLU C C 56 177.084 175.977 1.107 1
1 649 . 14 1 1 A 56 56 GLU CA C 56 57.099 57.098 0.001 1
1 650 . 14 1 1 A 56 56 GLU CB C 56 29.694 30.824 -1.130 1
1 652 . 14 1 1 A 56 56 GLU N N 56 122.015 118.693 3.322 1
1 653 . 14 1 1 A 57 57 GLU H H 57 8.303 8.401 -0.098 1
1 654 . 14 1 1 A 57 57 GLU HA H 57 4.214 4.397 -0.183 1
1 659 . 14 1 1 A 57 57 GLU CA C 57 56.960 56.857 0.103 1
1 660 . 14 1 1 A 57 57 GLU CB C 57 30.264 28.973 1.291 1
1 662 . 14 1 1 A 57 57 GLU N N 57 119.884 120.174 -0.290 1
1 663 . 14 1 1 A 58 58 ASN HA H 58 4.768 4.966 -0.198 1
1 668 . 14 1 1 A 58 58 ASN C C 58 174.902 173.312 1.590 1
1 669 . 14 1 1 A 58 58 ASN CA C 58 52.740 52.686 0.054 1
1 670 . 14 1 1 A 58 58 ASN CB C 58 38.116 36.532 1.584 1
1 672 . 14 1 1 A 59 59 ARG H H 59 7.805 8.034 -0.229 1
1 673 . 14 1 1 A 59 59 ARG HA H 59 4.762 4.670 0.092 1
1 680 . 14 1 1 A 59 59 ARG CA C 59 53.151 54.718 -1.567 1
1 681 . 14 1 1 A 59 59 ARG CB C 59 31.519 34.010 -2.491 1
1 684 . 14 1 1 A 59 59 ARG N N 59 121.060 120.684 0.376 1
1 685 . 14 1 1 A 60 60 PRO HA H 60 3.357 3.933 -0.576 1
1 692 . 14 1 1 A 60 60 PRO C C 60 176.817 176.461 0.356 1
1 693 . 14 1 1 A 60 60 PRO CA C 60 63.031 61.828 1.203 1
1 694 . 14 1 1 A 60 60 PRO CB C 60 31.273 31.840 -0.567 1
1 697 . 14 1 1 A 61 61 VAL H H 61 8.627 7.708 0.919 1
1 698 . 14 1 1 A 61 61 VAL HA H 61 3.966 3.707 0.259 1
1 706 . 14 1 1 A 61 61 VAL C C 61 176.503 175.971 0.532 1
1 707 . 14 1 1 A 61 61 VAL CA C 61 63.154 64.707 -1.553 1
1 708 . 14 1 1 A 61 61 VAL CB C 61 32.048 31.987 0.061 1
1 711 . 14 1 1 A 61 61 VAL N N 61 119.185 120.121 -0.936 1
1 712 . 14 1 1 A 62 62 GLY H H 62 6.715 6.491 0.224 1
1 713 . 14 1 1 A 62 62 GLY HA2 H 62 3.940 3.906 0.034 1
1 714 . 14 1 1 A 62 62 GLY HA3 H 62 3.538 3.960 -0.422 1
1 715 . 14 1 1 A 62 62 GLY C C 62 169.983 171.603 -1.620 1
1 716 . 14 1 1 A 62 62 GLY CA C 62 44.465 45.673 -1.208 1
1 717 . 14 1 1 A 62 62 GLY N N 62 105.813 105.526 0.287 1
1 718 . 14 1 1 A 63 63 GLY H H 63 8.004 8.625 -0.621 1
1 719 . 14 1 1 A 63 63 GLY HA2 H 63 4.095 3.373 0.722 1
1 720 . 14 1 1 A 63 63 GLY HA3 H 63 3.813 4.002 -0.189 1
1 721 . 14 1 1 A 63 63 GLY C C 63 171.870 171.856 0.014 1
1 722 . 14 1 1 A 63 63 GLY CA C 63 47.148 45.080 2.068 1
1 723 . 14 1 1 A 63 63 GLY N N 63 105.089 108.015 -2.926 1
1 724 . 14 1 1 A 64 64 PHE H H 64 7.967 7.916 0.051 1
1 725 . 14 1 1 A 64 64 PHE HA H 64 4.934 5.562 -0.628 1
1 733 . 14 1 1 A 64 64 PHE C C 64 173.140 173.786 -0.646 1
1 734 . 14 1 1 A 64 64 PHE CA C 64 55.248 55.609 -0.361 1
1 735 . 14 1 1 A 64 64 PHE CB C 64 40.238 42.132 -1.894 1
1 741 . 14 1 1 A 64 64 PHE N N 64 113.387 118.082 -4.695 1
1 742 . 14 1 1 A 65 65 SER H H 65 8.518 9.043 -0.525 1
1 743 . 14 1 1 A 65 65 SER HA H 65 3.264 4.243 -0.979 1
1 746 . 14 1 1 A 65 65 SER C C 65 176.417 174.162 2.255 1
1 747 . 14 1 1 A 65 65 SER CA C 65 56.819 57.610 -0.791 1
1 748 . 14 1 1 A 65 65 SER CB C 65 63.391 64.883 -1.492 1
1 749 . 14 1 1 A 65 65 SER N N 65 114.674 115.634 -0.960 1
1 750 . 14 1 1 A 66 66 LEU H H 66 7.404 8.098 -0.694 1
1 751 . 14 1 1 A 66 66 LEU HA H 66 4.470 4.354 0.116 1
1 761 . 14 1 1 A 66 66 LEU C C 66 177.993 178.185 -0.192 1
1 762 . 14 1 1 A 66 66 LEU CA C 66 54.242 55.825 -1.583 1
1 763 . 14 1 1 A 66 66 LEU CB C 66 42.787 42.867 -0.080 1
1 767 . 14 1 1 A 66 66 LEU N N 66 123.988 120.936 3.052 1
1 768 . 14 1 1 A 67 67 ARG H H 67 7.865 7.887 -0.022 1
1 769 . 14 1 1 A 67 67 ARG HA H 67 4.175 3.914 0.261 1
1 776 . 14 1 1 A 67 67 ARG C C 67 178.562 178.057 0.505 1
1 777 . 14 1 1 A 67 67 ARG CA C 67 58.143 59.475 -1.332 1
1 778 . 14 1 1 A 67 67 ARG CB C 67 29.052 30.185 -1.133 1
1 781 . 14 1 1 A 67 67 ARG N N 67 122.494 117.702 4.792 1
1 782 . 14 1 1 A 68 68 GLY H H 68 9.398 8.130 1.268 1
1 783 . 14 1 1 A 68 68 GLY HA2 H 68 4.066 3.915 0.151 1
1 784 . 14 1 1 A 68 68 GLY HA3 H 68 3.908 3.918 -0.010 1
1 785 . 14 1 1 A 68 68 GLY C C 68 173.982 173.522 0.460 1
1 786 . 14 1 1 A 68 68 GLY CA C 68 46.230 46.545 -0.315 1
1 787 . 14 1 1 A 68 68 GLY N N 68 117.548 107.421 10.127 1
1 788 . 14 1 1 A 69 69 SER H H 69 7.829 7.589 0.240 1
1 789 . 14 1 1 A 69 69 SER HA H 69 4.807 5.209 -0.402 1
1 792 . 14 1 1 A 69 69 SER C C 69 172.854 172.522 0.332 1
1 793 . 14 1 1 A 69 69 SER CA C 69 59.290 57.279 2.011 1
1 794 . 14 1 1 A 69 69 SER CB C 69 65.366 67.922 -2.556 1
1 795 . 14 1 1 A 69 69 SER N N 69 115.188 114.553 0.635 1
1 796 . 14 1 1 A 70 70 LEU H H 70 8.805 8.692 0.113 1
1 797 . 14 1 1 A 70 70 LEU HA H 70 4.846 4.940 -0.094 1
1 807 . 14 1 1 A 70 70 LEU C C 70 175.775 174.538 1.237 1
1 808 . 14 1 1 A 70 70 LEU CA C 70 53.907 53.766 0.141 1
1 809 . 14 1 1 A 70 70 LEU CB C 70 45.337 44.428 0.909 1
1 813 . 14 1 1 A 70 70 LEU N N 70 121.265 122.412 -1.147 1
1 814 . 14 1 1 A 71 71 VAL H H 71 8.644 8.652 -0.008 1
1 815 . 14 1 1 A 71 71 VAL HA H 71 5.555 5.157 0.398 1
1 823 . 14 1 1 A 71 71 VAL C C 71 173.636 173.306 0.330 1
1 824 . 14 1 1 A 71 71 VAL CA C 71 58.760 60.260 -1.500 1
1 825 . 14 1 1 A 71 71 VAL CB C 71 34.891 35.500 -0.609 1
1 828 . 14 1 1 A 71 71 VAL N N 71 122.315 120.640 1.675 1
1 829 . 14 1 1 A 72 72 SER H H 72 8.750 8.902 -0.152 1
1 830 . 14 1 1 A 72 72 SER HA H 72 4.742 5.009 -0.267 1
1 833 . 14 1 1 A 72 72 SER C C 72 173.058 172.807 0.251 1
1 834 . 14 1 1 A 72 72 SER CA C 72 57.190 57.808 -0.618 1
1 835 . 14 1 1 A 72 72 SER CB C 72 65.612 67.533 -1.921 1
1 836 . 14 1 1 A 72 72 SER N N 72 118.611 121.738 -3.127 1
1 837 . 14 1 1 A 73 73 ALA H H 73 9.009 8.473 0.536 1
1 838 . 14 1 1 A 73 73 ALA HA H 73 4.406 4.778 -0.372 1
1 842 . 14 1 1 A 73 73 ALA C C 73 176.708 177.213 -0.505 1
1 843 . 14 1 1 A 73 73 ALA CA C 73 52.672 51.440 1.232 1
1 844 . 14 1 1 A 73 73 ALA CB C 73 18.812 20.380 -1.568 1
1 845 . 14 1 1 A 73 73 ALA N N 73 125.694 125.153 0.541 1
1 846 . 14 1 1 A 74 74 LEU H H 74 7.800 8.095 -0.295 1
1 847 . 14 1 1 A 74 74 LEU HA H 74 4.716 4.818 -0.102 1
1 857 . 14 1 1 A 74 74 LEU C C 74 176.551 176.607 -0.056 1
1 858 . 14 1 1 A 74 74 LEU CA C 74 53.784 53.328 0.456 1
1 859 . 14 1 1 A 74 74 LEU CB C 74 43.446 44.658 -1.212 1
1 863 . 14 1 1 A 74 74 LEU N N 74 122.271 120.185 2.086 1
1 864 . 14 1 1 A 75 75 GLU H H 75 8.855 8.941 -0.086 1
1 865 . 14 1 1 A 75 75 GLU HA H 75 4.336 3.992 0.344 1
1 870 . 14 1 1 A 75 75 GLU C C 75 176.465 176.160 0.305 1
1 871 . 14 1 1 A 75 75 GLU CA C 75 56.507 57.233 -0.726 1
1 872 . 14 1 1 A 75 75 GLU CB C 75 30.245 28.229 2.016 1
1 874 . 14 1 1 A 75 75 GLU N N 75 122.678 122.084 0.594 1
1 875 . 14 1 1 A 76 76 ASP H H 76 8.542 8.085 0.457 1
1 876 . 14 1 1 A 76 76 ASP HA H 76 4.665 4.771 -0.106 1
1 879 . 14 1 1 A 76 76 ASP C C 76 176.087 175.594 0.493 1
1 880 . 14 1 1 A 76 76 ASP CA C 76 55.107 52.512 2.595 1
1 881 . 14 1 1 A 76 76 ASP CB C 76 41.431 39.761 1.670 1
1 882 . 14 1 1 A 76 76 ASP N N 76 121.488 121.149 0.339 1
1 883 . 14 1 1 A 77 77 ASN H H 77 8.322 8.987 -0.665 1
1 884 . 14 1 1 A 77 77 ASN HA H 77 4.729 4.445 0.284 1
1 889 . 14 1 1 A 77 77 ASN C C 77 175.566 175.316 0.250 1
1 890 . 14 1 1 A 77 77 ASN CA C 77 53.131 54.434 -1.303 1
1 891 . 14 1 1 A 77 77 ASN CB C 77 38.617 37.157 1.460 1
1 892 . 14 1 1 A 77 77 ASN N N 77 118.676 123.920 -5.244 1
1 894 . 14 1 1 A 78 78 GLY H H 78 8.311 8.517 -0.206 1
1 895 . 14 1 1 A 78 78 GLY HA2 H 78 3.897 4.013 -0.116 1
1 896 . 14 1 1 A 78 78 GLY HA3 H 78 3.897 4.016 -0.119 1
1 897 . 14 1 1 A 78 78 GLY C C 78 173.376 174.260 -0.884 1
1 898 . 14 1 1 A 78 78 GLY CA C 78 45.224 44.680 0.544 1
1 899 . 14 1 1 A 78 78 GLY N N 78 108.939 104.015 4.924 1
1 900 . 14 1 1 A 79 79 VAL H H 79 7.882 8.268 -0.386 1
1 901 . 14 1 1 A 79 79 VAL HA H 79 4.345 3.966 0.379 1
1 909 . 14 1 1 A 79 79 VAL CA C 79 59.995 63.129 -3.134 1
1 910 . 14 1 1 A 79 79 VAL CB C 79 32.589 30.807 1.782 1
1 913 . 14 1 1 A 79 79 VAL N N 79 121.135 120.208 0.927 1
1 914 . 14 1 1 A 80 80 PRO HA H 80 4.461 4.577 -0.116 1
1 921 . 14 1 1 A 80 80 PRO C C 80 176.979 175.636 1.343 1
1 922 . 14 1 1 A 80 80 PRO CA C 80 63.101 62.290 0.811 1
1 923 . 14 1 1 A 80 80 PRO CB C 80 32.177 33.175 -0.998 1
1 926 . 14 1 1 A 81 81 THR H H 81 8.281 8.358 -0.077 1
1 927 . 14 1 1 A 81 81 THR HA H 81 4.095 4.144 -0.049 1
1 932 . 14 1 1 A 81 81 THR C C 81 175.270 175.531 -0.261 1
1 933 . 14 1 1 A 81 81 THR CA C 81 62.872 63.684 -0.812 1
1 934 . 14 1 1 A 81 81 THR CB C 81 69.642 68.454 1.188 1
1 936 . 14 1 1 A 81 81 THR N N 81 114.684 115.056 -0.372 1
1 937 . 14 1 1 A 82 82 GLY H H 82 8.338 9.043 -0.705 1
1 938 . 14 1 1 A 82 82 GLY HA2 H 82 4.095 3.809 0.286 1
1 939 . 14 1 1 A 82 82 GLY HA3 H 82 3.668 3.829 -0.161 1
1 940 . 14 1 1 A 82 82 GLY C C 82 174.139 174.102 0.037 1
1 941 . 14 1 1 A 82 82 GLY CA C 82 45.083 47.058 -1.975 1
1 942 . 14 1 1 A 82 82 GLY N N 82 111.289 115.103 -3.814 1
1 943 . 14 1 1 A 83 83 VAL H H 83 7.668 7.835 -0.167 1
1 944 . 14 1 1 A 83 83 VAL HA H 83 3.985 4.350 -0.365 1
1 952 . 14 1 1 A 83 83 VAL C C 83 176.054 175.484 0.570 1
1 953 . 14 1 1 A 83 83 VAL CA C 83 62.431 60.813 1.618 1
1 954 . 14 1 1 A 83 83 VAL CB C 83 32.260 35.375 -3.115 1
1 957 . 14 1 1 A 83 83 VAL N N 83 120.003 120.267 -0.264 1
1 958 . 14 1 1 A 84 84 LYS H H 84 8.645 8.556 0.089 1
1 959 . 14 1 1 A 84 84 LYS HA H 84 4.276 3.776 0.500 1
1 968 . 14 1 1 A 84 84 LYS C C 84 176.832 177.660 -0.828 1
1 969 . 14 1 1 A 84 84 LYS CA C 84 56.272 58.720 -2.448 1
1 970 . 14 1 1 A 84 84 LYS CB C 84 32.876 32.118 0.758 1
1 974 . 14 1 1 A 84 84 LYS N N 84 126.447 125.361 1.086 1
1 975 . 14 1 1 A 85 85 GLY H H 85 8.410 8.915 -0.505 1
1 976 . 14 1 1 A 85 85 GLY HA2 H 85 4.066 3.836 0.230 1
1 977 . 14 1 1 A 85 85 GLY HA3 H 85 3.781 3.854 -0.073 1
1 978 . 14 1 1 A 85 85 GLY C C 85 173.969 173.865 0.104 1
1 979 . 14 1 1 A 85 85 GLY CA C 85 45.146 47.481 -2.335 1
1 980 . 14 1 1 A 85 85 GLY N N 85 109.957 111.342 -1.385 1
1 981 . 14 1 1 A 86 86 ASN H H 86 8.298 8.352 -0.054 1
1 982 . 14 1 1 A 86 86 ASN HA H 86 4.665 5.272 -0.607 1
1 987 . 14 1 1 A 86 86 ASN C C 86 174.987 173.430 1.557 1
1 988 . 14 1 1 A 86 86 ASN CA C 86 52.989 52.606 0.383 1
1 989 . 14 1 1 A 86 86 ASN CB C 86 38.376 39.639 -1.263 1
1 990 . 14 1 1 A 86 86 ASN N N 86 118.457 120.148 -1.691 1
1 992 . 14 1 1 A 87 87 VAL H H 87 7.660 8.681 -1.021 1
1 993 . 14 1 1 A 87 87 VAL HA H 87 3.946 4.152 -0.206 1
1 1001 . 14 1 1 A 87 87 VAL C C 87 174.902 175.083 -0.181 1
1 1002 . 14 1 1 A 87 87 VAL CA C 87 62.307 62.012 0.295 1
1 1003 . 14 1 1 A 87 87 VAL CB C 87 32.548 32.391 0.157 1
1 1006 . 14 1 1 A 87 87 VAL N N 87 120.557 125.628 -5.071 1
1 1007 . 14 1 1 A 88 88 GLN H H 88 8.115 8.644 -0.529 1
1 1008 . 14 1 1 A 88 88 GLN HA H 88 4.302 4.893 -0.591 1
1 1015 . 14 1 1 A 88 88 GLN C C 88 175.637 174.308 1.329 1
1 1016 . 14 1 1 A 88 88 GLN CA C 88 55.336 54.050 1.286 1
1 1017 . 14 1 1 A 88 88 GLN CB C 88 30.574 31.763 -1.189 1
1 1019 . 14 1 1 A 88 88 GLN N N 88 122.280 122.156 0.124 1
1 1021 . 14 1 1 A 89 89 GLY H H 89 8.544 8.403 0.141 1
1 1022 . 14 1 1 A 89 89 GLY HA2 H 89 3.885 4.060 -0.175 1
1 1023 . 14 1 1 A 89 89 GLY HA3 H 89 3.885 4.085 -0.200 1
1 1024 . 14 1 1 A 89 89 GLY C C 89 172.861 173.691 -0.830 1
1 1025 . 14 1 1 A 89 89 GLY CA C 89 44.889 44.020 0.869 1
1 1026 . 14 1 1 A 89 89 GLY N N 89 110.135 107.321 2.814 1
1 1027 . 14 1 1 A 90 90 ASN H H 90 8.451 8.459 -0.008 1
1 1028 . 14 1 1 A 90 90 ASN HA H 90 4.222 5.081 -0.859 1
1 1033 . 14 1 1 A 90 90 ASN C C 90 174.926 175.125 -0.199 1
1 1034 . 14 1 1 A 90 90 ASN CA C 90 54.613 52.461 2.152 1
1 1035 . 14 1 1 A 90 90 ASN CB C 90 37.852 37.410 0.442 1
1 1036 . 14 1 1 A 90 90 ASN N N 90 114.322 120.209 -5.887 1
1 1038 . 14 1 1 A 91 91 LEU H H 91 8.933 8.591 0.342 1
1 1039 . 14 1 1 A 91 91 LEU HA H 91 5.367 5.131 0.236 1
1 1049 . 14 1 1 A 91 91 LEU C C 91 178.732 175.767 2.965 1
1 1050 . 14 1 1 A 91 91 LEU CA C 91 55.160 53.175 1.985 1
1 1051 . 14 1 1 A 91 91 LEU CB C 91 45.461 45.150 0.311 1
1 1055 . 14 1 1 A 91 91 LEU N N 91 120.057 125.275 -5.218 1
1 1056 . 14 1 1 A 92 92 PHE H H 92 9.901 8.330 1.571 1
1 1057 . 14 1 1 A 92 92 PHE HA H 92 5.105 5.136 -0.031 1
1 1065 . 14 1 1 A 92 92 PHE C C 92 170.140 172.965 -2.825 1
1 1066 . 14 1 1 A 92 92 PHE CA C 92 56.236 56.801 -0.565 1
1 1067 . 14 1 1 A 92 92 PHE CB C 92 42.664 40.311 2.353 1
1 1073 . 14 1 1 A 92 92 PHE N N 92 119.740 117.055 2.685 1
1 1074 . 14 1 1 A 93 93 LYS H H 93 9.154 9.110 0.044 1
1 1075 . 14 1 1 A 93 93 LYS HA H 93 5.584 5.396 0.188 1
1 1083 . 14 1 1 A 93 93 LYS C C 93 174.830 175.307 -0.477 1
1 1084 . 14 1 1 A 93 93 LYS CA C 93 53.148 54.125 -0.977 1
1 1085 . 14 1 1 A 93 93 LYS CB C 93 36.660 36.363 0.297 1
1 1089 . 14 1 1 A 93 93 LYS N N 93 117.710 118.705 -0.995 1
1 1090 . 14 1 1 A 94 94 VAL H H 94 8.507 8.648 -0.141 1
1 1091 . 14 1 1 A 94 94 VAL HA H 94 4.872 5.065 -0.193 1
1 1099 . 14 1 1 A 94 94 VAL C C 94 174.408 174.912 -0.504 1
1 1100 . 14 1 1 A 94 94 VAL CA C 94 60.525 61.541 -1.016 1
1 1101 . 14 1 1 A 94 94 VAL CB C 94 34.862 34.315 0.547 1
1 1104 . 14 1 1 A 94 94 VAL N N 94 121.741 120.337 1.404 1
1 1105 . 14 1 1 A 95 95 ILE H H 95 8.959 8.969 -0.010 1
1 1106 . 14 1 1 A 95 95 ILE HA H 95 4.794 4.984 -0.190 1
1 1116 . 14 1 1 A 95 95 ILE C C 95 177.642 176.227 1.415 1
1 1117 . 14 1 1 A 95 95 ILE CA C 95 59.713 60.434 -0.721 1
1 1118 . 14 1 1 A 95 95 ILE CB C 95 40.032 37.871 2.161 1
1 1122 . 14 1 1 A 95 95 ILE N N 95 126.794 128.385 -1.591 1
1 1123 . 14 1 1 A 96 96 THR H H 96 8.765 8.721 0.044 1
1 1124 . 14 1 1 A 96 96 THR HA H 96 4.584 4.850 -0.266 1
1 1129 . 14 1 1 A 96 96 THR C C 96 177.023 176.348 0.675 1
1 1130 . 14 1 1 A 96 96 THR CA C 96 61.372 60.594 0.778 1
1 1131 . 14 1 1 A 96 96 THR CB C 96 70.794 71.780 -0.986 1
1 1133 . 14 1 1 A 96 96 THR N N 96 117.225 119.965 -2.740 1
1 1134 . 14 1 1 A 97 97 LYS H H 97 8.736 8.561 0.175 1
1 1135 . 14 1 1 A 97 97 LYS HA H 97 4.101 4.070 0.031 1
1 1144 . 14 1 1 A 97 97 LYS C C 97 176.490 176.811 -0.321 1
1 1145 . 14 1 1 A 97 97 LYS CA C 97 58.583 58.628 -0.045 1
1 1146 . 14 1 1 A 97 97 LYS CB C 97 31.848 32.208 -0.360 1
1 1150 . 14 1 1 A 97 97 LYS N N 97 120.457 119.663 0.794 1
1 1151 . 14 1 1 A 98 98 ASP H H 98 7.762 7.971 -0.209 1
1 1152 . 14 1 1 A 98 98 ASP HA H 98 4.633 4.773 -0.140 1
1 1155 . 14 1 1 A 98 98 ASP C C 98 175.270 175.158 0.112 1
1 1156 . 14 1 1 A 98 98 ASP CA C 98 53.272 53.879 -0.607 1
1 1157 . 14 1 1 A 98 98 ASP CB C 98 39.909 40.943 -1.034 1
1 1158 . 14 1 1 A 98 98 ASP N N 98 116.281 118.248 -1.967 1
1 1159 . 14 1 1 A 99 99 ASP H H 99 8.340 8.730 -0.390 1
1 1160 . 14 1 1 A 99 99 ASP HA H 99 4.245 4.262 -0.017 1
1 1163 . 14 1 1 A 99 99 ASP C C 99 175.315 174.791 0.524 1
1 1164 . 14 1 1 A 99 99 ASP CA C 99 55.989 55.542 0.447 1
1 1165 . 14 1 1 A 99 99 ASP CB C 99 39.827 40.256 -0.429 1
1 1166 . 14 1 1 A 99 99 ASP N N 99 116.687 118.161 -1.474 1
1 1167 . 14 1 1 A 100 100 THR H H 100 7.511 7.518 -0.007 1
1 1168 . 14 1 1 A 100 100 THR HA H 100 4.185 4.068 0.117 1
1 1173 . 14 1 1 A 100 100 THR C C 100 173.376 174.018 -0.642 1
1 1174 . 14 1 1 A 100 100 THR CA C 100 63.489 62.764 0.725 1
1 1175 . 14 1 1 A 100 100 THR CB C 100 67.909 68.813 -0.904 1
1 1177 . 14 1 1 A 100 100 THR N N 100 116.525 114.534 1.991 1
1 1178 . 14 1 1 A 101 101 HIS H H 101 8.753 8.653 0.100 1
1 1179 . 14 1 1 A 101 101 HIS HA H 101 4.898 4.836 0.062 1
1 1184 . 14 1 1 A 101 101 HIS C C 101 174.345 173.572 0.773 1
1 1185 . 14 1 1 A 101 101 HIS CA C 101 55.072 54.143 0.929 1
1 1186 . 14 1 1 A 101 101 HIS CB C 101 32.835 29.795 3.040 1
1 1189 . 14 1 1 A 101 101 HIS N N 101 125.953 126.141 -0.188 1
1 1190 . 14 1 1 A 102 102 TYR H H 102 9.023 8.729 0.294 1
1 1191 . 14 1 1 A 102 102 TYR HA H 102 4.545 4.598 -0.053 1
1 1198 . 14 1 1 A 102 102 TYR C C 102 174.126 174.649 -0.523 1
1 1199 . 14 1 1 A 102 102 TYR CA C 102 57.260 56.482 0.778 1
1 1200 . 14 1 1 A 102 102 TYR CB C 102 40.381 37.839 2.542 1
1 1205 . 14 1 1 A 102 102 TYR N N 102 121.975 124.308 -2.333 1
1 1206 . 14 1 1 A 103 103 TYR H H 103 8.899 8.586 0.313 1
1 1207 . 14 1 1 A 103 103 TYR HA H 103 4.729 4.730 -0.001 1
1 1214 . 14 1 1 A 103 103 TYR C C 103 174.139 175.722 -1.583 1
1 1215 . 14 1 1 A 103 103 TYR CA C 103 58.036 58.227 -0.191 1
1 1216 . 14 1 1 A 103 103 TYR CB C 103 40.485 38.599 1.886 1
1 1221 . 14 1 1 A 103 103 TYR N N 103 122.012 124.596 -2.584 1
1 1222 . 14 1 1 A 104 104 ILE H H 104 8.605 8.784 -0.179 1
1 1223 . 14 1 1 A 104 104 ILE HA H 104 4.859 5.154 -0.295 1
1 1233 . 14 1 1 A 104 104 ILE C C 104 172.769 174.141 -1.372 1
1 1234 . 14 1 1 A 104 104 ILE CA C 104 59.554 59.645 -0.091 1
1 1235 . 14 1 1 A 104 104 ILE CB C 104 40.631 41.620 -0.989 1
1 1239 . 14 1 1 A 104 104 ILE N N 104 123.443 124.051 -0.608 1
1 1240 . 14 1 1 A 105 105 GLN H H 105 9.369 8.648 0.721 1
1 1241 . 14 1 1 A 105 105 GLN HA H 105 4.895 5.059 -0.164 1
1 1248 . 14 1 1 A 105 105 GLN C C 105 175.642 175.391 0.251 1
1 1249 . 14 1 1 A 105 105 GLN CA C 105 54.965 53.873 1.092 1
1 1250 . 14 1 1 A 105 105 GLN CB C 105 32.856 32.297 0.559 1
1 1252 . 14 1 1 A 105 105 GLN N N 105 125.079 123.720 1.359 1
1 1254 . 14 1 1 A 106 106 ALA H H 106 8.513 8.095 0.418 1
1 1255 . 14 1 1 A 106 106 ALA HA H 106 4.962 4.890 0.072 1
1 1259 . 14 1 1 A 106 106 ALA C C 106 175.854 178.059 -2.205 1
1 1260 . 14 1 1 A 106 106 ALA CA C 106 50.272 50.651 -0.379 1
1 1261 . 14 1 1 A 106 106 ALA CB C 106 21.197 21.488 -0.291 1
1 1262 . 14 1 1 A 106 106 ALA N N 106 129.303 128.578 0.725 1
1 1263 . 14 1 1 A 107 107 SER H H 107 9.468 9.083 0.385 1
1 1264 . 14 1 1 A 107 107 SER HA H 107 4.447 4.295 0.152 1
1 1267 . 14 1 1 A 107 107 SER C C 107 173.785 173.605 0.180 1
1 1268 . 14 1 1 A 107 107 SER CA C 107 60.048 61.465 -1.417 1
1 1269 . 14 1 1 A 107 107 SER CB C 107 64.643 63.394 1.249 1
1 1270 . 14 1 1 A 107 107 SER N N 107 112.962 116.419 -3.457 1
1 1271 . 14 1 1 A 108 108 SER H H 108 7.555 7.981 -0.426 1
1 1272 . 14 1 1 A 108 108 SER HA H 108 4.665 4.944 -0.279 1
1 1275 . 14 1 1 A 108 108 SER C C 108 174.381 173.752 0.629 1
1 1276 . 14 1 1 A 108 108 SER CA C 108 56.907 56.000 0.907 1
1 1277 . 14 1 1 A 108 108 SER CB C 108 66.370 66.358 0.012 1
1 1278 . 14 1 1 A 108 108 SER N N 108 112.243 114.233 -1.990 1
1 1279 . 14 1 1 A 109 109 LYS H H 109 8.978 9.180 -0.202 1
1 1280 . 14 1 1 A 109 109 LYS HA H 109 4.777 4.031 0.746 1
1 1287 . 14 1 1 A 109 109 LYS C C 109 179.992 179.123 0.869 1
1 1288 . 14 1 1 A 109 109 LYS CA C 109 59.766 59.716 0.050 1
1 1289 . 14 1 1 A 109 109 LYS CB C 109 32.342 32.226 0.116 1
1 1293 . 14 1 1 A 109 109 LYS N N 109 123.170 124.404 -1.234 1
1 1294 . 14 1 1 A 110 110 ALA H H 110 8.608 8.097 0.511 1
1 1295 . 14 1 1 A 110 110 ALA HA H 110 4.178 4.015 0.163 1
1 1299 . 14 1 1 A 110 110 ALA C C 110 179.895 179.123 0.772 1
1 1300 . 14 1 1 A 110 110 ALA CA C 110 54.871 55.473 -0.602 1
1 1301 . 14 1 1 A 110 110 ALA CB C 110 18.065 18.428 -0.363 1
1 1302 . 14 1 1 A 110 110 ALA N N 110 123.750 122.175 1.575 1
1 1303 . 14 1 1 A 111 111 GLU H H 111 8.185 8.267 -0.082 1
1 1304 . 14 1 1 A 111 111 GLU HA H 111 4.180 4.030 0.150 1
1 1309 . 14 1 1 A 111 111 GLU C C 111 178.587 178.913 -0.326 1
1 1310 . 14 1 1 A 111 111 GLU CA C 111 59.466 59.830 -0.364 1
1 1311 . 14 1 1 A 111 111 GLU CB C 111 31.067 29.370 1.697 1
1 1313 . 14 1 1 A 111 111 GLU N N 111 119.757 118.567 1.190 1
1 1314 . 14 1 1 A 112 112 ARG H H 112 8.008 7.924 0.084 1
1 1315 . 14 1 1 A 112 112 ARG HA H 112 3.642 4.175 -0.533 1
1 1322 . 14 1 1 A 112 112 ARG C C 112 176.481 178.463 -1.982 1
1 1323 . 14 1 1 A 112 112 ARG CA C 112 60.419 59.752 0.667 1
1 1324 . 14 1 1 A 112 112 ARG CB C 112 29.957 30.189 -0.232 1
1 1327 . 14 1 1 A 112 112 ARG N N 112 118.430 119.868 -1.438 1
1 1328 . 14 1 1 A 113 113 ALA H H 113 7.985 7.787 0.198 1
1 1329 . 14 1 1 A 113 113 ALA HA H 113 3.925 4.045 -0.120 1
1 1333 . 14 1 1 A 113 113 ALA C C 113 180.117 180.048 0.069 1
1 1334 . 14 1 1 A 113 113 ALA CA C 113 55.372 55.026 0.346 1
1 1335 . 14 1 1 A 113 113 ALA CB C 113 17.825 18.441 -0.616 1
1 1336 . 14 1 1 A 113 113 ALA N N 113 119.980 120.582 -0.602 1
1 1337 . 14 1 1 A 114 114 GLU H H 114 8.093 8.264 -0.171 1
1 1338 . 14 1 1 A 114 114 GLU HA H 114 3.936 3.945 -0.009 1
1 1343 . 14 1 1 A 114 114 GLU C C 114 180.586 179.257 1.329 1
1 1344 . 14 1 1 A 114 114 GLU CA C 114 59.148 59.136 0.012 1
1 1345 . 14 1 1 A 114 114 GLU CB C 114 30.080 29.563 0.517 1
1 1347 . 14 1 1 A 114 114 GLU N N 114 117.168 118.089 -0.921 1
1 1348 . 14 1 1 A 115 115 TRP H H 115 7.980 9.003 -1.023 1
1 1349 . 14 1 1 A 115 115 TRP HA H 115 3.775 4.357 -0.582 1
1 1358 . 14 1 1 A 115 115 TRP C C 115 177.714 178.769 -1.055 1
1 1359 . 14 1 1 A 115 115 TRP CA C 115 62.696 59.920 2.776 1
1 1360 . 14 1 1 A 115 115 TRP CB C 115 29.052 28.993 0.059 1
1 1366 . 14 1 1 A 115 115 TRP N N 115 120.974 120.677 0.297 1
1 1368 . 14 1 1 A 116 116 ILE H H 116 8.297 8.308 -0.011 1
1 1369 . 14 1 1 A 116 116 ILE HA H 116 3.270 3.585 -0.315 1
1 1379 . 14 1 1 A 116 116 ILE C C 116 177.568 177.845 -0.277 1
1 1380 . 14 1 1 A 116 116 ILE CA C 116 66.643 64.214 2.429 1
1 1381 . 14 1 1 A 116 116 ILE CB C 116 37.606 37.407 0.199 1
1 1385 . 14 1 1 A 116 116 ILE N N 116 118.408 120.596 -2.188 1
1 1386 . 14 1 1 A 117 117 GLU H H 117 8.026 8.767 -0.741 1
1 1387 . 14 1 1 A 117 117 GLU HA H 117 3.880 3.963 -0.083 1
1 1392 . 14 1 1 A 117 117 GLU C C 117 178.476 178.904 -0.428 1
1 1393 . 14 1 1 A 117 117 GLU CA C 117 59.219 59.656 -0.437 1
1 1394 . 14 1 1 A 117 117 GLU CB C 117 29.381 29.370 0.011 1
1 1396 . 14 1 1 A 117 117 GLU N N 117 117.096 120.238 -3.142 1
1 1397 . 14 1 1 A 118 118 ALA H H 118 7.555 8.010 -0.455 1
1 1398 . 14 1 1 A 118 118 ALA HA H 118 3.952 4.024 -0.072 1
1 1402 . 14 1 1 A 118 118 ALA C C 118 179.862 179.766 0.096 1
1 1403 . 14 1 1 A 118 118 ALA CA C 118 54.772 55.136 -0.364 1
1 1404 . 14 1 1 A 118 118 ALA CB C 118 18.277 18.374 -0.097 1
1 1405 . 14 1 1 A 118 118 ALA N N 118 119.817 121.755 -1.938 1
1 1406 . 14 1 1 A 119 119 ILE H H 119 8.167 7.932 0.235 1
1 1407 . 14 1 1 A 119 119 ILE HA H 119 3.558 3.666 -0.108 1
1 1417 . 14 1 1 A 119 119 ILE C C 119 178.564 178.250 0.314 1
1 1418 . 14 1 1 A 119 119 ILE CA C 119 65.766 65.129 0.637 1
1 1419 . 14 1 1 A 119 119 ILE CB C 119 38.840 37.908 0.932 1
1 1423 . 14 1 1 A 119 119 ILE N N 119 116.280 117.712 -1.432 1
1 1424 . 14 1 1 A 120 120 LYS H H 120 8.790 8.421 0.369 1
1 1425 . 14 1 1 A 120 120 LYS HA H 120 3.965 4.100 -0.135 1
1 1434 . 14 1 1 A 120 120 LYS C C 120 179.673 179.169 0.504 1
1 1435 . 14 1 1 A 120 120 LYS CA C 120 60.031 60.379 -0.348 1
1 1436 . 14 1 1 A 120 120 LYS CB C 120 32.547 32.159 0.388 1
1 1440 . 14 1 1 A 120 120 LYS N N 120 119.650 119.058 0.592 1
1 1441 . 14 1 1 A 121 121 LYS H H 121 7.594 7.948 -0.354 1
1 1442 . 14 1 1 A 121 121 LYS HA H 121 4.095 3.954 0.141 1
1 1451 . 14 1 1 A 121 121 LYS C C 121 177.962 179.004 -1.042 1
1 1452 . 14 1 1 A 121 121 LYS CA C 121 58.848 59.163 -0.315 1
1 1453 . 14 1 1 A 121 121 LYS CB C 121 32.547 32.237 0.310 1
1 1457 . 14 1 1 A 121 121 LYS N N 121 117.197 119.652 -2.455 1
1 1458 . 14 1 1 A 122 122 LEU H H 122 7.586 7.745 -0.159 1
1 1459 . 14 1 1 A 122 122 LEU HA H 122 4.535 3.951 0.584 1
1 1469 . 14 1 1 A 122 122 LEU C C 122 177.902 177.375 0.527 1
1 1470 . 14 1 1 A 122 122 LEU CA C 122 55.071 57.984 -2.913 1
1 1471 . 14 1 1 A 122 122 LEU CB C 122 42.888 41.837 1.051 1
1 1475 . 14 1 1 A 122 122 LEU N N 122 116.861 119.847 -2.986 1
1 1476 . 14 1 1 A 123 123 THR H H 123 7.636 7.935 -0.299 1
1 1477 . 14 1 1 A 123 123 THR HA H 123 4.445 4.350 0.095 1
1 1482 . 14 1 1 A 123 123 THR C C 123 175.714 174.344 1.370 1
1 1483 . 14 1 1 A 123 123 THR CA C 123 62.643 61.167 1.476 1
1 1484 . 14 1 1 A 123 123 THR CB C 123 70.259 70.802 -0.543 1
1 1486 . 14 1 1 A 123 123 THR N N 123 108.963 111.846 -2.883 1
1 1487 . 14 1 1 A 124 124 SER H H 124 7.912 8.581 -0.669 1
1 1488 . 14 1 1 A 124 124 SER HA H 124 4.626 4.043 0.583 1
1 1491 . 14 1 1 A 124 124 SER C C 124 174.405 175.027 -0.622 1
1 1492 . 14 1 1 A 124 124 SER CA C 124 58.390 60.598 -2.208 1
1 1493 . 14 1 1 A 124 124 SER CB C 124 64.255 62.633 1.622 1
1 1494 . 14 1 1 A 124 124 SER N N 124 116.876 118.553 -1.677 1
1 1495 . 14 1 1 A 125 125 GLY H H 125 8.307 8.713 -0.406 1
1 1496 . 14 1 1 A 125 125 GLY HA2 H 125 4.166 4.185 -0.019 1
1 1497 . 14 1 1 A 125 125 GLY HA3 H 125 4.166 4.186 -0.020 1
1 1498 . 14 1 1 A 125 125 GLY C C 125 171.921 174.516 -2.595 1
1 1499 . 14 1 1 A 125 125 GLY CA C 125 44.748 45.166 -0.418 1
1 1500 . 14 1 1 A 125 125 GLY N N 125 110.006 113.808 -3.802 1
1 1501 . 14 1 1 A 126 126 PRO HA H 126 4.510 4.292 0.218 1
1 1508 . 14 1 1 A 126 126 PRO C C 126 177.471 177.515 -0.044 1
1 1509 . 14 1 1 A 126 126 PRO CA C 126 63.419 64.817 -1.398 1
1 1510 . 14 1 1 A 126 126 PRO CB C 126 32.106 31.804 0.302 1
1 1513 . 14 1 1 A 127 127 SER H H 127 8.607 8.072 0.535 1
1 1514 . 14 1 1 A 127 127 SER C C 127 174.628 174.340 0.288 1
1 1515 . 14 1 1 A 127 127 SER CA C 127 58.513 59.042 -0.529 1
1 1516 . 14 1 1 A 127 127 SER CB C 127 63.679 61.596 2.083 1
1 1517 . 14 1 1 A 127 127 SER N N 127 116.390 114.035 2.355 1
1 1518 . 14 1 1 A 128 128 SER H H 128 8.272 8.390 -0.118 1
1 1519 . 14 1 1 A 128 128 SER HA H 128 4.496 4.708 -0.212 1
1 1520 . 14 1 1 A 128 128 SER C C 128 173.921 175.619 -1.698 1
1 1521 . 14 1 1 A 128 128 SER CA C 128 58.442 59.052 -0.610 1
1 1522 . 14 1 1 A 128 128 SER CB C 128 64.173 65.699 -1.526 1
1 1523 . 14 1 1 A 128 128 SER N N 128 117.506 120.491 -2.985 1
1 1 . 15 1 1 A 7 7 GLY HA2 H 7 3.978 4.157 -0.179 1
1 2 . 15 1 1 A 7 7 GLY HA3 H 7 3.978 4.159 -0.181 1
1 3 . 15 1 1 A 7 7 GLY C C 7 174.274 171.495 2.779 1
1 4 . 15 1 1 A 7 7 GLY CA C 7 45.383 45.864 -0.481 1
1 5 . 15 1 1 A 8 8 SER H H 8 8.211 8.630 -0.419 1
1 6 . 15 1 1 A 8 8 SER HA H 8 4.425 5.166 -0.741 1
1 9 . 15 1 1 A 8 8 SER C C 8 174.635 173.424 1.211 1
1 10 . 15 1 1 A 8 8 SER CA C 8 58.425 57.855 0.570 1
1 11 . 15 1 1 A 8 8 SER CB C 8 63.885 64.150 -0.265 1
1 12 . 15 1 1 A 8 8 SER N N 8 115.732 120.501 -4.769 1
1 13 . 15 1 1 A 9 9 LEU H H 9 8.316 8.391 -0.075 1
1 14 . 15 1 1 A 9 9 LEU HA H 9 4.334 4.586 -0.252 1
1 24 . 15 1 1 A 9 9 LEU C C 9 177.447 175.076 2.371 1
1 25 . 15 1 1 A 9 9 LEU CA C 9 55.407 54.488 0.919 1
1 26 . 15 1 1 A 9 9 LEU CB C 9 42.171 45.489 -3.318 1
1 30 . 15 1 1 A 9 9 LEU N N 9 123.943 127.333 -3.390 1
1 31 . 15 1 1 A 10 10 SER H H 10 8.304 8.836 -0.532 1
1 32 . 15 1 1 A 10 10 SER HA H 10 4.424 4.401 0.023 1
1 35 . 15 1 1 A 10 10 SER C C 10 175.025 174.323 0.702 1
1 36 . 15 1 1 A 10 10 SER CA C 10 58.425 58.260 0.165 1
1 37 . 15 1 1 A 10 10 SER CB C 10 63.638 64.290 -0.652 1
1 38 . 15 1 1 A 10 10 SER N N 10 116.718 120.311 -3.593 1
1 39 . 15 1 1 A 11 11 THR H H 11 8.003 8.667 -0.664 1
1 40 . 15 1 1 A 11 11 THR HA H 11 4.196 4.400 -0.204 1
1 45 . 15 1 1 A 11 11 THR C C 11 176.296 174.109 2.187 1
1 46 . 15 1 1 A 11 11 THR CA C 11 62.483 62.751 -0.268 1
1 47 . 15 1 1 A 11 11 THR CB C 11 69.266 69.578 -0.312 1
1 49 . 15 1 1 A 11 11 THR N N 11 114.902 118.129 -3.227 1
1 50 . 15 1 1 A 12 12 VAL H H 12 8.095 8.531 -0.436 1
1 51 . 15 1 1 A 12 12 VAL HA H 12 3.826 4.148 -0.322 1
1 59 . 15 1 1 A 12 12 VAL C C 12 178.501 176.594 1.907 1
1 60 . 15 1 1 A 12 12 VAL CA C 12 64.760 63.358 1.402 1
1 61 . 15 1 1 A 12 12 VAL CB C 12 32.013 32.623 -0.610 1
1 64 . 15 1 1 A 12 12 VAL N N 12 122.111 120.650 1.461 1
1 65 . 15 1 1 A 13 13 GLU H H 13 8.151 8.823 -0.672 1
1 66 . 15 1 1 A 13 13 GLU HA H 13 3.244 3.424 -0.180 1
1 71 . 15 1 1 A 13 13 GLU C C 13 175.702 178.098 -2.396 1
1 72 . 15 1 1 A 13 13 GLU CA C 13 58.354 58.907 -0.553 1
1 73 . 15 1 1 A 13 13 GLU CB C 13 28.843 28.584 0.259 1
1 75 . 15 1 1 A 13 13 GLU N N 13 120.316 122.786 -2.470 1
1 76 . 15 1 1 A 14 14 LEU H H 14 7.067 7.578 -0.511 1
1 77 . 15 1 1 A 14 14 LEU HA H 14 4.157 4.167 -0.010 1
1 87 . 15 1 1 A 14 14 LEU C C 14 176.863 177.292 -0.429 1
1 88 . 15 1 1 A 14 14 LEU CA C 14 53.324 54.929 -1.605 1
1 89 . 15 1 1 A 14 14 LEU CB C 14 41.636 41.451 0.185 1
1 93 . 15 1 1 A 14 14 LEU N N 14 117.035 119.554 -2.519 1
1 94 . 15 1 1 A 15 15 SER H H 15 7.645 7.712 -0.067 1
1 95 . 15 1 1 A 15 15 SER HA H 15 4.305 4.558 -0.253 1
1 98 . 15 1 1 A 15 15 SER C C 15 175.340 173.052 2.288 1
1 99 . 15 1 1 A 15 15 SER CA C 15 59.783 57.226 2.557 1
1 100 . 15 1 1 A 15 15 SER CB C 15 64.625 62.038 2.587 1
1 101 . 15 1 1 A 15 15 SER N N 15 114.216 115.319 -1.103 1
1 102 . 15 1 1 A 16 16 GLY H H 16 8.506 8.362 0.144 1
1 103 . 15 1 1 A 16 16 GLY HA2 H 16 4.237 4.334 -0.097 1
1 104 . 15 1 1 A 16 16 GLY HA3 H 16 3.927 4.359 -0.432 1
1 105 . 15 1 1 A 16 16 GLY C C 16 173.661 172.083 1.578 1
1 106 . 15 1 1 A 16 16 GLY CA C 16 44.995 44.011 0.984 1
1 107 . 15 1 1 A 16 16 GLY N N 16 111.838 112.115 -0.277 1
1 108 . 15 1 1 A 17 17 THR H H 17 8.482 8.963 -0.481 1
1 109 . 15 1 1 A 17 17 THR HA H 17 4.319 4.337 -0.018 1
1 114 . 15 1 1 A 17 17 THR C C 17 174.758 174.412 0.346 1
1 115 . 15 1 1 A 17 17 THR CA C 17 62.272 63.706 -1.434 1
1 116 . 15 1 1 A 17 17 THR CB C 17 70.706 69.008 1.698 1
1 118 . 15 1 1 A 17 17 THR N N 17 116.679 115.430 1.249 1
1 119 . 15 1 1 A 18 18 VAL H H 18 8.948 8.769 0.179 1
1 120 . 15 1 1 A 18 18 VAL HA H 18 3.950 4.352 -0.402 1
1 128 . 15 1 1 A 18 18 VAL C C 18 176.669 176.864 -0.195 1
1 129 . 15 1 1 A 18 18 VAL CA C 18 64.813 63.604 1.209 1
1 130 . 15 1 1 A 18 18 VAL CB C 18 31.807 31.636 0.171 1
1 133 . 15 1 1 A 18 18 VAL N N 18 127.156 127.677 -0.521 1
1 134 . 15 1 1 A 19 19 VAL H H 19 9.359 9.247 0.112 1
1 135 . 15 1 1 A 19 19 VAL HA H 19 4.234 4.387 -0.153 1
1 143 . 15 1 1 A 19 19 VAL C C 19 175.738 175.816 -0.078 1
1 144 . 15 1 1 A 19 19 VAL CA C 19 62.060 62.166 -0.106 1
1 145 . 15 1 1 A 19 19 VAL CB C 19 33.822 33.463 0.359 1
1 148 . 15 1 1 A 19 19 VAL N N 19 125.162 121.407 3.755 1
1 149 . 15 1 1 A 20 20 LYS H H 20 7.584 7.331 0.253 1
1 150 . 15 1 1 A 20 20 LYS HA H 20 4.346 4.642 -0.296 1
1 159 . 15 1 1 A 20 20 LYS C C 20 172.818 174.069 -1.251 1
1 160 . 15 1 1 A 20 20 LYS CA C 20 56.801 55.540 1.261 1
1 161 . 15 1 1 A 20 20 LYS CB C 20 36.624 35.336 1.288 1
1 165 . 15 1 1 A 20 20 LYS N N 20 121.024 121.125 -0.101 1
1 166 . 15 1 1 A 21 21 GLN H H 21 8.625 8.548 0.077 1
1 167 . 15 1 1 A 21 21 GLN HA H 21 6.003 5.400 0.603 1
1 174 . 15 1 1 A 21 21 GLN C C 21 174.914 174.933 -0.019 1
1 175 . 15 1 1 A 21 21 GLN CA C 21 54.207 54.658 -0.451 1
1 176 . 15 1 1 A 21 21 GLN CB C 21 33.452 33.289 0.163 1
1 178 . 15 1 1 A 21 21 GLN N N 21 122.108 124.122 -2.014 1
1 180 . 15 1 1 A 22 22 GLY H H 22 8.964 8.361 0.603 1
1 181 . 15 1 1 A 22 22 GLY HA2 H 22 4.665 4.412 0.253 1
1 182 . 15 1 1 A 22 22 GLY HA3 H 22 4.295 4.587 -0.292 1
1 183 . 15 1 1 A 22 22 GLY C C 22 170.879 171.501 -0.622 1
1 184 . 15 1 1 A 22 22 GLY CA C 22 45.683 45.859 -0.176 1
1 185 . 15 1 1 A 22 22 GLY N N 22 108.508 109.031 -0.523 1
1 186 . 15 1 1 A 23 23 TYR H H 23 9.145 8.693 0.452 1
1 187 . 15 1 1 A 23 23 TYR HA H 23 5.595 5.651 -0.056 1
1 194 . 15 1 1 A 23 23 TYR C C 23 175.824 175.553 0.271 1
1 195 . 15 1 1 A 23 23 TYR CA C 23 58.019 56.755 1.264 1
1 196 . 15 1 1 A 23 23 TYR CB C 23 39.251 40.598 -1.347 1
1 201 . 15 1 1 A 23 23 TYR N N 23 120.809 119.674 1.135 1
1 202 . 15 1 1 A 24 24 LEU H H 24 8.935 9.758 -0.823 1
1 203 . 15 1 1 A 24 24 LEU HA H 24 4.716 5.034 -0.318 1
1 213 . 15 1 1 A 24 24 LEU C C 24 174.648 175.681 -1.033 1
1 214 . 15 1 1 A 24 24 LEU CA C 24 53.907 53.291 0.616 1
1 215 . 15 1 1 A 24 24 LEU CB C 24 46.078 45.707 0.371 1
1 219 . 15 1 1 A 24 24 LEU N N 24 122.887 124.636 -1.749 1
1 220 . 15 1 1 A 25 25 ALA H H 25 8.145 8.691 -0.546 1
1 221 . 15 1 1 A 25 25 ALA HA H 25 5.477 5.712 -0.235 1
1 225 . 15 1 1 A 25 25 ALA C C 25 175.751 175.633 0.118 1
1 226 . 15 1 1 A 25 25 ALA CA C 25 50.719 50.219 0.500 1
1 227 . 15 1 1 A 25 25 ALA CB C 25 21.074 22.625 -1.551 1
1 228 . 15 1 1 A 25 25 ALA N N 25 122.280 123.359 -1.079 1
1 229 . 15 1 1 A 26 26 LYS H H 26 9.167 8.937 0.230 1
1 230 . 15 1 1 A 26 26 LYS HA H 26 5.221 4.899 0.322 1
1 239 . 15 1 1 A 26 26 LYS C C 26 175.421 175.685 -0.264 1
1 240 . 15 1 1 A 26 26 LYS CA C 26 54.383 54.967 -0.584 1
1 241 . 15 1 1 A 26 26 LYS CB C 26 36.125 34.980 1.145 1
1 245 . 15 1 1 A 26 26 LYS N N 26 120.638 122.406 -1.768 1
1 246 . 15 1 1 A 27 27 GLN H H 27 7.866 7.962 -0.096 1
1 247 . 15 1 1 A 27 27 GLN HA H 27 3.525 3.824 -0.299 1
1 254 . 15 1 1 A 27 27 GLN C C 27 177.022 175.527 1.495 1
1 255 . 15 1 1 A 27 27 GLN CA C 27 55.778 56.216 -0.438 1
1 256 . 15 1 1 A 27 27 GLN CB C 27 29.864 28.128 1.736 1
1 258 . 15 1 1 A 27 27 GLN N N 27 130.194 127.181 3.013 1
1 260 . 15 1 1 A 28 28 GLY H H 28 8.565 8.377 0.188 1
1 261 . 15 1 1 A 28 28 GLY HA2 H 28 4.125 3.905 0.220 1
1 262 . 15 1 1 A 28 28 GLY HA3 H 28 4.034 4.000 0.034 1
1 263 . 15 1 1 A 28 28 GLY C C 28 174.030 174.306 -0.276 1
1 264 . 15 1 1 A 28 28 GLY CA C 28 45.665 45.922 -0.257 1
1 265 . 15 1 1 A 28 28 GLY N N 28 115.528 112.998 2.530 1
1 266 . 15 1 1 A 29 29 HIS HA H 29 4.355 4.479 -0.124 1
1 271 . 15 1 1 A 29 29 HIS CA C 29 58.795 56.835 1.960 1
1 272 . 15 1 1 A 29 29 HIS CB C 29 31.283 30.638 0.645 1
1 275 . 15 1 1 A 30 30 LYS HA H 30 4.096 4.555 -0.459 1
1 284 . 15 1 1 A 30 30 LYS CA C 30 57.290 55.510 1.780 1
1 285 . 15 1 1 A 30 30 LYS CB C 30 31.951 32.486 -0.535 1
1 289 . 15 1 1 A 31 31 ARG HA H 31 3.975 4.554 -0.579 1
1 296 . 15 1 1 A 31 31 ARG CA C 31 55.973 55.542 0.431 1
1 297 . 15 1 1 A 31 31 ARG CB C 31 29.902 33.474 -3.572 1
1 300 . 15 1 1 A 32 32 LYS HA H 32 4.160 4.044 0.116 1
1 309 . 15 1 1 A 32 32 LYS C C 32 175.678 175.601 0.077 1
1 310 . 15 1 1 A 32 32 LYS CA C 32 56.254 58.303 -2.049 1
1 311 . 15 1 1 A 32 32 LYS CB C 32 31.602 31.146 0.456 1
1 315 . 15 1 1 A 33 33 ASN H H 33 7.925 8.625 -0.700 1
1 316 . 15 1 1 A 33 33 ASN HA H 33 4.799 4.761 0.038 1
1 321 . 15 1 1 A 33 33 ASN C C 33 174.005 175.632 -1.627 1
1 322 . 15 1 1 A 33 33 ASN CA C 33 52.407 53.805 -1.398 1
1 323 . 15 1 1 A 33 33 ASN CB C 33 39.879 39.377 0.502 1
1 324 . 15 1 1 A 33 33 ASN N N 33 116.990 118.680 -1.690 1
1 326 . 15 1 1 A 34 34 TRP H H 34 8.798 8.193 0.605 1
1 327 . 15 1 1 A 34 34 TRP HA H 34 4.755 4.963 -0.208 1
1 336 . 15 1 1 A 34 34 TRP C C 34 176.090 176.189 -0.099 1
1 337 . 15 1 1 A 34 34 TRP CA C 34 57.119 56.394 0.725 1
1 338 . 15 1 1 A 34 34 TRP CB C 34 30.596 31.177 -0.581 1
1 344 . 15 1 1 A 34 34 TRP N N 34 121.917 121.536 0.381 1
1 346 . 15 1 1 A 35 35 LYS H H 35 8.404 8.801 -0.397 1
1 347 . 15 1 1 A 35 35 LYS HA H 35 4.846 4.856 -0.010 1
1 354 . 15 1 1 A 35 35 LYS C C 35 176.088 176.419 -0.331 1
1 355 . 15 1 1 A 35 35 LYS CA C 35 54.418 55.298 -0.880 1
1 356 . 15 1 1 A 35 35 LYS CB C 35 36.125 34.246 1.879 1
1 360 . 15 1 1 A 35 35 LYS N N 35 120.864 121.072 -0.208 1
1 361 . 15 1 1 A 36 36 VAL H H 36 8.977 8.462 0.515 1
1 362 . 15 1 1 A 36 36 VAL HA H 36 4.274 4.685 -0.411 1
1 370 . 15 1 1 A 36 36 VAL C C 36 176.733 175.337 1.396 1
1 371 . 15 1 1 A 36 36 VAL CA C 36 64.319 61.169 3.150 1
1 372 . 15 1 1 A 36 36 VAL CB C 36 31.602 33.266 -1.664 1
1 375 . 15 1 1 A 36 36 VAL N N 36 124.314 122.362 1.952 1
1 376 . 15 1 1 A 37 37 ARG H H 37 9.498 10.268 -0.770 1
1 377 . 15 1 1 A 37 37 ARG HA H 37 5.053 5.180 -0.127 1
1 384 . 15 1 1 A 37 37 ARG C C 37 174.442 174.411 0.031 1
1 385 . 15 1 1 A 37 37 ARG CA C 37 53.272 54.280 -1.008 1
1 386 . 15 1 1 A 37 37 ARG CB C 37 34.563 34.778 -0.215 1
1 389 . 15 1 1 A 37 37 ARG N N 37 128.121 125.518 2.603 1
1 390 . 15 1 1 A 38 38 ARG H H 38 8.755 8.693 0.062 1
1 391 . 15 1 1 A 38 38 ARG HA H 38 4.626 4.354 0.272 1
1 398 . 15 1 1 A 38 38 ARG C C 38 175.514 174.790 0.724 1
1 399 . 15 1 1 A 38 38 ARG CA C 38 55.601 55.164 0.437 1
1 400 . 15 1 1 A 38 38 ARG CB C 38 32.219 30.880 1.339 1
1 403 . 15 1 1 A 38 38 ARG N N 38 121.442 123.147 -1.705 1
1 404 . 15 1 1 A 39 39 PHE H H 39 9.865 9.082 0.783 1
1 405 . 15 1 1 A 39 39 PHE HA H 39 5.424 5.068 0.356 1
1 413 . 15 1 1 A 39 39 PHE C C 39 175.423 174.776 0.647 1
1 414 . 15 1 1 A 39 39 PHE CA C 39 57.419 57.013 0.406 1
1 415 . 15 1 1 A 39 39 PHE CB C 39 42.623 40.532 2.091 1
1 421 . 15 1 1 A 39 39 PHE N N 39 130.027 126.503 3.524 1
1 422 . 15 1 1 A 40 40 VAL H H 40 9.300 10.092 -0.792 1
1 423 . 15 1 1 A 40 40 VAL HA H 40 4.846 5.337 -0.491 1
1 431 . 15 1 1 A 40 40 VAL C C 40 174.477 173.554 0.923 1
1 432 . 15 1 1 A 40 40 VAL CA C 40 62.343 59.753 2.590 1
1 433 . 15 1 1 A 40 40 VAL CB C 40 35.755 34.640 1.115 1
1 436 . 15 1 1 A 40 40 VAL N N 40 119.369 123.220 -3.851 1
1 437 . 15 1 1 A 41 41 LEU H H 41 9.557 9.901 -0.344 1
1 438 . 15 1 1 A 41 41 LEU HA H 41 5.292 5.458 -0.166 1
1 448 . 15 1 1 A 41 41 LEU C C 41 174.632 175.402 -0.770 1
1 449 . 15 1 1 A 41 41 LEU CA C 41 53.571 53.908 -0.337 1
1 450 . 15 1 1 A 41 41 LEU CB C 41 45.337 45.013 0.324 1
1 454 . 15 1 1 A 41 41 LEU N N 41 132.121 129.243 2.878 1
1 455 . 15 1 1 A 42 42 ARG H H 42 9.396 8.922 0.474 1
1 456 . 15 1 1 A 42 42 ARG HA H 42 5.366 5.476 -0.110 1
1 464 . 15 1 1 A 42 42 ARG C C 42 173.997 175.138 -1.141 1
1 465 . 15 1 1 A 42 42 ARG CA C 42 54.631 54.213 0.418 1
1 466 . 15 1 1 A 42 42 ARG CB C 42 35.550 34.059 1.491 1
1 469 . 15 1 1 A 42 42 ARG N N 42 128.120 125.937 2.183 1
1 471 . 15 1 1 A 43 43 LYS H H 43 8.597 9.062 -0.465 1
1 472 . 15 1 1 A 43 43 LYS HA H 43 4.558 4.933 -0.375 1
1 481 . 15 1 1 A 43 43 LYS C C 43 174.648 174.962 -0.314 1
1 482 . 15 1 1 A 43 43 LYS CA C 43 53.378 54.731 -1.353 1
1 483 . 15 1 1 A 43 43 LYS CB C 43 37.303 36.178 1.125 1
1 487 . 15 1 1 A 43 43 LYS N N 43 114.484 119.155 -4.671 1
1 488 . 15 1 1 A 44 44 ASP H H 44 8.388 8.827 -0.439 1
1 489 . 15 1 1 A 44 44 ASP HA H 44 4.349 4.202 0.147 1
1 492 . 15 1 1 A 44 44 ASP C C 44 173.376 174.335 -0.959 1
1 493 . 15 1 1 A 44 44 ASP CA C 44 54.842 54.912 -0.070 1
1 494 . 15 1 1 A 44 44 ASP CB C 44 39.991 39.414 0.577 1
1 495 . 15 1 1 A 44 44 ASP N N 44 115.453 118.353 -2.900 1
1 496 . 15 1 1 A 45 45 PRO HA H 45 4.652 4.635 0.017 1
1 503 . 15 1 1 A 45 45 PRO C C 45 176.914 175.605 1.309 1
1 504 . 15 1 1 A 45 45 PRO CA C 45 63.490 62.585 0.905 1
1 505 . 15 1 1 A 45 45 PRO CB C 45 34.892 32.866 2.026 1
1 508 . 15 1 1 A 46 46 ALA H H 46 8.112 8.441 -0.329 1
1 509 . 15 1 1 A 46 46 ALA HA H 46 5.455 4.800 0.655 1
1 513 . 15 1 1 A 46 46 ALA C C 46 177.234 176.679 0.555 1
1 514 . 15 1 1 A 46 46 ALA CA C 46 51.560 50.791 0.769 1
1 515 . 15 1 1 A 46 46 ALA CB C 46 20.122 20.153 -0.031 1
1 516 . 15 1 1 A 46 46 ALA N N 46 120.155 123.178 -3.023 1
1 517 . 15 1 1 A 47 47 PHE H H 47 8.717 8.557 0.160 1
1 518 . 15 1 1 A 47 47 PHE HA H 47 4.795 4.917 -0.122 1
1 526 . 15 1 1 A 47 47 PHE C C 47 172.588 174.160 -1.572 1
1 527 . 15 1 1 A 47 47 PHE CA C 47 57.348 56.423 0.925 1
1 528 . 15 1 1 A 47 47 PHE CB C 47 47.123 43.654 3.469 1
1 534 . 15 1 1 A 47 47 PHE N N 47 129.946 119.159 10.787 1
1 535 . 15 1 1 A 48 48 LEU H H 48 7.883 8.279 -0.396 1
1 536 . 15 1 1 A 48 48 LEU HA H 48 5.198 5.174 0.024 1
1 546 . 15 1 1 A 48 48 LEU C C 48 173.569 174.428 -0.859 1
1 547 . 15 1 1 A 48 48 LEU CA C 48 53.290 53.649 -0.359 1
1 548 . 15 1 1 A 48 48 LEU CB C 48 45.502 44.995 0.507 1
1 552 . 15 1 1 A 48 48 LEU N N 48 121.108 123.684 -2.576 1
1 553 . 15 1 1 A 49 49 HIS H H 49 8.606 8.883 -0.277 1
1 554 . 15 1 1 A 49 49 HIS HA H 49 5.035 5.179 -0.144 1
1 559 . 15 1 1 A 49 49 HIS C C 49 173.993 173.954 0.039 1
1 560 . 15 1 1 A 49 49 HIS CA C 49 56.483 54.136 2.347 1
1 561 . 15 1 1 A 49 49 HIS CB C 49 35.919 33.710 2.209 1
1 564 . 15 1 1 A 49 49 HIS N N 49 121.199 125.778 -4.579 1
1 565 . 15 1 1 A 50 50 TYR H H 50 7.777 8.792 -1.015 1
1 566 . 15 1 1 A 50 50 TYR HA H 50 5.695 5.711 -0.016 1
1 573 . 15 1 1 A 50 50 TYR C C 50 174.284 172.357 1.927 1
1 574 . 15 1 1 A 50 50 TYR CA C 50 53.430 55.298 -1.868 1
1 575 . 15 1 1 A 50 50 TYR CB C 50 38.552 41.356 -2.804 1
1 580 . 15 1 1 A 50 50 TYR N N 50 114.156 117.605 -3.449 1
1 581 . 15 1 1 A 51 51 TYR H H 51 9.323 9.566 -0.243 1
1 582 . 15 1 1 A 51 51 TYR HA H 51 4.600 4.859 -0.259 1
1 589 . 15 1 1 A 51 51 TYR C C 51 175.352 174.432 0.920 1
1 590 . 15 1 1 A 51 51 TYR CA C 51 57.330 56.130 1.200 1
1 591 . 15 1 1 A 51 51 TYR CB C 51 41.683 41.703 -0.020 1
1 596 . 15 1 1 A 51 51 TYR N N 51 119.100 119.503 -0.403 1
1 597 . 15 1 1 A 52 52 ASP H H 52 9.375 8.537 0.838 1
1 598 . 15 1 1 A 52 52 ASP HA H 52 5.064 4.874 0.190 1
1 601 . 15 1 1 A 52 52 ASP C C 52 175.484 176.060 -0.576 1
1 602 . 15 1 1 A 52 52 ASP CA C 52 51.313 51.565 -0.252 1
1 603 . 15 1 1 A 52 52 ASP CB C 52 41.883 42.069 -0.186 1
1 604 . 15 1 1 A 52 52 ASP N N 52 124.636 124.103 0.533 1
1 605 . 15 1 1 A 53 53 PRO HA H 53 4.678 4.661 0.017 1
1 612 . 15 1 1 A 53 53 PRO C C 53 176.781 177.644 -0.863 1
1 613 . 15 1 1 A 53 53 PRO CA C 53 64.054 64.246 -0.192 1
1 614 . 15 1 1 A 53 53 PRO CB C 53 32.589 32.121 0.468 1
1 617 . 15 1 1 A 54 54 SER H H 54 8.685 9.670 -0.985 1
1 618 . 15 1 1 A 54 54 SER HA H 54 4.483 4.378 0.105 1
1 621 . 15 1 1 A 54 54 SER C C 54 174.006 174.237 -0.231 1
1 622 . 15 1 1 A 54 54 SER CA C 54 59.378 60.444 -1.066 1
1 623 . 15 1 1 A 54 54 SER CB C 54 64.132 64.252 -0.120 1
1 624 . 15 1 1 A 54 54 SER N N 54 113.769 112.983 0.786 1
1 625 . 15 1 1 A 55 55 LYS H H 55 7.706 7.537 0.169 1
1 626 . 15 1 1 A 55 55 LYS HA H 55 4.580 4.865 -0.285 1
1 635 . 15 1 1 A 55 55 LYS C C 55 175.969 175.365 0.604 1
1 636 . 15 1 1 A 55 55 LYS CA C 55 55.160 54.994 0.166 1
1 637 . 15 1 1 A 55 55 LYS CB C 55 34.069 35.167 -1.098 1
1 641 . 15 1 1 A 55 55 LYS N N 55 122.222 121.352 0.870 1
1 642 . 15 1 1 A 56 56 GLU H H 56 8.666 8.912 -0.246 1
1 643 . 15 1 1 A 56 56 GLU HA H 56 4.174 4.762 -0.588 1
1 648 . 15 1 1 A 56 56 GLU C C 56 177.084 175.081 2.003 1
1 649 . 15 1 1 A 56 56 GLU CA C 56 57.099 55.425 1.674 1
1 650 . 15 1 1 A 56 56 GLU CB C 56 29.694 29.668 0.026 1
1 652 . 15 1 1 A 56 56 GLU N N 56 122.015 125.150 -3.135 1
1 653 . 15 1 1 A 57 57 GLU H H 57 8.303 8.052 0.251 1
1 654 . 15 1 1 A 57 57 GLU HA H 57 4.214 4.553 -0.339 1
1 659 . 15 1 1 A 57 57 GLU CA C 57 56.960 55.900 1.060 1
1 660 . 15 1 1 A 57 57 GLU CB C 57 30.264 31.074 -0.810 1
1 662 . 15 1 1 A 57 57 GLU N N 57 119.884 123.760 -3.876 1
1 663 . 15 1 1 A 58 58 ASN HA H 58 4.768 4.963 -0.195 1
1 668 . 15 1 1 A 58 58 ASN C C 58 174.902 173.710 1.192 1
1 669 . 15 1 1 A 58 58 ASN CA C 58 52.740 52.991 -0.251 1
1 670 . 15 1 1 A 58 58 ASN CB C 58 38.116 36.426 1.690 1
1 672 . 15 1 1 A 59 59 ARG H H 59 7.805 7.785 0.020 1
1 673 . 15 1 1 A 59 59 ARG HA H 59 4.762 4.717 0.045 1
1 680 . 15 1 1 A 59 59 ARG CA C 59 53.151 54.894 -1.743 1
1 681 . 15 1 1 A 59 59 ARG CB C 59 31.519 33.664 -2.145 1
1 684 . 15 1 1 A 59 59 ARG N N 59 121.060 120.769 0.291 1
1 685 . 15 1 1 A 60 60 PRO HA H 60 3.357 3.796 -0.439 1
1 692 . 15 1 1 A 60 60 PRO C C 60 176.817 176.302 0.515 1
1 693 . 15 1 1 A 60 60 PRO CA C 60 63.031 61.657 1.374 1
1 694 . 15 1 1 A 60 60 PRO CB C 60 31.273 32.356 -1.083 1
1 697 . 15 1 1 A 61 61 VAL H H 61 8.627 8.996 -0.369 1
1 698 . 15 1 1 A 61 61 VAL HA H 61 3.966 3.703 0.263 1
1 706 . 15 1 1 A 61 61 VAL C C 61 176.503 176.078 0.425 1
1 707 . 15 1 1 A 61 61 VAL CA C 61 63.154 63.517 -0.363 1
1 708 . 15 1 1 A 61 61 VAL CB C 61 32.048 31.983 0.065 1
1 711 . 15 1 1 A 61 61 VAL N N 61 119.185 118.359 0.826 1
1 712 . 15 1 1 A 62 62 GLY H H 62 6.715 7.021 -0.306 1
1 713 . 15 1 1 A 62 62 GLY HA2 H 62 3.940 4.013 -0.073 1
1 714 . 15 1 1 A 62 62 GLY HA3 H 62 3.538 4.038 -0.500 1
1 715 . 15 1 1 A 62 62 GLY C C 62 169.983 174.302 -4.319 1
1 716 . 15 1 1 A 62 62 GLY CA C 62 44.465 45.469 -1.004 1
1 717 . 15 1 1 A 62 62 GLY N N 62 105.813 108.389 -2.576 1
1 718 . 15 1 1 A 63 63 GLY H H 63 8.004 8.133 -0.129 1
1 719 . 15 1 1 A 63 63 GLY HA2 H 63 4.095 3.360 0.735 1
1 720 . 15 1 1 A 63 63 GLY HA3 H 63 3.813 4.125 -0.312 1
1 721 . 15 1 1 A 63 63 GLY C C 63 171.870 172.586 -0.716 1
1 722 . 15 1 1 A 63 63 GLY CA C 63 47.148 44.522 2.626 1
1 723 . 15 1 1 A 63 63 GLY N N 63 105.089 109.896 -4.807 1
1 724 . 15 1 1 A 64 64 PHE H H 64 7.967 7.447 0.520 1
1 725 . 15 1 1 A 64 64 PHE HA H 64 4.934 5.392 -0.458 1
1 733 . 15 1 1 A 64 64 PHE C C 64 173.140 173.814 -0.674 1
1 734 . 15 1 1 A 64 64 PHE CA C 64 55.248 55.479 -0.231 1
1 735 . 15 1 1 A 64 64 PHE CB C 64 40.238 41.611 -1.373 1
1 741 . 15 1 1 A 64 64 PHE N N 64 113.387 116.047 -2.660 1
1 742 . 15 1 1 A 65 65 SER H H 65 8.518 8.976 -0.458 1
1 743 . 15 1 1 A 65 65 SER HA H 65 3.264 4.405 -1.141 1
1 746 . 15 1 1 A 65 65 SER C C 65 176.417 174.187 2.230 1
1 747 . 15 1 1 A 65 65 SER CA C 65 56.819 57.648 -0.829 1
1 748 . 15 1 1 A 65 65 SER CB C 65 63.391 64.969 -1.578 1
1 749 . 15 1 1 A 65 65 SER N N 65 114.674 115.797 -1.123 1
1 750 . 15 1 1 A 66 66 LEU H H 66 7.404 8.025 -0.621 1
1 751 . 15 1 1 A 66 66 LEU HA H 66 4.470 4.336 0.134 1
1 761 . 15 1 1 A 66 66 LEU C C 66 177.993 178.460 -0.467 1
1 762 . 15 1 1 A 66 66 LEU CA C 66 54.242 56.013 -1.771 1
1 763 . 15 1 1 A 66 66 LEU CB C 66 42.787 42.567 0.220 1
1 767 . 15 1 1 A 66 66 LEU N N 66 123.988 121.417 2.571 1
1 768 . 15 1 1 A 67 67 ARG H H 67 7.865 7.989 -0.124 1
1 769 . 15 1 1 A 67 67 ARG HA H 67 4.175 3.931 0.244 1
1 776 . 15 1 1 A 67 67 ARG C C 67 178.562 177.982 0.580 1
1 777 . 15 1 1 A 67 67 ARG CA C 67 58.143 59.286 -1.143 1
1 778 . 15 1 1 A 67 67 ARG CB C 67 29.052 30.075 -1.023 1
1 781 . 15 1 1 A 67 67 ARG N N 67 122.494 117.752 4.742 1
1 782 . 15 1 1 A 68 68 GLY H H 68 9.398 8.070 1.328 1
1 783 . 15 1 1 A 68 68 GLY HA2 H 68 4.066 3.913 0.153 1
1 784 . 15 1 1 A 68 68 GLY HA3 H 68 3.908 3.915 -0.007 1
1 785 . 15 1 1 A 68 68 GLY C C 68 173.982 173.376 0.606 1
1 786 . 15 1 1 A 68 68 GLY CA C 68 46.230 46.492 -0.262 1
1 787 . 15 1 1 A 68 68 GLY N N 68 117.548 107.762 9.786 1
1 788 . 15 1 1 A 69 69 SER H H 69 7.829 7.606 0.223 1
1 789 . 15 1 1 A 69 69 SER HA H 69 4.807 5.144 -0.337 1
1 792 . 15 1 1 A 69 69 SER C C 69 172.854 172.705 0.149 1
1 793 . 15 1 1 A 69 69 SER CA C 69 59.290 57.513 1.777 1
1 794 . 15 1 1 A 69 69 SER CB C 69 65.366 67.961 -2.595 1
1 795 . 15 1 1 A 69 69 SER N N 69 115.188 114.883 0.305 1
1 796 . 15 1 1 A 70 70 LEU H H 70 8.805 8.771 0.034 1
1 797 . 15 1 1 A 70 70 LEU HA H 70 4.846 4.776 0.070 1
1 807 . 15 1 1 A 70 70 LEU C C 70 175.775 174.120 1.655 1
1 808 . 15 1 1 A 70 70 LEU CA C 70 53.907 53.952 -0.045 1
1 809 . 15 1 1 A 70 70 LEU CB C 70 45.337 45.979 -0.642 1
1 813 . 15 1 1 A 70 70 LEU N N 70 121.265 123.031 -1.766 1
1 814 . 15 1 1 A 71 71 VAL H H 71 8.644 8.801 -0.157 1
1 815 . 15 1 1 A 71 71 VAL HA H 71 5.555 5.104 0.451 1
1 823 . 15 1 1 A 71 71 VAL C C 71 173.636 173.501 0.135 1
1 824 . 15 1 1 A 71 71 VAL CA C 71 58.760 59.580 -0.820 1
1 825 . 15 1 1 A 71 71 VAL CB C 71 34.891 35.975 -1.084 1
1 828 . 15 1 1 A 71 71 VAL N N 71 122.315 122.563 -0.248 1
1 829 . 15 1 1 A 72 72 SER H H 72 8.750 8.819 -0.069 1
1 830 . 15 1 1 A 72 72 SER HA H 72 4.742 4.969 -0.227 1
1 833 . 15 1 1 A 72 72 SER C C 72 173.058 172.636 0.422 1
1 834 . 15 1 1 A 72 72 SER CA C 72 57.190 57.771 -0.581 1
1 835 . 15 1 1 A 72 72 SER CB C 72 65.612 67.435 -1.823 1
1 836 . 15 1 1 A 72 72 SER N N 72 118.611 121.237 -2.626 1
1 837 . 15 1 1 A 73 73 ALA H H 73 9.009 8.607 0.402 1
1 838 . 15 1 1 A 73 73 ALA HA H 73 4.406 5.091 -0.685 1
1 842 . 15 1 1 A 73 73 ALA C C 73 176.708 176.835 -0.127 1
1 843 . 15 1 1 A 73 73 ALA CA C 73 52.672 50.481 2.191 1
1 844 . 15 1 1 A 73 73 ALA CB C 73 18.812 21.516 -2.704 1
1 845 . 15 1 1 A 73 73 ALA N N 73 125.694 125.454 0.240 1
1 846 . 15 1 1 A 74 74 LEU H H 74 7.800 8.262 -0.462 1
1 847 . 15 1 1 A 74 74 LEU HA H 74 4.716 4.916 -0.200 1
1 857 . 15 1 1 A 74 74 LEU C C 74 176.551 175.922 0.629 1
1 858 . 15 1 1 A 74 74 LEU CA C 74 53.784 53.211 0.573 1
1 859 . 15 1 1 A 74 74 LEU CB C 74 43.446 44.286 -0.840 1
1 863 . 15 1 1 A 74 74 LEU N N 74 122.271 120.322 1.949 1
1 864 . 15 1 1 A 75 75 GLU H H 75 8.855 8.857 -0.002 1
1 865 . 15 1 1 A 75 75 GLU HA H 75 4.336 5.200 -0.864 1
1 870 . 15 1 1 A 75 75 GLU C C 75 176.465 174.257 2.208 1
1 871 . 15 1 1 A 75 75 GLU CA C 75 56.507 55.263 1.244 1
1 872 . 15 1 1 A 75 75 GLU CB C 75 30.245 33.647 -3.402 1
1 874 . 15 1 1 A 75 75 GLU N N 75 122.678 118.467 4.211 1
1 875 . 15 1 1 A 76 76 ASP H H 76 8.542 8.941 -0.399 1
1 876 . 15 1 1 A 76 76 ASP HA H 76 4.665 4.829 -0.164 1
1 879 . 15 1 1 A 76 76 ASP C C 76 176.087 175.206 0.881 1
1 880 . 15 1 1 A 76 76 ASP CA C 76 55.107 55.560 -0.453 1
1 881 . 15 1 1 A 76 76 ASP CB C 76 41.431 43.032 -1.601 1
1 882 . 15 1 1 A 76 76 ASP N N 76 121.488 120.944 0.544 1
1 883 . 15 1 1 A 77 77 ASN H H 77 8.322 7.954 0.368 1
1 884 . 15 1 1 A 77 77 ASN HA H 77 4.729 4.903 -0.174 1
1 889 . 15 1 1 A 77 77 ASN C C 77 175.566 175.517 0.049 1
1 890 . 15 1 1 A 77 77 ASN CA C 77 53.131 52.330 0.801 1
1 891 . 15 1 1 A 77 77 ASN CB C 77 38.617 39.884 -1.267 1
1 892 . 15 1 1 A 77 77 ASN N N 77 118.676 115.722 2.954 1
1 894 . 15 1 1 A 78 78 GLY H H 78 8.311 8.953 -0.642 1
1 895 . 15 1 1 A 78 78 GLY HA2 H 78 3.897 3.850 0.047 1
1 896 . 15 1 1 A 78 78 GLY HA3 H 78 3.897 3.855 0.042 1
1 897 . 15 1 1 A 78 78 GLY C C 78 173.376 173.960 -0.584 1
1 898 . 15 1 1 A 78 78 GLY CA C 78 45.224 47.309 -2.085 1
1 899 . 15 1 1 A 78 78 GLY N N 78 108.939 115.328 -6.389 1
1 900 . 15 1 1 A 79 79 VAL H H 79 7.882 8.734 -0.852 1
1 901 . 15 1 1 A 79 79 VAL HA H 79 4.345 4.066 0.279 1
1 909 . 15 1 1 A 79 79 VAL CA C 79 59.995 60.961 -0.966 1
1 910 . 15 1 1 A 79 79 VAL CB C 79 32.589 32.420 0.169 1
1 913 . 15 1 1 A 79 79 VAL N N 79 121.135 124.601 -3.466 1
1 914 . 15 1 1 A 80 80 PRO HA H 80 4.461 4.658 -0.197 1
1 921 . 15 1 1 A 80 80 PRO C C 80 176.979 176.718 0.261 1
1 922 . 15 1 1 A 80 80 PRO CA C 80 63.101 62.293 0.808 1
1 923 . 15 1 1 A 80 80 PRO CB C 80 32.177 33.490 -1.313 1
1 926 . 15 1 1 A 81 81 THR H H 81 8.281 8.547 -0.266 1
1 927 . 15 1 1 A 81 81 THR HA H 81 4.095 4.471 -0.376 1
1 932 . 15 1 1 A 81 81 THR C C 81 175.270 174.733 0.537 1
1 933 . 15 1 1 A 81 81 THR CA C 81 62.872 62.306 0.566 1
1 934 . 15 1 1 A 81 81 THR CB C 81 69.642 69.073 0.569 1
1 936 . 15 1 1 A 81 81 THR N N 81 114.684 114.273 0.411 1
1 937 . 15 1 1 A 82 82 GLY H H 82 8.338 8.435 -0.097 1
1 938 . 15 1 1 A 82 82 GLY HA2 H 82 4.095 3.817 0.278 1
1 939 . 15 1 1 A 82 82 GLY HA3 H 82 3.668 3.851 -0.183 1
1 940 . 15 1 1 A 82 82 GLY C C 82 174.139 173.497 0.642 1
1 941 . 15 1 1 A 82 82 GLY CA C 82 45.083 46.863 -1.780 1
1 942 . 15 1 1 A 82 82 GLY N N 82 111.289 112.106 -0.817 1
1 943 . 15 1 1 A 83 83 VAL H H 83 7.668 7.980 -0.312 1
1 944 . 15 1 1 A 83 83 VAL HA H 83 3.985 4.515 -0.530 1
1 952 . 15 1 1 A 83 83 VAL C C 83 176.054 175.470 0.584 1
1 953 . 15 1 1 A 83 83 VAL CA C 83 62.431 61.758 0.673 1
1 954 . 15 1 1 A 83 83 VAL CB C 83 32.260 34.647 -2.387 1
1 957 . 15 1 1 A 83 83 VAL N N 83 120.003 125.531 -5.528 1
1 958 . 15 1 1 A 84 84 LYS H H 84 8.645 8.681 -0.036 1
1 959 . 15 1 1 A 84 84 LYS HA H 84 4.276 4.048 0.228 1
1 968 . 15 1 1 A 84 84 LYS C C 84 176.832 177.578 -0.746 1
1 969 . 15 1 1 A 84 84 LYS CA C 84 56.272 58.339 -2.067 1
1 970 . 15 1 1 A 84 84 LYS CB C 84 32.876 32.894 -0.018 1
1 974 . 15 1 1 A 84 84 LYS N N 84 126.447 126.882 -0.435 1
1 975 . 15 1 1 A 85 85 GLY H H 85 8.410 8.776 -0.366 1
1 976 . 15 1 1 A 85 85 GLY HA2 H 85 4.066 3.981 0.085 1
1 977 . 15 1 1 A 85 85 GLY HA3 H 85 3.781 3.988 -0.207 1
1 978 . 15 1 1 A 85 85 GLY C C 85 173.969 173.647 0.322 1
1 979 . 15 1 1 A 85 85 GLY CA C 85 45.146 44.829 0.317 1
1 980 . 15 1 1 A 85 85 GLY N N 85 109.957 110.310 -0.353 1
1 981 . 15 1 1 A 86 86 ASN H H 86 8.298 8.297 0.001 1
1 982 . 15 1 1 A 86 86 ASN HA H 86 4.665 5.386 -0.721 1
1 987 . 15 1 1 A 86 86 ASN C C 86 174.987 175.291 -0.304 1
1 988 . 15 1 1 A 86 86 ASN CA C 86 52.989 52.241 0.748 1
1 989 . 15 1 1 A 86 86 ASN CB C 86 38.376 39.467 -1.091 1
1 990 . 15 1 1 A 86 86 ASN N N 86 118.457 117.161 1.296 1
1 992 . 15 1 1 A 87 87 VAL H H 87 7.660 8.631 -0.971 1
1 993 . 15 1 1 A 87 87 VAL HA H 87 3.946 4.559 -0.613 1
1 1001 . 15 1 1 A 87 87 VAL C C 87 174.902 177.130 -2.228 1
1 1002 . 15 1 1 A 87 87 VAL CA C 87 62.307 60.209 2.098 1
1 1003 . 15 1 1 A 87 87 VAL CB C 87 32.548 34.547 -1.999 1
1 1006 . 15 1 1 A 87 87 VAL N N 87 120.557 118.068 2.489 1
1 1007 . 15 1 1 A 88 88 GLN H H 88 8.115 8.299 -0.184 1
1 1008 . 15 1 1 A 88 88 GLN HA H 88 4.302 4.086 0.216 1
1 1015 . 15 1 1 A 88 88 GLN C C 88 175.637 175.757 -0.120 1
1 1016 . 15 1 1 A 88 88 GLN CA C 88 55.336 57.669 -2.333 1
1 1017 . 15 1 1 A 88 88 GLN CB C 88 30.574 28.991 1.583 1
1 1019 . 15 1 1 A 88 88 GLN N N 88 122.280 120.571 1.709 1
1 1021 . 15 1 1 A 89 89 GLY H H 89 8.544 7.931 0.613 1
1 1022 . 15 1 1 A 89 89 GLY HA2 H 89 3.885 4.036 -0.151 1
1 1023 . 15 1 1 A 89 89 GLY HA3 H 89 3.885 4.045 -0.160 1
1 1024 . 15 1 1 A 89 89 GLY C C 89 172.861 174.190 -1.329 1
1 1025 . 15 1 1 A 89 89 GLY CA C 89 44.889 45.316 -0.427 1
1 1026 . 15 1 1 A 89 89 GLY N N 89 110.135 106.720 3.415 1
1 1027 . 15 1 1 A 90 90 ASN H H 90 8.451 8.074 0.377 1
1 1028 . 15 1 1 A 90 90 ASN HA H 90 4.222 5.041 -0.819 1
1 1033 . 15 1 1 A 90 90 ASN C C 90 174.926 174.418 0.508 1
1 1034 . 15 1 1 A 90 90 ASN CA C 90 54.613 52.177 2.436 1
1 1035 . 15 1 1 A 90 90 ASN CB C 90 37.852 39.352 -1.500 1
1 1036 . 15 1 1 A 90 90 ASN N N 90 114.322 119.163 -4.841 1
1 1038 . 15 1 1 A 91 91 LEU H H 91 8.933 8.096 0.837 1
1 1039 . 15 1 1 A 91 91 LEU HA H 91 5.367 4.778 0.589 1
1 1049 . 15 1 1 A 91 91 LEU C C 91 178.732 175.819 2.913 1
1 1050 . 15 1 1 A 91 91 LEU CA C 91 55.160 54.247 0.913 1
1 1051 . 15 1 1 A 91 91 LEU CB C 91 45.461 42.741 2.720 1
1 1055 . 15 1 1 A 91 91 LEU N N 91 120.057 122.197 -2.140 1
1 1056 . 15 1 1 A 92 92 PHE H H 92 9.901 8.069 1.832 1
1 1057 . 15 1 1 A 92 92 PHE HA H 92 5.105 5.055 0.050 1
1 1065 . 15 1 1 A 92 92 PHE C C 92 170.140 172.882 -2.742 1
1 1066 . 15 1 1 A 92 92 PHE CA C 92 56.236 56.158 0.078 1
1 1067 . 15 1 1 A 92 92 PHE CB C 92 42.664 40.933 1.731 1
1 1073 . 15 1 1 A 92 92 PHE N N 92 119.740 116.488 3.252 1
1 1074 . 15 1 1 A 93 93 LYS H H 93 9.154 9.076 0.078 1
1 1075 . 15 1 1 A 93 93 LYS HA H 93 5.584 5.164 0.420 1
1 1083 . 15 1 1 A 93 93 LYS C C 93 174.830 174.451 0.379 1
1 1084 . 15 1 1 A 93 93 LYS CA C 93 53.148 54.121 -0.973 1
1 1085 . 15 1 1 A 93 93 LYS CB C 93 36.660 36.672 -0.012 1
1 1089 . 15 1 1 A 93 93 LYS N N 93 117.710 117.225 0.485 1
1 1090 . 15 1 1 A 94 94 VAL H H 94 8.507 8.417 0.090 1
1 1091 . 15 1 1 A 94 94 VAL HA H 94 4.872 5.107 -0.235 1
1 1099 . 15 1 1 A 94 94 VAL C C 94 174.408 174.693 -0.285 1
1 1100 . 15 1 1 A 94 94 VAL CA C 94 60.525 61.365 -0.840 1
1 1101 . 15 1 1 A 94 94 VAL CB C 94 34.862 34.732 0.130 1
1 1104 . 15 1 1 A 94 94 VAL N N 94 121.741 120.191 1.550 1
1 1105 . 15 1 1 A 95 95 ILE H H 95 8.959 9.044 -0.085 1
1 1106 . 15 1 1 A 95 95 ILE HA H 95 4.794 5.101 -0.307 1
1 1116 . 15 1 1 A 95 95 ILE C C 95 177.642 176.204 1.438 1
1 1117 . 15 1 1 A 95 95 ILE CA C 95 59.713 60.429 -0.716 1
1 1118 . 15 1 1 A 95 95 ILE CB C 95 40.032 38.187 1.845 1
1 1122 . 15 1 1 A 95 95 ILE N N 95 126.794 128.428 -1.634 1
1 1123 . 15 1 1 A 96 96 THR H H 96 8.765 8.840 -0.075 1
1 1124 . 15 1 1 A 96 96 THR HA H 96 4.584 4.804 -0.220 1
1 1129 . 15 1 1 A 96 96 THR C C 96 177.023 176.321 0.702 1
1 1130 . 15 1 1 A 96 96 THR CA C 96 61.372 60.551 0.821 1
1 1131 . 15 1 1 A 96 96 THR CB C 96 70.794 71.722 -0.928 1
1 1133 . 15 1 1 A 96 96 THR N N 96 117.225 119.937 -2.712 1
1 1134 . 15 1 1 A 97 97 LYS H H 97 8.736 8.591 0.145 1
1 1135 . 15 1 1 A 97 97 LYS HA H 97 4.101 4.072 0.029 1
1 1144 . 15 1 1 A 97 97 LYS C C 97 176.490 176.820 -0.330 1
1 1145 . 15 1 1 A 97 97 LYS CA C 97 58.583 58.624 -0.041 1
1 1146 . 15 1 1 A 97 97 LYS CB C 97 31.848 32.196 -0.348 1
1 1150 . 15 1 1 A 97 97 LYS N N 97 120.457 119.633 0.824 1
1 1151 . 15 1 1 A 98 98 ASP H H 98 7.762 7.972 -0.210 1
1 1152 . 15 1 1 A 98 98 ASP HA H 98 4.633 4.792 -0.159 1
1 1155 . 15 1 1 A 98 98 ASP C C 98 175.270 175.260 0.010 1
1 1156 . 15 1 1 A 98 98 ASP CA C 98 53.272 53.901 -0.629 1
1 1157 . 15 1 1 A 98 98 ASP CB C 98 39.909 41.021 -1.112 1
1 1158 . 15 1 1 A 98 98 ASP N N 98 116.281 118.238 -1.957 1
1 1159 . 15 1 1 A 99 99 ASP H H 99 8.340 8.576 -0.236 1
1 1160 . 15 1 1 A 99 99 ASP HA H 99 4.245 4.298 -0.053 1
1 1163 . 15 1 1 A 99 99 ASP C C 99 175.315 174.798 0.517 1
1 1164 . 15 1 1 A 99 99 ASP CA C 99 55.989 55.584 0.405 1
1 1165 . 15 1 1 A 99 99 ASP CB C 99 39.827 40.306 -0.479 1
1 1166 . 15 1 1 A 99 99 ASP N N 99 116.687 118.142 -1.455 1
1 1167 . 15 1 1 A 100 100 THR H H 100 7.511 7.550 -0.039 1
1 1168 . 15 1 1 A 100 100 THR HA H 100 4.185 4.209 -0.024 1
1 1173 . 15 1 1 A 100 100 THR C C 100 173.376 174.006 -0.630 1
1 1174 . 15 1 1 A 100 100 THR CA C 100 63.489 62.621 0.868 1
1 1175 . 15 1 1 A 100 100 THR CB C 100 67.909 69.159 -1.250 1
1 1177 . 15 1 1 A 100 100 THR N N 100 116.525 114.208 2.317 1
1 1178 . 15 1 1 A 101 101 HIS H H 101 8.753 8.948 -0.195 1
1 1179 . 15 1 1 A 101 101 HIS HA H 101 4.898 5.064 -0.166 1
1 1184 . 15 1 1 A 101 101 HIS C C 101 174.345 174.031 0.314 1
1 1185 . 15 1 1 A 101 101 HIS CA C 101 55.072 54.710 0.362 1
1 1186 . 15 1 1 A 101 101 HIS CB C 101 32.835 29.748 3.087 1
1 1189 . 15 1 1 A 101 101 HIS N N 101 125.953 126.492 -0.539 1
1 1190 . 15 1 1 A 102 102 TYR H H 102 9.023 9.427 -0.404 1
1 1191 . 15 1 1 A 102 102 TYR HA H 102 4.545 4.779 -0.234 1
1 1198 . 15 1 1 A 102 102 TYR C C 102 174.126 174.849 -0.723 1
1 1199 . 15 1 1 A 102 102 TYR CA C 102 57.260 56.780 0.480 1
1 1200 . 15 1 1 A 102 102 TYR CB C 102 40.381 37.670 2.711 1
1 1205 . 15 1 1 A 102 102 TYR N N 102 121.975 124.562 -2.587 1
1 1206 . 15 1 1 A 103 103 TYR H H 103 8.899 8.920 -0.021 1
1 1207 . 15 1 1 A 103 103 TYR HA H 103 4.729 4.856 -0.127 1
1 1214 . 15 1 1 A 103 103 TYR C C 103 174.139 175.864 -1.725 1
1 1215 . 15 1 1 A 103 103 TYR CA C 103 58.036 57.992 0.044 1
1 1216 . 15 1 1 A 103 103 TYR CB C 103 40.485 38.580 1.905 1
1 1221 . 15 1 1 A 103 103 TYR N N 103 122.012 124.690 -2.678 1
1 1222 . 15 1 1 A 104 104 ILE H H 104 8.605 8.438 0.167 1
1 1223 . 15 1 1 A 104 104 ILE HA H 104 4.859 5.022 -0.163 1
1 1233 . 15 1 1 A 104 104 ILE C C 104 172.769 174.211 -1.442 1
1 1234 . 15 1 1 A 104 104 ILE CA C 104 59.554 59.711 -0.157 1
1 1235 . 15 1 1 A 104 104 ILE CB C 104 40.631 40.777 -0.146 1
1 1239 . 15 1 1 A 104 104 ILE N N 104 123.443 123.679 -0.236 1
1 1240 . 15 1 1 A 105 105 GLN H H 105 9.369 8.538 0.831 1
1 1241 . 15 1 1 A 105 105 GLN HA H 105 4.895 5.173 -0.278 1
1 1248 . 15 1 1 A 105 105 GLN C C 105 175.642 174.824 0.818 1
1 1249 . 15 1 1 A 105 105 GLN CA C 105 54.965 53.927 1.038 1
1 1250 . 15 1 1 A 105 105 GLN CB C 105 32.856 32.195 0.661 1
1 1252 . 15 1 1 A 105 105 GLN N N 105 125.079 123.744 1.335 1
1 1254 . 15 1 1 A 106 106 ALA H H 106 8.513 8.598 -0.085 1
1 1255 . 15 1 1 A 106 106 ALA HA H 106 4.962 4.802 0.160 1
1 1259 . 15 1 1 A 106 106 ALA C C 106 175.854 178.043 -2.189 1
1 1260 . 15 1 1 A 106 106 ALA CA C 106 50.272 50.608 -0.336 1
1 1261 . 15 1 1 A 106 106 ALA CB C 106 21.197 21.049 0.148 1
1 1262 . 15 1 1 A 106 106 ALA N N 106 129.303 129.394 -0.091 1
1 1263 . 15 1 1 A 107 107 SER H H 107 9.468 9.002 0.466 1
1 1264 . 15 1 1 A 107 107 SER HA H 107 4.447 4.307 0.140 1
1 1267 . 15 1 1 A 107 107 SER C C 107 173.785 173.531 0.254 1
1 1268 . 15 1 1 A 107 107 SER CA C 107 60.048 61.506 -1.458 1
1 1269 . 15 1 1 A 107 107 SER CB C 107 64.643 63.289 1.354 1
1 1270 . 15 1 1 A 107 107 SER N N 107 112.962 117.266 -4.304 1
1 1271 . 15 1 1 A 108 108 SER H H 108 7.555 7.769 -0.214 1
1 1272 . 15 1 1 A 108 108 SER HA H 108 4.665 4.927 -0.262 1
1 1275 . 15 1 1 A 108 108 SER C C 108 174.381 173.854 0.527 1
1 1276 . 15 1 1 A 108 108 SER CA C 108 56.907 56.946 -0.039 1
1 1277 . 15 1 1 A 108 108 SER CB C 108 66.370 66.768 -0.398 1
1 1278 . 15 1 1 A 108 108 SER N N 108 112.243 112.844 -0.601 1
1 1279 . 15 1 1 A 109 109 LYS H H 109 8.978 9.141 -0.163 1
1 1280 . 15 1 1 A 109 109 LYS HA H 109 4.777 4.060 0.717 1
1 1287 . 15 1 1 A 109 109 LYS C C 109 179.992 178.842 1.150 1
1 1288 . 15 1 1 A 109 109 LYS CA C 109 59.766 59.173 0.593 1
1 1289 . 15 1 1 A 109 109 LYS CB C 109 32.342 31.965 0.377 1
1 1293 . 15 1 1 A 109 109 LYS N N 109 123.170 124.287 -1.117 1
1 1294 . 15 1 1 A 110 110 ALA H H 110 8.608 8.072 0.536 1
1 1295 . 15 1 1 A 110 110 ALA HA H 110 4.178 4.169 0.009 1
1 1299 . 15 1 1 A 110 110 ALA C C 110 179.895 179.354 0.541 1
1 1300 . 15 1 1 A 110 110 ALA CA C 110 54.871 55.200 -0.329 1
1 1301 . 15 1 1 A 110 110 ALA CB C 110 18.065 19.046 -0.981 1
1 1302 . 15 1 1 A 110 110 ALA N N 110 123.750 122.699 1.051 1
1 1303 . 15 1 1 A 111 111 GLU H H 111 8.185 8.307 -0.122 1
1 1304 . 15 1 1 A 111 111 GLU HA H 111 4.180 4.024 0.156 1
1 1309 . 15 1 1 A 111 111 GLU C C 111 178.587 178.825 -0.238 1
1 1310 . 15 1 1 A 111 111 GLU CA C 111 59.466 59.771 -0.305 1
1 1311 . 15 1 1 A 111 111 GLU CB C 111 31.067 29.456 1.611 1
1 1313 . 15 1 1 A 111 111 GLU N N 111 119.757 119.012 0.745 1
1 1314 . 15 1 1 A 112 112 ARG H H 112 8.008 7.846 0.162 1
1 1315 . 15 1 1 A 112 112 ARG HA H 112 3.642 3.978 -0.336 1
1 1322 . 15 1 1 A 112 112 ARG C C 112 176.481 178.282 -1.801 1
1 1323 . 15 1 1 A 112 112 ARG CA C 112 60.419 59.616 0.803 1
1 1324 . 15 1 1 A 112 112 ARG CB C 112 29.957 30.094 -0.137 1
1 1327 . 15 1 1 A 112 112 ARG N N 112 118.430 120.025 -1.595 1
1 1328 . 15 1 1 A 113 113 ALA H H 113 7.985 8.127 -0.142 1
1 1329 . 15 1 1 A 113 113 ALA HA H 113 3.925 4.009 -0.084 1
1 1333 . 15 1 1 A 113 113 ALA C C 113 180.117 180.003 0.114 1
1 1334 . 15 1 1 A 113 113 ALA CA C 113 55.372 55.034 0.338 1
1 1335 . 15 1 1 A 113 113 ALA CB C 113 17.825 18.396 -0.571 1
1 1336 . 15 1 1 A 113 113 ALA N N 113 119.980 120.567 -0.587 1
1 1337 . 15 1 1 A 114 114 GLU H H 114 8.093 8.199 -0.106 1
1 1338 . 15 1 1 A 114 114 GLU HA H 114 3.936 3.975 -0.039 1
1 1343 . 15 1 1 A 114 114 GLU C C 114 180.586 179.092 1.494 1
1 1344 . 15 1 1 A 114 114 GLU CA C 114 59.148 58.965 0.183 1
1 1345 . 15 1 1 A 114 114 GLU CB C 114 30.080 29.783 0.297 1
1 1347 . 15 1 1 A 114 114 GLU N N 114 117.168 118.065 -0.897 1
1 1348 . 15 1 1 A 115 115 TRP H H 115 7.980 8.533 -0.553 1
1 1349 . 15 1 1 A 115 115 TRP HA H 115 3.775 4.352 -0.577 1
1 1358 . 15 1 1 A 115 115 TRP C C 115 177.714 178.633 -0.919 1
1 1359 . 15 1 1 A 115 115 TRP CA C 115 62.696 60.136 2.560 1
1 1360 . 15 1 1 A 115 115 TRP CB C 115 29.052 28.716 0.336 1
1 1366 . 15 1 1 A 115 115 TRP N N 115 120.974 120.633 0.341 1
1 1368 . 15 1 1 A 116 116 ILE H H 116 8.297 8.411 -0.114 1
1 1369 . 15 1 1 A 116 116 ILE HA H 116 3.270 3.661 -0.391 1
1 1379 . 15 1 1 A 116 116 ILE C C 116 177.568 177.927 -0.359 1
1 1380 . 15 1 1 A 116 116 ILE CA C 116 66.643 64.214 2.429 1
1 1381 . 15 1 1 A 116 116 ILE CB C 116 37.606 37.421 0.185 1
1 1385 . 15 1 1 A 116 116 ILE N N 116 118.408 120.738 -2.330 1
1 1386 . 15 1 1 A 117 117 GLU H H 117 8.026 8.558 -0.532 1
1 1387 . 15 1 1 A 117 117 GLU HA H 117 3.880 3.962 -0.082 1
1 1392 . 15 1 1 A 117 117 GLU C C 117 178.476 179.112 -0.636 1
1 1393 . 15 1 1 A 117 117 GLU CA C 117 59.219 59.660 -0.441 1
1 1394 . 15 1 1 A 117 117 GLU CB C 117 29.381 29.313 0.068 1
1 1396 . 15 1 1 A 117 117 GLU N N 117 117.096 120.272 -3.176 1
1 1397 . 15 1 1 A 118 118 ALA H H 118 7.555 7.746 -0.191 1
1 1398 . 15 1 1 A 118 118 ALA HA H 118 3.952 4.047 -0.095 1
1 1402 . 15 1 1 A 118 118 ALA C C 118 179.862 179.954 -0.092 1
1 1403 . 15 1 1 A 118 118 ALA CA C 118 54.772 55.049 -0.277 1
1 1404 . 15 1 1 A 118 118 ALA CB C 118 18.277 18.549 -0.272 1
1 1405 . 15 1 1 A 118 118 ALA N N 118 119.817 121.993 -2.176 1
1 1406 . 15 1 1 A 119 119 ILE H H 119 8.167 7.833 0.334 1
1 1407 . 15 1 1 A 119 119 ILE HA H 119 3.558 3.758 -0.200 1
1 1417 . 15 1 1 A 119 119 ILE C C 119 178.564 177.969 0.595 1
1 1418 . 15 1 1 A 119 119 ILE CA C 119 65.766 65.290 0.476 1
1 1419 . 15 1 1 A 119 119 ILE CB C 119 38.840 37.805 1.035 1
1 1423 . 15 1 1 A 119 119 ILE N N 119 116.280 118.012 -1.732 1
1 1424 . 15 1 1 A 120 120 LYS H H 120 8.790 8.089 0.701 1
1 1425 . 15 1 1 A 120 120 LYS HA H 120 3.965 4.244 -0.279 1
1 1434 . 15 1 1 A 120 120 LYS C C 120 179.673 179.286 0.387 1
1 1435 . 15 1 1 A 120 120 LYS CA C 120 60.031 60.211 -0.180 1
1 1436 . 15 1 1 A 120 120 LYS CB C 120 32.547 32.283 0.264 1
1 1440 . 15 1 1 A 120 120 LYS N N 120 119.650 118.973 0.677 1
1 1441 . 15 1 1 A 121 121 LYS H H 121 7.594 8.213 -0.619 1
1 1442 . 15 1 1 A 121 121 LYS HA H 121 4.095 3.935 0.160 1
1 1451 . 15 1 1 A 121 121 LYS C C 121 177.962 179.129 -1.167 1
1 1452 . 15 1 1 A 121 121 LYS CA C 121 58.848 59.610 -0.762 1
1 1453 . 15 1 1 A 121 121 LYS CB C 121 32.547 32.310 0.237 1
1 1457 . 15 1 1 A 121 121 LYS N N 121 117.197 119.488 -2.291 1
1 1458 . 15 1 1 A 122 122 LEU H H 122 7.586 7.829 -0.243 1
1 1459 . 15 1 1 A 122 122 LEU HA H 122 4.535 3.949 0.586 1
1 1469 . 15 1 1 A 122 122 LEU C C 122 177.902 177.332 0.570 1
1 1470 . 15 1 1 A 122 122 LEU CA C 122 55.071 58.035 -2.964 1
1 1471 . 15 1 1 A 122 122 LEU CB C 122 42.888 42.088 0.800 1
1 1475 . 15 1 1 A 122 122 LEU N N 122 116.861 119.948 -3.087 1
1 1476 . 15 1 1 A 123 123 THR H H 123 7.636 7.665 -0.029 1
1 1477 . 15 1 1 A 123 123 THR HA H 123 4.445 4.336 0.109 1
1 1482 . 15 1 1 A 123 123 THR C C 123 175.714 174.104 1.610 1
1 1483 . 15 1 1 A 123 123 THR CA C 123 62.643 61.314 1.329 1
1 1484 . 15 1 1 A 123 123 THR CB C 123 70.259 70.531 -0.272 1
1 1486 . 15 1 1 A 123 123 THR N N 123 108.963 111.792 -2.829 1
1 1487 . 15 1 1 A 124 124 SER H H 124 7.912 8.619 -0.707 1
1 1488 . 15 1 1 A 124 124 SER HA H 124 4.626 4.600 0.026 1
1 1491 . 15 1 1 A 124 124 SER C C 124 174.405 174.951 -0.546 1
1 1492 . 15 1 1 A 124 124 SER CA C 124 58.390 58.258 0.132 1
1 1493 . 15 1 1 A 124 124 SER CB C 124 64.255 63.352 0.903 1
1 1494 . 15 1 1 A 124 124 SER N N 124 116.876 116.101 0.775 1
1 1495 . 15 1 1 A 125 125 GLY H H 125 8.307 8.562 -0.255 1
1 1496 . 15 1 1 A 125 125 GLY HA2 H 125 4.166 4.228 -0.062 1
1 1497 . 15 1 1 A 125 125 GLY HA3 H 125 4.166 4.229 -0.063 1
1 1498 . 15 1 1 A 125 125 GLY C C 125 171.921 171.981 -0.060 1
1 1499 . 15 1 1 A 125 125 GLY CA C 125 44.748 45.117 -0.369 1
1 1500 . 15 1 1 A 125 125 GLY N N 125 110.006 111.719 -1.713 1
1 1501 . 15 1 1 A 126 126 PRO HA H 126 4.510 4.777 -0.267 1
1 1508 . 15 1 1 A 126 126 PRO C C 126 177.471 175.364 2.107 1
1 1509 . 15 1 1 A 126 126 PRO CA C 126 63.419 62.527 0.892 1
1 1510 . 15 1 1 A 126 126 PRO CB C 126 32.106 32.962 -0.856 1
1 1513 . 15 1 1 A 127 127 SER H H 127 8.607 8.570 0.037 1
1 1514 . 15 1 1 A 127 127 SER C C 127 174.628 173.955 0.673 1
1 1515 . 15 1 1 A 127 127 SER CA C 127 58.513 57.780 0.733 1
1 1516 . 15 1 1 A 127 127 SER CB C 127 63.679 66.450 -2.771 1
1 1517 . 15 1 1 A 127 127 SER N N 127 116.390 117.124 -0.734 1
1 1518 . 15 1 1 A 128 128 SER H H 128 8.272 8.695 -0.423 1
1 1519 . 15 1 1 A 128 128 SER HA H 128 4.496 4.140 0.356 1
1 1520 . 15 1 1 A 128 128 SER C C 128 173.921 174.434 -0.513 1
1 1521 . 15 1 1 A 128 128 SER CA C 128 58.442 59.123 -0.681 1
1 1522 . 15 1 1 A 128 128 SER CB C 128 64.173 62.071 2.102 1
1 1523 . 15 1 1 A 128 128 SER N N 128 117.506 116.460 1.046 1
1 1 . 16 1 1 A 7 7 GLY HA2 H 7 3.978 4.060 -0.082 1
1 2 . 16 1 1 A 7 7 GLY HA3 H 7 3.978 4.061 -0.083 1
1 3 . 16 1 1 A 7 7 GLY C C 7 174.274 174.721 -0.447 1
1 4 . 16 1 1 A 7 7 GLY CA C 7 45.383 46.255 -0.872 1
1 5 . 16 1 1 A 8 8 SER H H 8 8.211 7.805 0.406 1
1 6 . 16 1 1 A 8 8 SER HA H 8 4.425 4.612 -0.187 1
1 9 . 16 1 1 A 8 8 SER C C 8 174.635 175.030 -0.395 1
1 10 . 16 1 1 A 8 8 SER CA C 8 58.425 58.184 0.241 1
1 11 . 16 1 1 A 8 8 SER CB C 8 63.885 64.937 -1.052 1
1 12 . 16 1 1 A 8 8 SER N N 8 115.732 113.173 2.559 1
1 13 . 16 1 1 A 9 9 LEU H H 9 8.316 8.067 0.249 1
1 14 . 16 1 1 A 9 9 LEU HA H 9 4.334 4.128 0.206 1
1 24 . 16 1 1 A 9 9 LEU C C 9 177.447 175.293 2.154 1
1 25 . 16 1 1 A 9 9 LEU CA C 9 55.407 55.588 -0.181 1
1 26 . 16 1 1 A 9 9 LEU CB C 9 42.171 41.109 1.062 1
1 30 . 16 1 1 A 9 9 LEU N N 9 123.943 119.681 4.262 1
1 31 . 16 1 1 A 10 10 SER H H 10 8.304 8.284 0.020 1
1 32 . 16 1 1 A 10 10 SER HA H 10 4.424 4.927 -0.503 1
1 35 . 16 1 1 A 10 10 SER C C 10 175.025 173.416 1.609 1
1 36 . 16 1 1 A 10 10 SER CA C 10 58.425 57.178 1.247 1
1 37 . 16 1 1 A 10 10 SER CB C 10 63.638 67.107 -3.469 1
1 38 . 16 1 1 A 10 10 SER N N 10 116.718 120.326 -3.608 1
1 39 . 16 1 1 A 11 11 THR H H 11 8.003 8.687 -0.684 1
1 40 . 16 1 1 A 11 11 THR HA H 11 4.196 4.185 0.011 1
1 45 . 16 1 1 A 11 11 THR C C 11 176.296 173.836 2.460 1
1 46 . 16 1 1 A 11 11 THR CA C 11 62.483 64.026 -1.543 1
1 47 . 16 1 1 A 11 11 THR CB C 11 69.266 67.612 1.654 1
1 49 . 16 1 1 A 11 11 THR N N 11 114.902 112.621 2.281 1
1 50 . 16 1 1 A 12 12 VAL H H 12 8.095 8.384 -0.289 1
1 51 . 16 1 1 A 12 12 VAL HA H 12 3.826 4.215 -0.389 1
1 59 . 16 1 1 A 12 12 VAL C C 12 178.501 176.935 1.566 1
1 60 . 16 1 1 A 12 12 VAL CA C 12 64.760 63.409 1.351 1
1 61 . 16 1 1 A 12 12 VAL CB C 12 32.013 34.129 -2.116 1
1 64 . 16 1 1 A 12 12 VAL N N 12 122.111 123.136 -1.025 1
1 65 . 16 1 1 A 13 13 GLU H H 13 8.151 8.449 -0.298 1
1 66 . 16 1 1 A 13 13 GLU HA H 13 3.244 3.456 -0.212 1
1 71 . 16 1 1 A 13 13 GLU C C 13 175.702 178.599 -2.897 1
1 72 . 16 1 1 A 13 13 GLU CA C 13 58.354 58.960 -0.606 1
1 73 . 16 1 1 A 13 13 GLU CB C 13 28.843 28.685 0.158 1
1 75 . 16 1 1 A 13 13 GLU N N 13 120.316 121.449 -1.133 1
1 76 . 16 1 1 A 14 14 LEU H H 14 7.067 7.815 -0.748 1
1 77 . 16 1 1 A 14 14 LEU HA H 14 4.157 4.117 0.040 1
1 87 . 16 1 1 A 14 14 LEU C C 14 176.863 177.494 -0.631 1
1 88 . 16 1 1 A 14 14 LEU CA C 14 53.324 55.366 -2.042 1
1 89 . 16 1 1 A 14 14 LEU CB C 14 41.636 41.427 0.209 1
1 93 . 16 1 1 A 14 14 LEU N N 14 117.035 119.765 -2.730 1
1 94 . 16 1 1 A 15 15 SER H H 15 7.645 7.953 -0.308 1
1 95 . 16 1 1 A 15 15 SER HA H 15 4.305 4.586 -0.281 1
1 98 . 16 1 1 A 15 15 SER C C 15 175.340 174.518 0.822 1
1 99 . 16 1 1 A 15 15 SER CA C 15 59.783 57.810 1.973 1
1 100 . 16 1 1 A 15 15 SER CB C 15 64.625 63.418 1.207 1
1 101 . 16 1 1 A 15 15 SER N N 15 114.216 114.100 0.116 1
1 102 . 16 1 1 A 16 16 GLY H H 16 8.506 7.991 0.515 1
1 103 . 16 1 1 A 16 16 GLY HA2 H 16 4.237 4.061 0.176 1
1 104 . 16 1 1 A 16 16 GLY HA3 H 16 3.927 4.084 -0.157 1
1 105 . 16 1 1 A 16 16 GLY C C 16 173.661 172.682 0.979 1
1 106 . 16 1 1 A 16 16 GLY CA C 16 44.995 44.493 0.502 1
1 107 . 16 1 1 A 16 16 GLY N N 16 111.838 109.576 2.262 1
1 108 . 16 1 1 A 17 17 THR H H 17 8.482 9.534 -1.052 1
1 109 . 16 1 1 A 17 17 THR HA H 17 4.319 4.490 -0.171 1
1 114 . 16 1 1 A 17 17 THR C C 17 174.758 174.341 0.417 1
1 115 . 16 1 1 A 17 17 THR CA C 17 62.272 63.581 -1.309 1
1 116 . 16 1 1 A 17 17 THR CB C 17 70.706 69.172 1.534 1
1 118 . 16 1 1 A 17 17 THR N N 17 116.679 114.967 1.712 1
1 119 . 16 1 1 A 18 18 VAL H H 18 8.948 8.789 0.159 1
1 120 . 16 1 1 A 18 18 VAL HA H 18 3.950 4.433 -0.483 1
1 128 . 16 1 1 A 18 18 VAL C C 18 176.669 176.870 -0.201 1
1 129 . 16 1 1 A 18 18 VAL CA C 18 64.813 63.606 1.207 1
1 130 . 16 1 1 A 18 18 VAL CB C 18 31.807 31.605 0.202 1
1 133 . 16 1 1 A 18 18 VAL N N 18 127.156 127.439 -0.283 1
1 134 . 16 1 1 A 19 19 VAL H H 19 9.359 9.349 0.010 1
1 135 . 16 1 1 A 19 19 VAL HA H 19 4.234 4.390 -0.156 1
1 143 . 16 1 1 A 19 19 VAL C C 19 175.738 175.818 -0.080 1
1 144 . 16 1 1 A 19 19 VAL CA C 19 62.060 62.083 -0.023 1
1 145 . 16 1 1 A 19 19 VAL CB C 19 33.822 33.462 0.360 1
1 148 . 16 1 1 A 19 19 VAL N N 19 125.162 121.512 3.650 1
1 149 . 16 1 1 A 20 20 LYS H H 20 7.584 7.283 0.301 1
1 150 . 16 1 1 A 20 20 LYS HA H 20 4.346 4.575 -0.229 1
1 159 . 16 1 1 A 20 20 LYS C C 20 172.818 174.106 -1.288 1
1 160 . 16 1 1 A 20 20 LYS CA C 20 56.801 55.515 1.286 1
1 161 . 16 1 1 A 20 20 LYS CB C 20 36.624 35.527 1.097 1
1 165 . 16 1 1 A 20 20 LYS N N 20 121.024 121.048 -0.024 1
1 166 . 16 1 1 A 21 21 GLN H H 21 8.625 8.562 0.063 1
1 167 . 16 1 1 A 21 21 GLN HA H 21 6.003 5.454 0.549 1
1 174 . 16 1 1 A 21 21 GLN C C 21 174.914 174.422 0.492 1
1 175 . 16 1 1 A 21 21 GLN CA C 21 54.207 54.410 -0.203 1
1 176 . 16 1 1 A 21 21 GLN CB C 21 33.452 32.606 0.846 1
1 178 . 16 1 1 A 21 21 GLN N N 21 122.108 122.698 -0.590 1
1 180 . 16 1 1 A 22 22 GLY H H 22 8.964 8.252 0.712 1
1 181 . 16 1 1 A 22 22 GLY HA2 H 22 4.665 4.351 0.314 1
1 182 . 16 1 1 A 22 22 GLY HA3 H 22 4.295 4.546 -0.251 1
1 183 . 16 1 1 A 22 22 GLY C C 22 170.879 171.903 -1.024 1
1 184 . 16 1 1 A 22 22 GLY CA C 22 45.683 45.419 0.264 1
1 185 . 16 1 1 A 22 22 GLY N N 22 108.508 106.759 1.749 1
1 186 . 16 1 1 A 23 23 TYR H H 23 9.145 8.743 0.402 1
1 187 . 16 1 1 A 23 23 TYR HA H 23 5.595 5.546 0.049 1
1 194 . 16 1 1 A 23 23 TYR C C 23 175.824 174.960 0.864 1
1 195 . 16 1 1 A 23 23 TYR CA C 23 58.019 56.745 1.274 1
1 196 . 16 1 1 A 23 23 TYR CB C 23 39.251 40.612 -1.361 1
1 201 . 16 1 1 A 23 23 TYR N N 23 120.809 120.537 0.272 1
1 202 . 16 1 1 A 24 24 LEU H H 24 8.935 9.391 -0.456 1
1 203 . 16 1 1 A 24 24 LEU HA H 24 4.716 5.067 -0.351 1
1 213 . 16 1 1 A 24 24 LEU C C 24 174.648 176.260 -1.612 1
1 214 . 16 1 1 A 24 24 LEU CA C 24 53.907 53.357 0.550 1
1 215 . 16 1 1 A 24 24 LEU CB C 24 46.078 44.275 1.803 1
1 219 . 16 1 1 A 24 24 LEU N N 24 122.887 124.562 -1.675 1
1 220 . 16 1 1 A 25 25 ALA H H 25 8.145 8.675 -0.530 1
1 221 . 16 1 1 A 25 25 ALA HA H 25 5.477 5.591 -0.114 1
1 225 . 16 1 1 A 25 25 ALA C C 25 175.751 176.477 -0.726 1
1 226 . 16 1 1 A 25 25 ALA CA C 25 50.719 50.460 0.259 1
1 227 . 16 1 1 A 25 25 ALA CB C 25 21.074 21.453 -0.379 1
1 228 . 16 1 1 A 25 25 ALA N N 25 122.280 122.870 -0.590 1
1 229 . 16 1 1 A 26 26 LYS H H 26 9.167 9.120 0.047 1
1 230 . 16 1 1 A 26 26 LYS HA H 26 5.221 4.629 0.592 1
1 239 . 16 1 1 A 26 26 LYS C C 26 175.421 175.352 0.069 1
1 240 . 16 1 1 A 26 26 LYS CA C 26 54.383 55.360 -0.977 1
1 241 . 16 1 1 A 26 26 LYS CB C 26 36.125 33.975 2.150 1
1 245 . 16 1 1 A 26 26 LYS N N 26 120.638 123.153 -2.515 1
1 246 . 16 1 1 A 27 27 GLN H H 27 7.866 7.957 -0.091 1
1 247 . 16 1 1 A 27 27 GLN HA H 27 3.525 4.051 -0.526 1
1 254 . 16 1 1 A 27 27 GLN C C 27 177.022 174.519 2.503 1
1 255 . 16 1 1 A 27 27 GLN CA C 27 55.778 53.671 2.107 1
1 256 . 16 1 1 A 27 27 GLN CB C 27 29.864 28.820 1.044 1
1 258 . 16 1 1 A 27 27 GLN N N 27 130.194 122.416 7.778 1
1 260 . 16 1 1 A 28 28 GLY H H 28 8.565 8.058 0.507 1
1 261 . 16 1 1 A 28 28 GLY HA2 H 28 4.125 4.053 0.072 1
1 262 . 16 1 1 A 28 28 GLY HA3 H 28 4.034 4.076 -0.042 1
1 263 . 16 1 1 A 28 28 GLY C C 28 174.030 172.957 1.073 1
1 264 . 16 1 1 A 28 28 GLY CA C 28 45.665 45.494 0.171 1
1 265 . 16 1 1 A 28 28 GLY N N 28 115.528 112.470 3.058 1
1 266 . 16 1 1 A 29 29 HIS HA H 29 4.355 4.706 -0.351 1
1 271 . 16 1 1 A 29 29 HIS CA C 29 58.795 56.185 2.610 1
1 272 . 16 1 1 A 29 29 HIS CB C 29 31.283 33.018 -1.735 1
1 275 . 16 1 1 A 30 30 LYS HA H 30 4.096 4.205 -0.109 1
1 284 . 16 1 1 A 30 30 LYS CA C 30 57.290 57.166 0.124 1
1 285 . 16 1 1 A 30 30 LYS CB C 30 31.951 31.550 0.401 1
1 289 . 16 1 1 A 31 31 ARG HA H 31 3.975 4.542 -0.567 1
1 296 . 16 1 1 A 31 31 ARG CA C 31 55.973 55.744 0.229 1
1 297 . 16 1 1 A 31 31 ARG CB C 31 29.902 29.306 0.596 1
1 300 . 16 1 1 A 32 32 LYS HA H 32 4.160 4.528 -0.368 1
1 309 . 16 1 1 A 32 32 LYS C C 32 175.678 175.117 0.561 1
1 310 . 16 1 1 A 32 32 LYS CA C 32 56.254 57.827 -1.573 1
1 311 . 16 1 1 A 32 32 LYS CB C 32 31.602 34.372 -2.770 1
1 315 . 16 1 1 A 33 33 ASN H H 33 7.925 7.880 0.045 1
1 316 . 16 1 1 A 33 33 ASN HA H 33 4.799 5.224 -0.425 1
1 321 . 16 1 1 A 33 33 ASN C C 33 174.005 174.463 -0.458 1
1 322 . 16 1 1 A 33 33 ASN CA C 33 52.407 51.918 0.489 1
1 323 . 16 1 1 A 33 33 ASN CB C 33 39.879 41.795 -1.916 1
1 324 . 16 1 1 A 33 33 ASN N N 33 116.990 115.186 1.804 1
1 326 . 16 1 1 A 34 34 TRP H H 34 8.798 8.797 0.001 1
1 327 . 16 1 1 A 34 34 TRP HA H 34 4.755 4.854 -0.099 1
1 336 . 16 1 1 A 34 34 TRP C C 34 176.090 176.732 -0.642 1
1 337 . 16 1 1 A 34 34 TRP CA C 34 57.119 57.902 -0.783 1
1 338 . 16 1 1 A 34 34 TRP CB C 34 30.596 30.014 0.582 1
1 344 . 16 1 1 A 34 34 TRP N N 34 121.917 120.047 1.870 1
1 346 . 16 1 1 A 35 35 LYS H H 35 8.404 8.890 -0.486 1
1 347 . 16 1 1 A 35 35 LYS HA H 35 4.846 4.996 -0.150 1
1 354 . 16 1 1 A 35 35 LYS C C 35 176.088 175.746 0.342 1
1 355 . 16 1 1 A 35 35 LYS CA C 35 54.418 55.010 -0.592 1
1 356 . 16 1 1 A 35 35 LYS CB C 35 36.125 35.911 0.214 1
1 360 . 16 1 1 A 35 35 LYS N N 35 120.864 119.896 0.968 1
1 361 . 16 1 1 A 36 36 VAL H H 36 8.977 8.849 0.128 1
1 362 . 16 1 1 A 36 36 VAL HA H 36 4.274 4.613 -0.339 1
1 370 . 16 1 1 A 36 36 VAL C C 36 176.733 175.386 1.347 1
1 371 . 16 1 1 A 36 36 VAL CA C 36 64.319 62.969 1.350 1
1 372 . 16 1 1 A 36 36 VAL CB C 36 31.602 31.385 0.217 1
1 375 . 16 1 1 A 36 36 VAL N N 36 124.314 125.129 -0.815 1
1 376 . 16 1 1 A 37 37 ARG H H 37 9.498 10.213 -0.715 1
1 377 . 16 1 1 A 37 37 ARG HA H 37 5.053 5.247 -0.194 1
1 384 . 16 1 1 A 37 37 ARG C C 37 174.442 174.572 -0.130 1
1 385 . 16 1 1 A 37 37 ARG CA C 37 53.272 54.070 -0.798 1
1 386 . 16 1 1 A 37 37 ARG CB C 37 34.563 34.032 0.531 1
1 389 . 16 1 1 A 37 37 ARG N N 37 128.121 129.236 -1.115 1
1 390 . 16 1 1 A 38 38 ARG H H 38 8.755 8.600 0.155 1
1 391 . 16 1 1 A 38 38 ARG HA H 38 4.626 4.576 0.050 1
1 398 . 16 1 1 A 38 38 ARG C C 38 175.514 175.280 0.234 1
1 399 . 16 1 1 A 38 38 ARG CA C 38 55.601 55.040 0.561 1
1 400 . 16 1 1 A 38 38 ARG CB C 38 32.219 30.945 1.274 1
1 403 . 16 1 1 A 38 38 ARG N N 38 121.442 125.925 -4.483 1
1 404 . 16 1 1 A 39 39 PHE H H 39 9.865 8.930 0.935 1
1 405 . 16 1 1 A 39 39 PHE HA H 39 5.424 5.266 0.158 1
1 413 . 16 1 1 A 39 39 PHE C C 39 175.423 174.567 0.856 1
1 414 . 16 1 1 A 39 39 PHE CA C 39 57.419 56.541 0.878 1
1 415 . 16 1 1 A 39 39 PHE CB C 39 42.623 42.028 0.595 1
1 421 . 16 1 1 A 39 39 PHE N N 39 130.027 126.256 3.771 1
1 422 . 16 1 1 A 40 40 VAL H H 40 9.300 10.255 -0.955 1
1 423 . 16 1 1 A 40 40 VAL HA H 40 4.846 5.218 -0.372 1
1 431 . 16 1 1 A 40 40 VAL C C 40 174.477 173.214 1.263 1
1 432 . 16 1 1 A 40 40 VAL CA C 40 62.343 60.353 1.990 1
1 433 . 16 1 1 A 40 40 VAL CB C 40 35.755 35.703 0.052 1
1 436 . 16 1 1 A 40 40 VAL N N 40 119.369 120.382 -1.013 1
1 437 . 16 1 1 A 41 41 LEU H H 41 9.557 10.204 -0.647 1
1 438 . 16 1 1 A 41 41 LEU HA H 41 5.292 5.447 -0.155 1
1 448 . 16 1 1 A 41 41 LEU C C 41 174.632 175.287 -0.655 1
1 449 . 16 1 1 A 41 41 LEU CA C 41 53.571 53.821 -0.250 1
1 450 . 16 1 1 A 41 41 LEU CB C 41 45.337 44.259 1.078 1
1 454 . 16 1 1 A 41 41 LEU N N 41 132.121 129.668 2.453 1
1 455 . 16 1 1 A 42 42 ARG H H 42 9.396 9.218 0.178 1
1 456 . 16 1 1 A 42 42 ARG HA H 42 5.366 5.333 0.033 1
1 464 . 16 1 1 A 42 42 ARG C C 42 173.997 175.165 -1.168 1
1 465 . 16 1 1 A 42 42 ARG CA C 42 54.631 54.255 0.376 1
1 466 . 16 1 1 A 42 42 ARG CB C 42 35.550 33.812 1.738 1
1 469 . 16 1 1 A 42 42 ARG N N 42 128.120 125.374 2.746 1
1 471 . 16 1 1 A 43 43 LYS H H 43 8.597 8.776 -0.179 1
1 472 . 16 1 1 A 43 43 LYS HA H 43 4.558 4.977 -0.419 1
1 481 . 16 1 1 A 43 43 LYS C C 43 174.648 175.301 -0.653 1
1 482 . 16 1 1 A 43 43 LYS CA C 43 53.378 54.916 -1.538 1
1 483 . 16 1 1 A 43 43 LYS CB C 43 37.303 35.828 1.475 1
1 487 . 16 1 1 A 43 43 LYS N N 43 114.484 118.309 -3.825 1
1 488 . 16 1 1 A 44 44 ASP H H 44 8.388 9.061 -0.673 1
1 489 . 16 1 1 A 44 44 ASP HA H 44 4.349 4.297 0.052 1
1 492 . 16 1 1 A 44 44 ASP C C 44 173.376 174.276 -0.900 1
1 493 . 16 1 1 A 44 44 ASP CA C 44 54.842 54.972 -0.130 1
1 494 . 16 1 1 A 44 44 ASP CB C 44 39.991 39.630 0.361 1
1 495 . 16 1 1 A 44 44 ASP N N 44 115.453 119.397 -3.944 1
1 496 . 16 1 1 A 45 45 PRO HA H 45 4.652 4.637 0.015 1
1 503 . 16 1 1 A 45 45 PRO C C 45 176.914 175.540 1.374 1
1 504 . 16 1 1 A 45 45 PRO CA C 45 63.490 62.660 0.830 1
1 505 . 16 1 1 A 45 45 PRO CB C 45 34.892 32.715 2.177 1
1 508 . 16 1 1 A 46 46 ALA H H 46 8.112 8.461 -0.349 1
1 509 . 16 1 1 A 46 46 ALA HA H 46 5.455 4.703 0.752 1
1 513 . 16 1 1 A 46 46 ALA C C 46 177.234 176.928 0.306 1
1 514 . 16 1 1 A 46 46 ALA CA C 46 51.560 50.887 0.673 1
1 515 . 16 1 1 A 46 46 ALA CB C 46 20.122 19.774 0.348 1
1 516 . 16 1 1 A 46 46 ALA N N 46 120.155 123.503 -3.348 1
1 517 . 16 1 1 A 47 47 PHE H H 47 8.717 9.074 -0.357 1
1 518 . 16 1 1 A 47 47 PHE HA H 47 4.795 5.170 -0.375 1
1 526 . 16 1 1 A 47 47 PHE C C 47 172.588 174.339 -1.751 1
1 527 . 16 1 1 A 47 47 PHE CA C 47 57.348 56.139 1.209 1
1 528 . 16 1 1 A 47 47 PHE CB C 47 47.123 44.090 3.033 1
1 534 . 16 1 1 A 47 47 PHE N N 47 129.946 120.474 9.472 1
1 535 . 16 1 1 A 48 48 LEU H H 48 7.883 8.483 -0.600 1
1 536 . 16 1 1 A 48 48 LEU HA H 48 5.198 5.203 -0.005 1
1 546 . 16 1 1 A 48 48 LEU C C 48 173.569 174.475 -0.906 1
1 547 . 16 1 1 A 48 48 LEU CA C 48 53.290 53.855 -0.565 1
1 548 . 16 1 1 A 48 48 LEU CB C 48 45.502 45.180 0.322 1
1 552 . 16 1 1 A 48 48 LEU N N 48 121.108 122.054 -0.946 1
1 553 . 16 1 1 A 49 49 HIS H H 49 8.606 9.148 -0.542 1
1 554 . 16 1 1 A 49 49 HIS HA H 49 5.035 5.306 -0.271 1
1 559 . 16 1 1 A 49 49 HIS C C 49 173.993 174.003 -0.010 1
1 560 . 16 1 1 A 49 49 HIS CA C 49 56.483 54.218 2.265 1
1 561 . 16 1 1 A 49 49 HIS CB C 49 35.919 34.027 1.892 1
1 564 . 16 1 1 A 49 49 HIS N N 49 121.199 125.392 -4.193 1
1 565 . 16 1 1 A 50 50 TYR H H 50 7.777 8.615 -0.838 1
1 566 . 16 1 1 A 50 50 TYR HA H 50 5.695 5.628 0.067 1
1 573 . 16 1 1 A 50 50 TYR C C 50 174.284 172.162 2.122 1
1 574 . 16 1 1 A 50 50 TYR CA C 50 53.430 55.624 -2.194 1
1 575 . 16 1 1 A 50 50 TYR CB C 50 38.552 40.509 -1.957 1
1 580 . 16 1 1 A 50 50 TYR N N 50 114.156 117.554 -3.398 1
1 581 . 16 1 1 A 51 51 TYR H H 51 9.323 9.825 -0.502 1
1 582 . 16 1 1 A 51 51 TYR HA H 51 4.600 4.837 -0.237 1
1 589 . 16 1 1 A 51 51 TYR C C 51 175.352 174.191 1.161 1
1 590 . 16 1 1 A 51 51 TYR CA C 51 57.330 56.108 1.222 1
1 591 . 16 1 1 A 51 51 TYR CB C 51 41.683 42.143 -0.460 1
1 596 . 16 1 1 A 51 51 TYR N N 51 119.100 118.433 0.667 1
1 597 . 16 1 1 A 52 52 ASP H H 52 9.375 8.527 0.848 1
1 598 . 16 1 1 A 52 52 ASP HA H 52 5.064 4.787 0.277 1
1 601 . 16 1 1 A 52 52 ASP C C 52 175.484 176.328 -0.844 1
1 602 . 16 1 1 A 52 52 ASP CA C 52 51.313 51.588 -0.275 1
1 603 . 16 1 1 A 52 52 ASP CB C 52 41.883 41.959 -0.076 1
1 604 . 16 1 1 A 52 52 ASP N N 52 124.636 124.270 0.366 1
1 605 . 16 1 1 A 53 53 PRO HA H 53 4.678 4.467 0.211 1
1 612 . 16 1 1 A 53 53 PRO C C 53 176.781 178.672 -1.891 1
1 613 . 16 1 1 A 53 53 PRO CA C 53 64.054 64.828 -0.774 1
1 614 . 16 1 1 A 53 53 PRO CB C 53 32.589 32.274 0.315 1
1 617 . 16 1 1 A 54 54 SER H H 54 8.685 8.625 0.060 1
1 618 . 16 1 1 A 54 54 SER HA H 54 4.483 4.152 0.331 1
1 621 . 16 1 1 A 54 54 SER C C 54 174.006 175.583 -1.577 1
1 622 . 16 1 1 A 54 54 SER CA C 54 59.378 61.687 -2.309 1
1 623 . 16 1 1 A 54 54 SER CB C 54 64.132 62.837 1.295 1
1 624 . 16 1 1 A 54 54 SER N N 54 113.769 113.104 0.665 1
1 625 . 16 1 1 A 55 55 LYS H H 55 7.706 7.926 -0.220 1
1 626 . 16 1 1 A 55 55 LYS HA H 55 4.580 4.516 0.064 1
1 635 . 16 1 1 A 55 55 LYS C C 55 175.969 175.740 0.229 1
1 636 . 16 1 1 A 55 55 LYS CA C 55 55.160 55.669 -0.509 1
1 637 . 16 1 1 A 55 55 LYS CB C 55 34.069 34.006 0.063 1
1 641 . 16 1 1 A 55 55 LYS N N 55 122.222 118.350 3.872 1
1 642 . 16 1 1 A 56 56 GLU H H 56 8.666 8.719 -0.053 1
1 643 . 16 1 1 A 56 56 GLU HA H 56 4.174 4.788 -0.614 1
1 648 . 16 1 1 A 56 56 GLU C C 56 177.084 174.678 2.406 1
1 649 . 16 1 1 A 56 56 GLU CA C 56 57.099 55.528 1.571 1
1 650 . 16 1 1 A 56 56 GLU CB C 56 29.694 30.504 -0.810 1
1 652 . 16 1 1 A 56 56 GLU N N 56 122.015 119.380 2.635 1
1 653 . 16 1 1 A 57 57 GLU H H 57 8.303 8.467 -0.164 1
1 654 . 16 1 1 A 57 57 GLU HA H 57 4.214 4.906 -0.692 1
1 659 . 16 1 1 A 57 57 GLU CA C 57 56.960 55.113 1.847 1
1 660 . 16 1 1 A 57 57 GLU CB C 57 30.264 33.368 -3.104 1
1 662 . 16 1 1 A 57 57 GLU N N 57 119.884 123.899 -4.015 1
1 663 . 16 1 1 A 58 58 ASN HA H 58 4.768 4.897 -0.129 1
1 668 . 16 1 1 A 58 58 ASN C C 58 174.902 176.043 -1.141 1
1 669 . 16 1 1 A 58 58 ASN CA C 58 52.740 54.217 -1.477 1
1 670 . 16 1 1 A 58 58 ASN CB C 58 38.116 40.049 -1.933 1
1 672 . 16 1 1 A 59 59 ARG H H 59 7.805 7.743 0.062 1
1 673 . 16 1 1 A 59 59 ARG HA H 59 4.762 4.548 0.214 1
1 680 . 16 1 1 A 59 59 ARG CA C 59 53.151 54.877 -1.726 1
1 681 . 16 1 1 A 59 59 ARG CB C 59 31.519 29.912 1.607 1
1 684 . 16 1 1 A 59 59 ARG N N 59 121.060 118.899 2.161 1
1 685 . 16 1 1 A 60 60 PRO HA H 60 3.357 3.564 -0.207 1
1 692 . 16 1 1 A 60 60 PRO C C 60 176.817 176.685 0.132 1
1 693 . 16 1 1 A 60 60 PRO CA C 60 63.031 61.661 1.370 1
1 694 . 16 1 1 A 60 60 PRO CB C 60 31.273 31.963 -0.690 1
1 697 . 16 1 1 A 61 61 VAL H H 61 8.627 8.492 0.135 1
1 698 . 16 1 1 A 61 61 VAL HA H 61 3.966 3.739 0.227 1
1 706 . 16 1 1 A 61 61 VAL C C 61 176.503 176.134 0.369 1
1 707 . 16 1 1 A 61 61 VAL CA C 61 63.154 63.566 -0.412 1
1 708 . 16 1 1 A 61 61 VAL CB C 61 32.048 32.102 -0.054 1
1 711 . 16 1 1 A 61 61 VAL N N 61 119.185 118.779 0.406 1
1 712 . 16 1 1 A 62 62 GLY H H 62 6.715 6.827 -0.112 1
1 713 . 16 1 1 A 62 62 GLY HA2 H 62 3.940 4.006 -0.066 1
1 714 . 16 1 1 A 62 62 GLY HA3 H 62 3.538 4.045 -0.507 1
1 715 . 16 1 1 A 62 62 GLY C C 62 169.983 174.214 -4.231 1
1 716 . 16 1 1 A 62 62 GLY CA C 62 44.465 45.347 -0.882 1
1 717 . 16 1 1 A 62 62 GLY N N 62 105.813 108.113 -2.300 1
1 718 . 16 1 1 A 63 63 GLY H H 63 8.004 8.225 -0.221 1
1 719 . 16 1 1 A 63 63 GLY HA2 H 63 4.095 3.099 0.996 1
1 720 . 16 1 1 A 63 63 GLY HA3 H 63 3.813 4.055 -0.242 1
1 721 . 16 1 1 A 63 63 GLY C C 63 171.870 172.461 -0.591 1
1 722 . 16 1 1 A 63 63 GLY CA C 63 47.148 44.830 2.318 1
1 723 . 16 1 1 A 63 63 GLY N N 63 105.089 110.193 -5.104 1
1 724 . 16 1 1 A 64 64 PHE H H 64 7.967 8.064 -0.097 1
1 725 . 16 1 1 A 64 64 PHE HA H 64 4.934 5.484 -0.550 1
1 733 . 16 1 1 A 64 64 PHE C C 64 173.140 173.835 -0.695 1
1 734 . 16 1 1 A 64 64 PHE CA C 64 55.248 55.502 -0.254 1
1 735 . 16 1 1 A 64 64 PHE CB C 64 40.238 42.003 -1.765 1
1 741 . 16 1 1 A 64 64 PHE N N 64 113.387 116.290 -2.903 1
1 742 . 16 1 1 A 65 65 SER H H 65 8.518 8.975 -0.457 1
1 743 . 16 1 1 A 65 65 SER HA H 65 3.264 3.925 -0.661 1
1 746 . 16 1 1 A 65 65 SER C C 65 176.417 174.129 2.288 1
1 747 . 16 1 1 A 65 65 SER CA C 65 56.819 57.456 -0.637 1
1 748 . 16 1 1 A 65 65 SER CB C 65 63.391 64.661 -1.270 1
1 749 . 16 1 1 A 65 65 SER N N 65 114.674 115.712 -1.038 1
1 750 . 16 1 1 A 66 66 LEU H H 66 7.404 7.599 -0.195 1
1 751 . 16 1 1 A 66 66 LEU HA H 66 4.470 4.424 0.046 1
1 761 . 16 1 1 A 66 66 LEU C C 66 177.993 178.079 -0.086 1
1 762 . 16 1 1 A 66 66 LEU CA C 66 54.242 55.276 -1.034 1
1 763 . 16 1 1 A 66 66 LEU CB C 66 42.787 43.017 -0.230 1
1 767 . 16 1 1 A 66 66 LEU N N 66 123.988 120.699 3.289 1
1 768 . 16 1 1 A 67 67 ARG H H 67 7.865 7.931 -0.066 1
1 769 . 16 1 1 A 67 67 ARG HA H 67 4.175 3.929 0.246 1
1 776 . 16 1 1 A 67 67 ARG C C 67 178.562 178.073 0.489 1
1 777 . 16 1 1 A 67 67 ARG CA C 67 58.143 59.440 -1.297 1
1 778 . 16 1 1 A 67 67 ARG CB C 67 29.052 30.017 -0.965 1
1 781 . 16 1 1 A 67 67 ARG N N 67 122.494 118.475 4.019 1
1 782 . 16 1 1 A 68 68 GLY H H 68 9.398 8.062 1.336 1
1 783 . 16 1 1 A 68 68 GLY HA2 H 68 4.066 3.906 0.160 1
1 784 . 16 1 1 A 68 68 GLY HA3 H 68 3.908 3.907 0.001 1
1 785 . 16 1 1 A 68 68 GLY C C 68 173.982 173.542 0.440 1
1 786 . 16 1 1 A 68 68 GLY CA C 68 46.230 46.446 -0.216 1
1 787 . 16 1 1 A 68 68 GLY N N 68 117.548 107.850 9.698 1
1 788 . 16 1 1 A 69 69 SER H H 69 7.829 7.734 0.095 1
1 789 . 16 1 1 A 69 69 SER HA H 69 4.807 5.242 -0.435 1
1 792 . 16 1 1 A 69 69 SER C C 69 172.854 172.762 0.092 1
1 793 . 16 1 1 A 69 69 SER CA C 69 59.290 57.413 1.877 1
1 794 . 16 1 1 A 69 69 SER CB C 69 65.366 67.581 -2.215 1
1 795 . 16 1 1 A 69 69 SER N N 69 115.188 114.425 0.763 1
1 796 . 16 1 1 A 70 70 LEU H H 70 8.805 8.719 0.086 1
1 797 . 16 1 1 A 70 70 LEU HA H 70 4.846 4.848 -0.002 1
1 807 . 16 1 1 A 70 70 LEU C C 70 175.775 174.198 1.577 1
1 808 . 16 1 1 A 70 70 LEU CA C 70 53.907 54.181 -0.274 1
1 809 . 16 1 1 A 70 70 LEU CB C 70 45.337 46.013 -0.676 1
1 813 . 16 1 1 A 70 70 LEU N N 70 121.265 123.198 -1.933 1
1 814 . 16 1 1 A 71 71 VAL H H 71 8.644 8.907 -0.263 1
1 815 . 16 1 1 A 71 71 VAL HA H 71 5.555 5.353 0.202 1
1 823 . 16 1 1 A 71 71 VAL C C 71 173.636 173.827 -0.191 1
1 824 . 16 1 1 A 71 71 VAL CA C 71 58.760 59.845 -1.085 1
1 825 . 16 1 1 A 71 71 VAL CB C 71 34.891 35.822 -0.931 1
1 828 . 16 1 1 A 71 71 VAL N N 71 122.315 122.645 -0.330 1
1 829 . 16 1 1 A 72 72 SER H H 72 8.750 9.254 -0.504 1
1 830 . 16 1 1 A 72 72 SER HA H 72 4.742 5.071 -0.329 1
1 833 . 16 1 1 A 72 72 SER C C 72 173.058 172.359 0.699 1
1 834 . 16 1 1 A 72 72 SER CA C 72 57.190 56.667 0.523 1
1 835 . 16 1 1 A 72 72 SER CB C 72 65.612 66.519 -0.907 1
1 836 . 16 1 1 A 72 72 SER N N 72 118.611 121.477 -2.866 1
1 837 . 16 1 1 A 73 73 ALA H H 73 9.009 8.911 0.098 1
1 838 . 16 1 1 A 73 73 ALA HA H 73 4.406 5.261 -0.855 1
1 842 . 16 1 1 A 73 73 ALA C C 73 176.708 176.159 0.549 1
1 843 . 16 1 1 A 73 73 ALA CA C 73 52.672 49.987 2.685 1
1 844 . 16 1 1 A 73 73 ALA CB C 73 18.812 21.590 -2.778 1
1 845 . 16 1 1 A 73 73 ALA N N 73 125.694 124.518 1.176 1
1 846 . 16 1 1 A 74 74 LEU H H 74 7.800 8.500 -0.700 1
1 847 . 16 1 1 A 74 74 LEU HA H 74 4.716 4.589 0.127 1
1 857 . 16 1 1 A 74 74 LEU C C 74 176.551 175.990 0.561 1
1 858 . 16 1 1 A 74 74 LEU CA C 74 53.784 54.413 -0.629 1
1 859 . 16 1 1 A 74 74 LEU CB C 74 43.446 40.684 2.762 1
1 863 . 16 1 1 A 74 74 LEU N N 74 122.271 123.595 -1.324 1
1 864 . 16 1 1 A 75 75 GLU H H 75 8.855 8.869 -0.014 1
1 865 . 16 1 1 A 75 75 GLU HA H 75 4.336 5.339 -1.003 1
1 870 . 16 1 1 A 75 75 GLU C C 75 176.465 174.607 1.858 1
1 871 . 16 1 1 A 75 75 GLU CA C 75 56.507 54.973 1.534 1
1 872 . 16 1 1 A 75 75 GLU CB C 75 30.245 31.101 -0.856 1
1 874 . 16 1 1 A 75 75 GLU N N 75 122.678 123.253 -0.575 1
1 875 . 16 1 1 A 76 76 ASP H H 76 8.542 8.691 -0.149 1
1 876 . 16 1 1 A 76 76 ASP HA H 76 4.665 5.002 -0.337 1
1 879 . 16 1 1 A 76 76 ASP C C 76 176.087 174.748 1.339 1
1 880 . 16 1 1 A 76 76 ASP CA C 76 55.107 53.465 1.642 1
1 881 . 16 1 1 A 76 76 ASP CB C 76 41.431 44.350 -2.919 1
1 882 . 16 1 1 A 76 76 ASP N N 76 121.488 122.598 -1.110 1
1 883 . 16 1 1 A 77 77 ASN H H 77 8.322 8.817 -0.495 1
1 884 . 16 1 1 A 77 77 ASN HA H 77 4.729 4.331 0.398 1
1 889 . 16 1 1 A 77 77 ASN C C 77 175.566 176.503 -0.937 1
1 890 . 16 1 1 A 77 77 ASN CA C 77 53.131 55.208 -2.077 1
1 891 . 16 1 1 A 77 77 ASN CB C 77 38.617 37.800 0.817 1
1 892 . 16 1 1 A 77 77 ASN N N 77 118.676 120.705 -2.029 1
1 894 . 16 1 1 A 78 78 GLY H H 78 8.311 8.929 -0.618 1
1 895 . 16 1 1 A 78 78 GLY HA2 H 78 3.897 3.829 0.068 1
1 896 . 16 1 1 A 78 78 GLY HA3 H 78 3.897 3.832 0.065 1
1 897 . 16 1 1 A 78 78 GLY C C 78 173.376 174.135 -0.759 1
1 898 . 16 1 1 A 78 78 GLY CA C 78 45.224 47.400 -2.176 1
1 899 . 16 1 1 A 78 78 GLY N N 78 108.939 114.736 -5.797 1
1 900 . 16 1 1 A 79 79 VAL H H 79 7.882 8.621 -0.739 1
1 901 . 16 1 1 A 79 79 VAL HA H 79 4.345 4.074 0.271 1
1 909 . 16 1 1 A 79 79 VAL CA C 79 59.995 61.368 -1.373 1
1 910 . 16 1 1 A 79 79 VAL CB C 79 32.589 31.849 0.740 1
1 913 . 16 1 1 A 79 79 VAL N N 79 121.135 124.539 -3.404 1
1 914 . 16 1 1 A 80 80 PRO HA H 80 4.461 4.457 0.004 1
1 921 . 16 1 1 A 80 80 PRO C C 80 176.979 177.782 -0.803 1
1 922 . 16 1 1 A 80 80 PRO CA C 80 63.101 66.131 -3.030 1
1 923 . 16 1 1 A 80 80 PRO CB C 80 32.177 31.683 0.494 1
1 926 . 16 1 1 A 81 81 THR H H 81 8.281 7.974 0.307 1
1 927 . 16 1 1 A 81 81 THR HA H 81 4.095 4.555 -0.460 1
1 932 . 16 1 1 A 81 81 THR C C 81 175.270 174.567 0.703 1
1 933 . 16 1 1 A 81 81 THR CA C 81 62.872 63.401 -0.529 1
1 934 . 16 1 1 A 81 81 THR CB C 81 69.642 70.570 -0.928 1
1 936 . 16 1 1 A 81 81 THR N N 81 114.684 110.771 3.913 1
1 937 . 16 1 1 A 82 82 GLY H H 82 8.338 7.976 0.362 1
1 938 . 16 1 1 A 82 82 GLY HA2 H 82 4.095 3.979 0.116 1
1 939 . 16 1 1 A 82 82 GLY HA3 H 82 3.668 4.009 -0.341 1
1 940 . 16 1 1 A 82 82 GLY C C 82 174.139 172.330 1.809 1
1 941 . 16 1 1 A 82 82 GLY CA C 82 45.083 46.176 -1.093 1
1 942 . 16 1 1 A 82 82 GLY N N 82 111.289 107.407 3.882 1
1 943 . 16 1 1 A 83 83 VAL H H 83 7.668 8.069 -0.401 1
1 944 . 16 1 1 A 83 83 VAL HA H 83 3.985 4.645 -0.660 1
1 952 . 16 1 1 A 83 83 VAL C C 83 176.054 176.152 -0.098 1
1 953 . 16 1 1 A 83 83 VAL CA C 83 62.431 60.140 2.291 1
1 954 . 16 1 1 A 83 83 VAL CB C 83 32.260 35.624 -3.364 1
1 957 . 16 1 1 A 83 83 VAL N N 83 120.003 121.269 -1.266 1
1 958 . 16 1 1 A 84 84 LYS H H 84 8.645 9.021 -0.376 1
1 959 . 16 1 1 A 84 84 LYS HA H 84 4.276 3.921 0.355 1
1 968 . 16 1 1 A 84 84 LYS C C 84 176.832 178.471 -1.639 1
1 969 . 16 1 1 A 84 84 LYS CA C 84 56.272 59.740 -3.468 1
1 970 . 16 1 1 A 84 84 LYS CB C 84 32.876 32.463 0.413 1
1 974 . 16 1 1 A 84 84 LYS N N 84 126.447 126.662 -0.215 1
1 975 . 16 1 1 A 85 85 GLY H H 85 8.410 8.159 0.251 1
1 976 . 16 1 1 A 85 85 GLY HA2 H 85 4.066 4.074 -0.008 1
1 977 . 16 1 1 A 85 85 GLY HA3 H 85 3.781 4.080 -0.299 1
1 978 . 16 1 1 A 85 85 GLY C C 85 173.969 174.541 -0.572 1
1 979 . 16 1 1 A 85 85 GLY CA C 85 45.146 44.436 0.710 1
1 980 . 16 1 1 A 85 85 GLY N N 85 109.957 107.471 2.486 1
1 981 . 16 1 1 A 86 86 ASN H H 86 8.298 8.231 0.067 1
1 982 . 16 1 1 A 86 86 ASN HA H 86 4.665 4.972 -0.307 1
1 987 . 16 1 1 A 86 86 ASN C C 86 174.987 176.151 -1.164 1
1 988 . 16 1 1 A 86 86 ASN CA C 86 52.989 51.879 1.110 1
1 989 . 16 1 1 A 86 86 ASN CB C 86 38.376 38.139 0.237 1
1 990 . 16 1 1 A 86 86 ASN N N 86 118.457 118.341 0.116 1
1 992 . 16 1 1 A 87 87 VAL H H 87 7.660 8.424 -0.764 1
1 993 . 16 1 1 A 87 87 VAL HA H 87 3.946 3.789 0.157 1
1 1001 . 16 1 1 A 87 87 VAL C C 87 174.902 176.063 -1.161 1
1 1002 . 16 1 1 A 87 87 VAL CA C 87 62.307 64.719 -2.412 1
1 1003 . 16 1 1 A 87 87 VAL CB C 87 32.548 30.504 2.044 1
1 1006 . 16 1 1 A 87 87 VAL N N 87 120.557 114.545 6.012 1
1 1007 . 16 1 1 A 88 88 GLN H H 88 8.115 8.411 -0.296 1
1 1008 . 16 1 1 A 88 88 GLN HA H 88 4.302 4.581 -0.279 1
1 1015 . 16 1 1 A 88 88 GLN C C 88 175.637 175.068 0.569 1
1 1016 . 16 1 1 A 88 88 GLN CA C 88 55.336 55.653 -0.317 1
1 1017 . 16 1 1 A 88 88 GLN CB C 88 30.574 29.871 0.703 1
1 1019 . 16 1 1 A 88 88 GLN N N 88 122.280 125.950 -3.670 1
1 1021 . 16 1 1 A 89 89 GLY H H 89 8.544 8.487 0.057 1
1 1022 . 16 1 1 A 89 89 GLY HA2 H 89 3.885 4.328 -0.443 1
1 1023 . 16 1 1 A 89 89 GLY HA3 H 89 3.885 4.330 -0.445 1
1 1024 . 16 1 1 A 89 89 GLY C C 89 172.861 174.269 -1.408 1
1 1025 . 16 1 1 A 89 89 GLY CA C 89 44.889 44.157 0.732 1
1 1026 . 16 1 1 A 89 89 GLY N N 89 110.135 108.943 1.192 1
1 1027 . 16 1 1 A 90 90 ASN H H 90 8.451 9.396 -0.945 1
1 1028 . 16 1 1 A 90 90 ASN HA H 90 4.222 4.382 -0.160 1
1 1033 . 16 1 1 A 90 90 ASN C C 90 174.926 174.857 0.069 1
1 1034 . 16 1 1 A 90 90 ASN CA C 90 54.613 55.446 -0.833 1
1 1035 . 16 1 1 A 90 90 ASN CB C 90 37.852 37.128 0.724 1
1 1036 . 16 1 1 A 90 90 ASN N N 90 114.322 118.813 -4.491 1
1 1038 . 16 1 1 A 91 91 LEU H H 91 8.933 8.070 0.863 1
1 1039 . 16 1 1 A 91 91 LEU HA H 91 5.367 4.232 1.135 1
1 1049 . 16 1 1 A 91 91 LEU C C 91 178.732 175.551 3.181 1
1 1050 . 16 1 1 A 91 91 LEU CA C 91 55.160 56.959 -1.799 1
1 1051 . 16 1 1 A 91 91 LEU CB C 91 45.461 40.868 4.593 1
1 1055 . 16 1 1 A 91 91 LEU N N 91 120.057 118.434 1.623 1
1 1056 . 16 1 1 A 92 92 PHE H H 92 9.901 8.019 1.882 1
1 1057 . 16 1 1 A 92 92 PHE HA H 92 5.105 5.093 0.012 1
1 1065 . 16 1 1 A 92 92 PHE C C 92 170.140 172.700 -2.560 1
1 1066 . 16 1 1 A 92 92 PHE CA C 92 56.236 56.106 0.130 1
1 1067 . 16 1 1 A 92 92 PHE CB C 92 42.664 41.357 1.307 1
1 1073 . 16 1 1 A 92 92 PHE N N 92 119.740 116.192 3.548 1
1 1074 . 16 1 1 A 93 93 LYS H H 93 9.154 8.961 0.193 1
1 1075 . 16 1 1 A 93 93 LYS HA H 93 5.584 5.162 0.422 1
1 1083 . 16 1 1 A 93 93 LYS C C 93 174.830 175.204 -0.374 1
1 1084 . 16 1 1 A 93 93 LYS CA C 93 53.148 53.954 -0.806 1
1 1085 . 16 1 1 A 93 93 LYS CB C 93 36.660 36.228 0.432 1
1 1089 . 16 1 1 A 93 93 LYS N N 93 117.710 118.459 -0.749 1
1 1090 . 16 1 1 A 94 94 VAL H H 94 8.507 8.563 -0.056 1
1 1091 . 16 1 1 A 94 94 VAL HA H 94 4.872 5.051 -0.179 1
1 1099 . 16 1 1 A 94 94 VAL C C 94 174.408 175.058 -0.650 1
1 1100 . 16 1 1 A 94 94 VAL CA C 94 60.525 61.615 -1.090 1
1 1101 . 16 1 1 A 94 94 VAL CB C 94 34.862 33.687 1.175 1
1 1104 . 16 1 1 A 94 94 VAL N N 94 121.741 120.732 1.009 1
1 1105 . 16 1 1 A 95 95 ILE H H 95 8.959 9.030 -0.071 1
1 1106 . 16 1 1 A 95 95 ILE HA H 95 4.794 4.634 0.160 1
1 1116 . 16 1 1 A 95 95 ILE C C 95 177.642 176.372 1.270 1
1 1117 . 16 1 1 A 95 95 ILE CA C 95 59.713 60.984 -1.271 1
1 1118 . 16 1 1 A 95 95 ILE CB C 95 40.032 37.303 2.729 1
1 1122 . 16 1 1 A 95 95 ILE N N 95 126.794 128.381 -1.587 1
1 1123 . 16 1 1 A 96 96 THR H H 96 8.765 8.891 -0.126 1
1 1124 . 16 1 1 A 96 96 THR HA H 96 4.584 4.769 -0.185 1
1 1129 . 16 1 1 A 96 96 THR C C 96 177.023 175.569 1.454 1
1 1130 . 16 1 1 A 96 96 THR CA C 96 61.372 60.774 0.598 1
1 1131 . 16 1 1 A 96 96 THR CB C 96 70.794 71.621 -0.827 1
1 1133 . 16 1 1 A 96 96 THR N N 96 117.225 121.162 -3.937 1
1 1134 . 16 1 1 A 97 97 LYS H H 97 8.736 8.984 -0.248 1
1 1135 . 16 1 1 A 97 97 LYS HA H 97 4.101 4.047 0.054 1
1 1144 . 16 1 1 A 97 97 LYS C C 97 176.490 177.553 -1.063 1
1 1145 . 16 1 1 A 97 97 LYS CA C 97 58.583 59.573 -0.990 1
1 1146 . 16 1 1 A 97 97 LYS CB C 97 31.848 32.450 -0.602 1
1 1150 . 16 1 1 A 97 97 LYS N N 97 120.457 122.795 -2.338 1
1 1151 . 16 1 1 A 98 98 ASP H H 98 7.762 7.984 -0.222 1
1 1152 . 16 1 1 A 98 98 ASP HA H 98 4.633 4.794 -0.161 1
1 1155 . 16 1 1 A 98 98 ASP C C 98 175.270 174.614 0.656 1
1 1156 . 16 1 1 A 98 98 ASP CA C 98 53.272 53.965 -0.693 1
1 1157 . 16 1 1 A 98 98 ASP CB C 98 39.909 40.821 -0.912 1
1 1158 . 16 1 1 A 98 98 ASP N N 98 116.281 116.373 -0.092 1
1 1159 . 16 1 1 A 99 99 ASP H H 99 8.340 8.690 -0.350 1
1 1160 . 16 1 1 A 99 99 ASP HA H 99 4.245 4.627 -0.382 1
1 1163 . 16 1 1 A 99 99 ASP C C 99 175.315 175.749 -0.434 1
1 1164 . 16 1 1 A 99 99 ASP CA C 99 55.989 55.622 0.367 1
1 1165 . 16 1 1 A 99 99 ASP CB C 99 39.827 39.132 0.695 1
1 1166 . 16 1 1 A 99 99 ASP N N 99 116.687 116.355 0.332 1
1 1167 . 16 1 1 A 100 100 THR H H 100 7.511 7.848 -0.337 1
1 1168 . 16 1 1 A 100 100 THR HA H 100 4.185 3.815 0.370 1
1 1173 . 16 1 1 A 100 100 THR C C 100 173.376 174.388 -1.012 1
1 1174 . 16 1 1 A 100 100 THR CA C 100 63.489 65.847 -2.358 1
1 1175 . 16 1 1 A 100 100 THR CB C 100 67.909 69.202 -1.293 1
1 1177 . 16 1 1 A 100 100 THR N N 100 116.525 111.486 5.039 1
1 1178 . 16 1 1 A 101 101 HIS H H 101 8.753 8.219 0.534 1
1 1179 . 16 1 1 A 101 101 HIS HA H 101 4.898 4.241 0.657 1
1 1184 . 16 1 1 A 101 101 HIS C C 101 174.345 173.791 0.554 1
1 1185 . 16 1 1 A 101 101 HIS CA C 101 55.072 56.339 -1.267 1
1 1186 . 16 1 1 A 101 101 HIS CB C 101 32.835 27.800 5.035 1
1 1189 . 16 1 1 A 101 101 HIS N N 101 125.953 116.590 9.363 1
1 1190 . 16 1 1 A 102 102 TYR H H 102 9.023 8.530 0.493 1
1 1191 . 16 1 1 A 102 102 TYR HA H 102 4.545 4.947 -0.402 1
1 1198 . 16 1 1 A 102 102 TYR C C 102 174.126 175.001 -0.875 1
1 1199 . 16 1 1 A 102 102 TYR CA C 102 57.260 56.482 0.778 1
1 1200 . 16 1 1 A 102 102 TYR CB C 102 40.381 38.678 1.703 1
1 1205 . 16 1 1 A 102 102 TYR N N 102 121.975 121.249 0.726 1
1 1206 . 16 1 1 A 103 103 TYR H H 103 8.899 8.946 -0.047 1
1 1207 . 16 1 1 A 103 103 TYR HA H 103 4.729 4.765 -0.036 1
1 1214 . 16 1 1 A 103 103 TYR C C 103 174.139 176.067 -1.928 1
1 1215 . 16 1 1 A 103 103 TYR CA C 103 58.036 58.619 -0.583 1
1 1216 . 16 1 1 A 103 103 TYR CB C 103 40.485 39.294 1.191 1
1 1221 . 16 1 1 A 103 103 TYR N N 103 122.012 124.277 -2.265 1
1 1222 . 16 1 1 A 104 104 ILE H H 104 8.605 8.536 0.069 1
1 1223 . 16 1 1 A 104 104 ILE HA H 104 4.859 5.090 -0.231 1
1 1233 . 16 1 1 A 104 104 ILE C C 104 172.769 174.043 -1.274 1
1 1234 . 16 1 1 A 104 104 ILE CA C 104 59.554 59.769 -0.215 1
1 1235 . 16 1 1 A 104 104 ILE CB C 104 40.631 41.946 -1.315 1
1 1239 . 16 1 1 A 104 104 ILE N N 104 123.443 123.109 0.334 1
1 1240 . 16 1 1 A 105 105 GLN H H 105 9.369 8.538 0.831 1
1 1241 . 16 1 1 A 105 105 GLN HA H 105 4.895 5.003 -0.108 1
1 1248 . 16 1 1 A 105 105 GLN C C 105 175.642 175.076 0.566 1
1 1249 . 16 1 1 A 105 105 GLN CA C 105 54.965 53.830 1.135 1
1 1250 . 16 1 1 A 105 105 GLN CB C 105 32.856 32.161 0.695 1
1 1252 . 16 1 1 A 105 105 GLN N N 105 125.079 124.248 0.831 1
1 1254 . 16 1 1 A 106 106 ALA H H 106 8.513 8.536 -0.023 1
1 1255 . 16 1 1 A 106 106 ALA HA H 106 4.962 4.835 0.127 1
1 1259 . 16 1 1 A 106 106 ALA C C 106 175.854 178.113 -2.259 1
1 1260 . 16 1 1 A 106 106 ALA CA C 106 50.272 50.705 -0.433 1
1 1261 . 16 1 1 A 106 106 ALA CB C 106 21.197 21.099 0.098 1
1 1262 . 16 1 1 A 106 106 ALA N N 106 129.303 128.766 0.537 1
1 1263 . 16 1 1 A 107 107 SER H H 107 9.468 8.728 0.740 1
1 1264 . 16 1 1 A 107 107 SER HA H 107 4.447 4.339 0.108 1
1 1267 . 16 1 1 A 107 107 SER C C 107 173.785 174.361 -0.576 1
1 1268 . 16 1 1 A 107 107 SER CA C 107 60.048 61.910 -1.862 1
1 1269 . 16 1 1 A 107 107 SER CB C 107 64.643 63.196 1.447 1
1 1270 . 16 1 1 A 107 107 SER N N 107 112.962 116.735 -3.773 1
1 1271 . 16 1 1 A 108 108 SER H H 108 7.555 7.822 -0.267 1
1 1272 . 16 1 1 A 108 108 SER HA H 108 4.665 4.831 -0.166 1
1 1275 . 16 1 1 A 108 108 SER C C 108 174.381 174.119 0.262 1
1 1276 . 16 1 1 A 108 108 SER CA C 108 56.907 56.361 0.546 1
1 1277 . 16 1 1 A 108 108 SER CB C 108 66.370 65.336 1.034 1
1 1278 . 16 1 1 A 108 108 SER N N 108 112.243 113.182 -0.939 1
1 1279 . 16 1 1 A 109 109 LYS H H 109 8.978 9.150 -0.172 1
1 1280 . 16 1 1 A 109 109 LYS HA H 109 4.777 4.037 0.740 1
1 1287 . 16 1 1 A 109 109 LYS C C 109 179.992 178.657 1.335 1
1 1288 . 16 1 1 A 109 109 LYS CA C 109 59.766 59.981 -0.215 1
1 1289 . 16 1 1 A 109 109 LYS CB C 109 32.342 32.139 0.203 1
1 1293 . 16 1 1 A 109 109 LYS N N 109 123.170 126.128 -2.958 1
1 1294 . 16 1 1 A 110 110 ALA H H 110 8.608 8.154 0.454 1
1 1295 . 16 1 1 A 110 110 ALA HA H 110 4.178 4.000 0.178 1
1 1299 . 16 1 1 A 110 110 ALA C C 110 179.895 179.168 0.727 1
1 1300 . 16 1 1 A 110 110 ALA CA C 110 54.871 55.509 -0.638 1
1 1301 . 16 1 1 A 110 110 ALA CB C 110 18.065 18.490 -0.425 1
1 1302 . 16 1 1 A 110 110 ALA N N 110 123.750 122.185 1.565 1
1 1303 . 16 1 1 A 111 111 GLU H H 111 8.185 8.375 -0.190 1
1 1304 . 16 1 1 A 111 111 GLU HA H 111 4.180 3.985 0.195 1
1 1309 . 16 1 1 A 111 111 GLU C C 111 178.587 178.812 -0.225 1
1 1310 . 16 1 1 A 111 111 GLU CA C 111 59.466 59.778 -0.312 1
1 1311 . 16 1 1 A 111 111 GLU CB C 111 31.067 29.417 1.650 1
1 1313 . 16 1 1 A 111 111 GLU N N 111 119.757 118.946 0.811 1
1 1314 . 16 1 1 A 112 112 ARG H H 112 8.008 7.976 0.032 1
1 1315 . 16 1 1 A 112 112 ARG HA H 112 3.642 4.076 -0.434 1
1 1322 . 16 1 1 A 112 112 ARG C C 112 176.481 178.165 -1.684 1
1 1323 . 16 1 1 A 112 112 ARG CA C 112 60.419 59.540 0.879 1
1 1324 . 16 1 1 A 112 112 ARG CB C 112 29.957 30.162 -0.205 1
1 1327 . 16 1 1 A 112 112 ARG N N 112 118.430 119.932 -1.502 1
1 1328 . 16 1 1 A 113 113 ALA H H 113 7.985 7.779 0.206 1
1 1329 . 16 1 1 A 113 113 ALA HA H 113 3.925 4.053 -0.128 1
1 1333 . 16 1 1 A 113 113 ALA C C 113 180.117 180.174 -0.057 1
1 1334 . 16 1 1 A 113 113 ALA CA C 113 55.372 55.188 0.184 1
1 1335 . 16 1 1 A 113 113 ALA CB C 113 17.825 18.387 -0.562 1
1 1336 . 16 1 1 A 113 113 ALA N N 113 119.980 120.656 -0.676 1
1 1337 . 16 1 1 A 114 114 GLU H H 114 8.093 8.235 -0.142 1
1 1338 . 16 1 1 A 114 114 GLU HA H 114 3.936 3.925 0.011 1
1 1343 . 16 1 1 A 114 114 GLU C C 114 180.586 179.150 1.436 1
1 1344 . 16 1 1 A 114 114 GLU CA C 114 59.148 59.339 -0.191 1
1 1345 . 16 1 1 A 114 114 GLU CB C 114 30.080 29.014 1.066 1
1 1347 . 16 1 1 A 114 114 GLU N N 114 117.168 117.443 -0.275 1
1 1348 . 16 1 1 A 115 115 TRP H H 115 7.980 8.970 -0.990 1
1 1349 . 16 1 1 A 115 115 TRP HA H 115 3.775 4.325 -0.550 1
1 1358 . 16 1 1 A 115 115 TRP C C 115 177.714 178.425 -0.711 1
1 1359 . 16 1 1 A 115 115 TRP CA C 115 62.696 59.462 3.234 1
1 1360 . 16 1 1 A 115 115 TRP CB C 115 29.052 29.123 -0.071 1
1 1366 . 16 1 1 A 115 115 TRP N N 115 120.974 120.755 0.219 1
1 1368 . 16 1 1 A 116 116 ILE H H 116 8.297 9.169 -0.872 1
1 1369 . 16 1 1 A 116 116 ILE HA H 116 3.270 3.426 -0.156 1
1 1379 . 16 1 1 A 116 116 ILE C C 116 177.568 177.854 -0.286 1
1 1380 . 16 1 1 A 116 116 ILE CA C 116 66.643 64.822 1.821 1
1 1381 . 16 1 1 A 116 116 ILE CB C 116 37.606 37.436 0.170 1
1 1385 . 16 1 1 A 116 116 ILE N N 116 118.408 119.735 -1.327 1
1 1386 . 16 1 1 A 117 117 GLU H H 117 8.026 9.005 -0.979 1
1 1387 . 16 1 1 A 117 117 GLU HA H 117 3.880 3.974 -0.094 1
1 1392 . 16 1 1 A 117 117 GLU C C 117 178.476 179.101 -0.625 1
1 1393 . 16 1 1 A 117 117 GLU CA C 117 59.219 59.770 -0.551 1
1 1394 . 16 1 1 A 117 117 GLU CB C 117 29.381 29.395 -0.014 1
1 1396 . 16 1 1 A 117 117 GLU N N 117 117.096 120.334 -3.238 1
1 1397 . 16 1 1 A 118 118 ALA H H 118 7.555 8.634 -1.079 1
1 1398 . 16 1 1 A 118 118 ALA HA H 118 3.952 4.060 -0.108 1
1 1402 . 16 1 1 A 118 118 ALA C C 118 179.862 180.007 -0.145 1
1 1403 . 16 1 1 A 118 118 ALA CA C 118 54.772 55.051 -0.279 1
1 1404 . 16 1 1 A 118 118 ALA CB C 118 18.277 18.451 -0.174 1
1 1405 . 16 1 1 A 118 118 ALA N N 118 119.817 122.123 -2.306 1
1 1406 . 16 1 1 A 119 119 ILE H H 119 8.167 8.185 -0.018 1
1 1407 . 16 1 1 A 119 119 ILE HA H 119 3.558 3.726 -0.168 1
1 1417 . 16 1 1 A 119 119 ILE C C 119 178.564 178.033 0.531 1
1 1418 . 16 1 1 A 119 119 ILE CA C 119 65.766 65.112 0.654 1
1 1419 . 16 1 1 A 119 119 ILE CB C 119 38.840 37.816 1.024 1
1 1423 . 16 1 1 A 119 119 ILE N N 119 116.280 118.194 -1.914 1
1 1424 . 16 1 1 A 120 120 LYS H H 120 8.790 8.424 0.366 1
1 1425 . 16 1 1 A 120 120 LYS HA H 120 3.965 4.327 -0.362 1
1 1434 . 16 1 1 A 120 120 LYS C C 120 179.673 179.310 0.363 1
1 1435 . 16 1 1 A 120 120 LYS CA C 120 60.031 60.382 -0.351 1
1 1436 . 16 1 1 A 120 120 LYS CB C 120 32.547 32.231 0.316 1
1 1440 . 16 1 1 A 120 120 LYS N N 120 119.650 118.977 0.673 1
1 1441 . 16 1 1 A 121 121 LYS H H 121 7.594 8.171 -0.577 1
1 1442 . 16 1 1 A 121 121 LYS HA H 121 4.095 3.968 0.127 1
1 1451 . 16 1 1 A 121 121 LYS C C 121 177.962 179.161 -1.199 1
1 1452 . 16 1 1 A 121 121 LYS CA C 121 58.848 59.177 -0.329 1
1 1453 . 16 1 1 A 121 121 LYS CB C 121 32.547 32.247 0.300 1
1 1457 . 16 1 1 A 121 121 LYS N N 121 117.197 119.668 -2.471 1
1 1458 . 16 1 1 A 122 122 LEU H H 122 7.586 7.665 -0.079 1
1 1459 . 16 1 1 A 122 122 LEU HA H 122 4.535 3.997 0.538 1
1 1469 . 16 1 1 A 122 122 LEU C C 122 177.902 177.399 0.503 1
1 1470 . 16 1 1 A 122 122 LEU CA C 122 55.071 58.044 -2.973 1
1 1471 . 16 1 1 A 122 122 LEU CB C 122 42.888 42.092 0.796 1
1 1475 . 16 1 1 A 122 122 LEU N N 122 116.861 119.971 -3.110 1
1 1476 . 16 1 1 A 123 123 THR H H 123 7.636 7.932 -0.296 1
1 1477 . 16 1 1 A 123 123 THR HA H 123 4.445 4.278 0.167 1
1 1482 . 16 1 1 A 123 123 THR C C 123 175.714 175.091 0.623 1
1 1483 . 16 1 1 A 123 123 THR CA C 123 62.643 60.879 1.764 1
1 1484 . 16 1 1 A 123 123 THR CB C 123 70.259 70.981 -0.722 1
1 1486 . 16 1 1 A 123 123 THR N N 123 108.963 112.489 -3.526 1
1 1487 . 16 1 1 A 124 124 SER H H 124 7.912 8.797 -0.885 1
1 1488 . 16 1 1 A 124 124 SER HA H 124 4.626 4.129 0.497 1
1 1491 . 16 1 1 A 124 124 SER C C 124 174.405 174.482 -0.077 1
1 1492 . 16 1 1 A 124 124 SER CA C 124 58.390 61.003 -2.613 1
1 1493 . 16 1 1 A 124 124 SER CB C 124 64.255 63.460 0.795 1
1 1494 . 16 1 1 A 124 124 SER N N 124 116.876 116.542 0.334 1
1 1495 . 16 1 1 A 125 125 GLY H H 125 8.307 7.843 0.464 1
1 1496 . 16 1 1 A 125 125 GLY HA2 H 125 4.166 4.095 0.071 1
1 1497 . 16 1 1 A 125 125 GLY HA3 H 125 4.166 4.097 0.069 1
1 1498 . 16 1 1 A 125 125 GLY C C 125 171.921 173.424 -1.503 1
1 1499 . 16 1 1 A 125 125 GLY CA C 125 44.748 45.091 -0.343 1
1 1500 . 16 1 1 A 125 125 GLY N N 125 110.006 107.179 2.827 1
1 1501 . 16 1 1 A 126 126 PRO HA H 126 4.510 4.394 0.116 1
1 1508 . 16 1 1 A 126 126 PRO C C 126 177.471 176.868 0.603 1
1 1509 . 16 1 1 A 126 126 PRO CA C 126 63.419 64.738 -1.319 1
1 1510 . 16 1 1 A 126 126 PRO CB C 126 32.106 31.947 0.159 1
1 1513 . 16 1 1 A 127 127 SER H H 127 8.607 8.042 0.565 1
1 1514 . 16 1 1 A 127 127 SER C C 127 174.628 173.595 1.033 1
1 1515 . 16 1 1 A 127 127 SER CA C 127 58.513 58.794 -0.281 1
1 1516 . 16 1 1 A 127 127 SER CB C 127 63.679 61.887 1.792 1
1 1517 . 16 1 1 A 127 127 SER N N 127 116.390 112.736 3.654 1
1 1518 . 16 1 1 A 128 128 SER H H 128 8.272 8.250 0.022 1
1 1519 . 16 1 1 A 128 128 SER HA H 128 4.496 5.439 -0.943 1
1 1520 . 16 1 1 A 128 128 SER C C 128 173.921 173.462 0.459 1
1 1521 . 16 1 1 A 128 128 SER CA C 128 58.442 56.600 1.842 1
1 1522 . 16 1 1 A 128 128 SER CB C 128 64.173 64.807 -0.634 1
1 1523 . 16 1 1 A 128 128 SER N N 128 117.506 117.362 0.144 1
1 1 . 17 1 1 A 7 7 GLY HA2 H 7 3.978 4.174 -0.196 1
1 2 . 17 1 1 A 7 7 GLY HA3 H 7 3.978 4.175 -0.197 1
1 3 . 17 1 1 A 7 7 GLY C C 7 174.274 173.342 0.932 1
1 4 . 17 1 1 A 7 7 GLY CA C 7 45.383 45.554 -0.171 1
1 5 . 17 1 1 A 8 8 SER H H 8 8.211 8.798 -0.587 1
1 6 . 17 1 1 A 8 8 SER HA H 8 4.425 4.036 0.389 1
1 9 . 17 1 1 A 8 8 SER C C 8 174.635 173.689 0.946 1
1 10 . 17 1 1 A 8 8 SER CA C 8 58.425 59.425 -1.000 1
1 11 . 17 1 1 A 8 8 SER CB C 8 63.885 61.771 2.114 1
1 12 . 17 1 1 A 8 8 SER N N 8 115.732 115.124 0.608 1
1 13 . 17 1 1 A 9 9 LEU H H 9 8.316 7.771 0.545 1
1 14 . 17 1 1 A 9 9 LEU HA H 9 4.334 4.337 -0.003 1
1 24 . 17 1 1 A 9 9 LEU C C 9 177.447 177.913 -0.466 1
1 25 . 17 1 1 A 9 9 LEU CA C 9 55.407 54.166 1.241 1
1 26 . 17 1 1 A 9 9 LEU CB C 9 42.171 42.676 -0.505 1
1 30 . 17 1 1 A 9 9 LEU N N 9 123.943 122.336 1.607 1
1 31 . 17 1 1 A 10 10 SER H H 10 8.304 8.666 -0.362 1
1 32 . 17 1 1 A 10 10 SER HA H 10 4.424 4.392 0.032 1
1 35 . 17 1 1 A 10 10 SER C C 10 175.025 174.610 0.415 1
1 36 . 17 1 1 A 10 10 SER CA C 10 58.425 60.934 -2.509 1
1 37 . 17 1 1 A 10 10 SER CB C 10 63.638 63.856 -0.218 1
1 38 . 17 1 1 A 10 10 SER N N 10 116.718 117.009 -0.291 1
1 39 . 17 1 1 A 11 11 THR H H 11 8.003 7.738 0.265 1
1 40 . 17 1 1 A 11 11 THR HA H 11 4.196 4.984 -0.788 1
1 45 . 17 1 1 A 11 11 THR C C 11 176.296 173.378 2.918 1
1 46 . 17 1 1 A 11 11 THR CA C 11 62.483 61.491 0.992 1
1 47 . 17 1 1 A 11 11 THR CB C 11 69.266 73.478 -4.212 1
1 49 . 17 1 1 A 11 11 THR N N 11 114.902 112.234 2.668 1
1 50 . 17 1 1 A 12 12 VAL H H 12 8.095 8.597 -0.502 1
1 51 . 17 1 1 A 12 12 VAL HA H 12 3.826 4.258 -0.432 1
1 59 . 17 1 1 A 12 12 VAL C C 12 178.501 176.890 1.611 1
1 60 . 17 1 1 A 12 12 VAL CA C 12 64.760 63.364 1.396 1
1 61 . 17 1 1 A 12 12 VAL CB C 12 32.013 32.418 -0.405 1
1 64 . 17 1 1 A 12 12 VAL N N 12 122.111 120.979 1.132 1
1 65 . 17 1 1 A 13 13 GLU H H 13 8.151 9.136 -0.985 1
1 66 . 17 1 1 A 13 13 GLU HA H 13 3.244 4.425 -1.181 1
1 71 . 17 1 1 A 13 13 GLU C C 13 175.702 178.551 -2.849 1
1 72 . 17 1 1 A 13 13 GLU CA C 13 58.354 59.809 -1.455 1
1 73 . 17 1 1 A 13 13 GLU CB C 13 28.843 29.233 -0.390 1
1 75 . 17 1 1 A 13 13 GLU N N 13 120.316 123.287 -2.971 1
1 76 . 17 1 1 A 14 14 LEU H H 14 7.067 7.798 -0.731 1
1 77 . 17 1 1 A 14 14 LEU HA H 14 4.157 4.368 -0.211 1
1 87 . 17 1 1 A 14 14 LEU C C 14 176.863 176.952 -0.089 1
1 88 . 17 1 1 A 14 14 LEU CA C 14 53.324 54.296 -0.972 1
1 89 . 17 1 1 A 14 14 LEU CB C 14 41.636 41.098 0.538 1
1 93 . 17 1 1 A 14 14 LEU N N 14 117.035 118.548 -1.513 1
1 94 . 17 1 1 A 15 15 SER H H 15 7.645 8.847 -1.202 1
1 95 . 17 1 1 A 15 15 SER HA H 15 4.305 4.687 -0.382 1
1 98 . 17 1 1 A 15 15 SER C C 15 175.340 173.209 2.131 1
1 99 . 17 1 1 A 15 15 SER CA C 15 59.783 57.344 2.439 1
1 100 . 17 1 1 A 15 15 SER CB C 15 64.625 62.843 1.782 1
1 101 . 17 1 1 A 15 15 SER N N 15 114.216 115.944 -1.728 1
1 102 . 17 1 1 A 16 16 GLY H H 16 8.506 8.128 0.378 1
1 103 . 17 1 1 A 16 16 GLY HA2 H 16 4.237 4.272 -0.035 1
1 104 . 17 1 1 A 16 16 GLY HA3 H 16 3.927 4.292 -0.365 1
1 105 . 17 1 1 A 16 16 GLY C C 16 173.661 172.155 1.506 1
1 106 . 17 1 1 A 16 16 GLY CA C 16 44.995 43.585 1.410 1
1 107 . 17 1 1 A 16 16 GLY N N 16 111.838 111.934 -0.096 1
1 108 . 17 1 1 A 17 17 THR H H 17 8.482 9.331 -0.849 1
1 109 . 17 1 1 A 17 17 THR HA H 17 4.319 4.480 -0.161 1
1 114 . 17 1 1 A 17 17 THR C C 17 174.758 174.520 0.238 1
1 115 . 17 1 1 A 17 17 THR CA C 17 62.272 63.473 -1.201 1
1 116 . 17 1 1 A 17 17 THR CB C 17 70.706 69.123 1.583 1
1 118 . 17 1 1 A 17 17 THR N N 17 116.679 115.401 1.278 1
1 119 . 17 1 1 A 18 18 VAL H H 18 8.948 8.792 0.156 1
1 120 . 17 1 1 A 18 18 VAL HA H 18 3.950 4.281 -0.331 1
1 128 . 17 1 1 A 18 18 VAL C C 18 176.669 177.041 -0.372 1
1 129 . 17 1 1 A 18 18 VAL CA C 18 64.813 63.716 1.097 1
1 130 . 17 1 1 A 18 18 VAL CB C 18 31.807 32.013 -0.206 1
1 133 . 17 1 1 A 18 18 VAL N N 18 127.156 127.719 -0.563 1
1 134 . 17 1 1 A 19 19 VAL H H 19 9.359 9.287 0.072 1
1 135 . 17 1 1 A 19 19 VAL HA H 19 4.234 4.398 -0.164 1
1 143 . 17 1 1 A 19 19 VAL C C 19 175.738 175.796 -0.058 1
1 144 . 17 1 1 A 19 19 VAL CA C 19 62.060 62.119 -0.059 1
1 145 . 17 1 1 A 19 19 VAL CB C 19 33.822 33.432 0.390 1
1 148 . 17 1 1 A 19 19 VAL N N 19 125.162 121.638 3.524 1
1 149 . 17 1 1 A 20 20 LYS H H 20 7.584 7.283 0.301 1
1 150 . 17 1 1 A 20 20 LYS HA H 20 4.346 4.468 -0.122 1
1 159 . 17 1 1 A 20 20 LYS C C 20 172.818 174.027 -1.209 1
1 160 . 17 1 1 A 20 20 LYS CA C 20 56.801 55.560 1.241 1
1 161 . 17 1 1 A 20 20 LYS CB C 20 36.624 35.656 0.968 1
1 165 . 17 1 1 A 20 20 LYS N N 20 121.024 121.002 0.022 1
1 166 . 17 1 1 A 21 21 GLN H H 21 8.625 8.550 0.075 1
1 167 . 17 1 1 A 21 21 GLN HA H 21 6.003 5.365 0.638 1
1 174 . 17 1 1 A 21 21 GLN C C 21 174.914 174.909 0.005 1
1 175 . 17 1 1 A 21 21 GLN CA C 21 54.207 54.602 -0.395 1
1 176 . 17 1 1 A 21 21 GLN CB C 21 33.452 33.405 0.047 1
1 178 . 17 1 1 A 21 21 GLN N N 21 122.108 124.282 -2.174 1
1 180 . 17 1 1 A 22 22 GLY H H 22 8.964 8.320 0.644 1
1 181 . 17 1 1 A 22 22 GLY HA2 H 22 4.665 4.419 0.246 1
1 182 . 17 1 1 A 22 22 GLY HA3 H 22 4.295 4.601 -0.306 1
1 183 . 17 1 1 A 22 22 GLY C C 22 170.879 171.680 -0.801 1
1 184 . 17 1 1 A 22 22 GLY CA C 22 45.683 45.926 -0.243 1
1 185 . 17 1 1 A 22 22 GLY N N 22 108.508 109.005 -0.497 1
1 186 . 17 1 1 A 23 23 TYR H H 23 9.145 8.731 0.414 1
1 187 . 17 1 1 A 23 23 TYR HA H 23 5.595 5.632 -0.037 1
1 194 . 17 1 1 A 23 23 TYR C C 23 175.824 175.482 0.342 1
1 195 . 17 1 1 A 23 23 TYR CA C 23 58.019 56.787 1.232 1
1 196 . 17 1 1 A 23 23 TYR CB C 23 39.251 40.465 -1.214 1
1 201 . 17 1 1 A 23 23 TYR N N 23 120.809 119.776 1.033 1
1 202 . 17 1 1 A 24 24 LEU H H 24 8.935 9.500 -0.565 1
1 203 . 17 1 1 A 24 24 LEU HA H 24 4.716 5.065 -0.349 1
1 213 . 17 1 1 A 24 24 LEU C C 24 174.648 176.417 -1.769 1
1 214 . 17 1 1 A 24 24 LEU CA C 24 53.907 53.160 0.747 1
1 215 . 17 1 1 A 24 24 LEU CB C 24 46.078 44.637 1.441 1
1 219 . 17 1 1 A 24 24 LEU N N 24 122.887 124.832 -1.945 1
1 220 . 17 1 1 A 25 25 ALA H H 25 8.145 8.700 -0.555 1
1 221 . 17 1 1 A 25 25 ALA HA H 25 5.477 5.567 -0.090 1
1 225 . 17 1 1 A 25 25 ALA C C 25 175.751 176.548 -0.797 1
1 226 . 17 1 1 A 25 25 ALA CA C 25 50.719 50.685 0.034 1
1 227 . 17 1 1 A 25 25 ALA CB C 25 21.074 20.584 0.490 1
1 228 . 17 1 1 A 25 25 ALA N N 25 122.280 123.094 -0.814 1
1 229 . 17 1 1 A 26 26 LYS H H 26 9.167 8.188 0.979 1
1 230 . 17 1 1 A 26 26 LYS HA H 26 5.221 4.790 0.431 1
1 239 . 17 1 1 A 26 26 LYS C C 26 175.421 174.935 0.486 1
1 240 . 17 1 1 A 26 26 LYS CA C 26 54.383 55.225 -0.842 1
1 241 . 17 1 1 A 26 26 LYS CB C 26 36.125 33.818 2.307 1
1 245 . 17 1 1 A 26 26 LYS N N 26 120.638 121.852 -1.214 1
1 246 . 17 1 1 A 27 27 GLN H H 27 7.866 7.807 0.059 1
1 247 . 17 1 1 A 27 27 GLN HA H 27 3.525 4.231 -0.706 1
1 254 . 17 1 1 A 27 27 GLN C C 27 177.022 174.847 2.175 1
1 255 . 17 1 1 A 27 27 GLN CA C 27 55.778 54.638 1.140 1
1 256 . 17 1 1 A 27 27 GLN CB C 27 29.864 28.668 1.196 1
1 258 . 17 1 1 A 27 27 GLN N N 27 130.194 122.856 7.338 1
1 260 . 17 1 1 A 28 28 GLY H H 28 8.565 8.193 0.372 1
1 261 . 17 1 1 A 28 28 GLY HA2 H 28 4.125 3.998 0.127 1
1 262 . 17 1 1 A 28 28 GLY HA3 H 28 4.034 4.019 0.015 1
1 263 . 17 1 1 A 28 28 GLY C C 28 174.030 173.367 0.663 1
1 264 . 17 1 1 A 28 28 GLY CA C 28 45.665 45.679 -0.014 1
1 265 . 17 1 1 A 28 28 GLY N N 28 115.528 112.788 2.740 1
1 266 . 17 1 1 A 29 29 HIS HA H 29 4.355 4.454 -0.099 1
1 271 . 17 1 1 A 29 29 HIS CA C 29 58.795 58.367 0.428 1
1 272 . 17 1 1 A 29 29 HIS CB C 29 31.283 28.705 2.578 1
1 275 . 17 1 1 A 30 30 LYS HA H 30 4.096 4.571 -0.475 1
1 284 . 17 1 1 A 30 30 LYS CA C 30 57.290 54.555 2.735 1
1 285 . 17 1 1 A 30 30 LYS CB C 30 31.951 34.922 -2.971 1
1 289 . 17 1 1 A 31 31 ARG HA H 31 3.975 4.115 -0.140 1
1 296 . 17 1 1 A 31 31 ARG CA C 31 55.973 57.127 -1.154 1
1 297 . 17 1 1 A 31 31 ARG CB C 31 29.902 29.072 0.830 1
1 300 . 17 1 1 A 32 32 LYS HA H 32 4.160 4.365 -0.205 1
1 309 . 17 1 1 A 32 32 LYS C C 32 175.678 176.975 -1.297 1
1 310 . 17 1 1 A 32 32 LYS CA C 32 56.254 57.958 -1.704 1
1 311 . 17 1 1 A 32 32 LYS CB C 32 31.602 31.577 0.025 1
1 315 . 17 1 1 A 33 33 ASN H H 33 7.925 8.940 -1.015 1
1 316 . 17 1 1 A 33 33 ASN HA H 33 4.799 4.756 0.043 1
1 321 . 17 1 1 A 33 33 ASN C C 33 174.005 174.821 -0.816 1
1 322 . 17 1 1 A 33 33 ASN CA C 33 52.407 55.100 -2.693 1
1 323 . 17 1 1 A 33 33 ASN CB C 33 39.879 38.392 1.487 1
1 324 . 17 1 1 A 33 33 ASN N N 33 116.990 120.532 -3.542 1
1 326 . 17 1 1 A 34 34 TRP H H 34 8.798 8.350 0.448 1
1 327 . 17 1 1 A 34 34 TRP HA H 34 4.755 5.038 -0.283 1
1 336 . 17 1 1 A 34 34 TRP C C 34 176.090 176.426 -0.336 1
1 337 . 17 1 1 A 34 34 TRP CA C 34 57.119 56.454 0.665 1
1 338 . 17 1 1 A 34 34 TRP CB C 34 30.596 30.717 -0.121 1
1 344 . 17 1 1 A 34 34 TRP N N 34 121.917 117.137 4.780 1
1 346 . 17 1 1 A 35 35 LYS H H 35 8.404 9.122 -0.718 1
1 347 . 17 1 1 A 35 35 LYS HA H 35 4.846 4.934 -0.088 1
1 354 . 17 1 1 A 35 35 LYS C C 35 176.088 175.832 0.256 1
1 355 . 17 1 1 A 35 35 LYS CA C 35 54.418 54.961 -0.543 1
1 356 . 17 1 1 A 35 35 LYS CB C 35 36.125 35.703 0.422 1
1 360 . 17 1 1 A 35 35 LYS N N 35 120.864 122.761 -1.897 1
1 361 . 17 1 1 A 36 36 VAL H H 36 8.977 8.751 0.226 1
1 362 . 17 1 1 A 36 36 VAL HA H 36 4.274 4.710 -0.436 1
1 370 . 17 1 1 A 36 36 VAL C C 36 176.733 176.061 0.672 1
1 371 . 17 1 1 A 36 36 VAL CA C 36 64.319 62.217 2.102 1
1 372 . 17 1 1 A 36 36 VAL CB C 36 31.602 32.462 -0.860 1
1 375 . 17 1 1 A 36 36 VAL N N 36 124.314 123.938 0.376 1
1 376 . 17 1 1 A 37 37 ARG H H 37 9.498 10.407 -0.909 1
1 377 . 17 1 1 A 37 37 ARG HA H 37 5.053 5.150 -0.097 1
1 384 . 17 1 1 A 37 37 ARG C C 37 174.442 174.422 0.020 1
1 385 . 17 1 1 A 37 37 ARG CA C 37 53.272 54.159 -0.887 1
1 386 . 17 1 1 A 37 37 ARG CB C 37 34.563 34.497 0.066 1
1 389 . 17 1 1 A 37 37 ARG N N 37 128.121 126.834 1.287 1
1 390 . 17 1 1 A 38 38 ARG H H 38 8.755 8.527 0.228 1
1 391 . 17 1 1 A 38 38 ARG HA H 38 4.626 4.263 0.363 1
1 398 . 17 1 1 A 38 38 ARG C C 38 175.514 174.742 0.772 1
1 399 . 17 1 1 A 38 38 ARG CA C 38 55.601 55.300 0.301 1
1 400 . 17 1 1 A 38 38 ARG CB C 38 32.219 30.803 1.416 1
1 403 . 17 1 1 A 38 38 ARG N N 38 121.442 123.113 -1.671 1
1 404 . 17 1 1 A 39 39 PHE H H 39 9.865 8.929 0.936 1
1 405 . 17 1 1 A 39 39 PHE HA H 39 5.424 5.050 0.374 1
1 413 . 17 1 1 A 39 39 PHE C C 39 175.423 174.731 0.692 1
1 414 . 17 1 1 A 39 39 PHE CA C 39 57.419 57.075 0.344 1
1 415 . 17 1 1 A 39 39 PHE CB C 39 42.623 40.542 2.081 1
1 421 . 17 1 1 A 39 39 PHE N N 39 130.027 126.480 3.547 1
1 422 . 17 1 1 A 40 40 VAL H H 40 9.300 9.969 -0.669 1
1 423 . 17 1 1 A 40 40 VAL HA H 40 4.846 5.324 -0.478 1
1 431 . 17 1 1 A 40 40 VAL C C 40 174.477 173.569 0.908 1
1 432 . 17 1 1 A 40 40 VAL CA C 40 62.343 59.734 2.609 1
1 433 . 17 1 1 A 40 40 VAL CB C 40 35.755 34.739 1.016 1
1 436 . 17 1 1 A 40 40 VAL N N 40 119.369 123.223 -3.854 1
1 437 . 17 1 1 A 41 41 LEU H H 41 9.557 10.061 -0.504 1
1 438 . 17 1 1 A 41 41 LEU HA H 41 5.292 5.533 -0.241 1
1 448 . 17 1 1 A 41 41 LEU C C 41 174.632 175.382 -0.750 1
1 449 . 17 1 1 A 41 41 LEU CA C 41 53.571 53.626 -0.055 1
1 450 . 17 1 1 A 41 41 LEU CB C 41 45.337 45.265 0.072 1
1 454 . 17 1 1 A 41 41 LEU N N 41 132.121 129.602 2.519 1
1 455 . 17 1 1 A 42 42 ARG H H 42 9.396 8.788 0.608 1
1 456 . 17 1 1 A 42 42 ARG HA H 42 5.366 5.121 0.245 1
1 464 . 17 1 1 A 42 42 ARG C C 42 173.997 174.773 -0.776 1
1 465 . 17 1 1 A 42 42 ARG CA C 42 54.631 54.120 0.511 1
1 466 . 17 1 1 A 42 42 ARG CB C 42 35.550 34.885 0.665 1
1 469 . 17 1 1 A 42 42 ARG N N 42 128.120 123.349 4.771 1
1 471 . 17 1 1 A 43 43 LYS H H 43 8.597 8.615 -0.018 1
1 472 . 17 1 1 A 43 43 LYS HA H 43 4.558 4.913 -0.355 1
1 481 . 17 1 1 A 43 43 LYS C C 43 174.648 174.927 -0.279 1
1 482 . 17 1 1 A 43 43 LYS CA C 43 53.378 54.743 -1.365 1
1 483 . 17 1 1 A 43 43 LYS CB C 43 37.303 36.123 1.180 1
1 487 . 17 1 1 A 43 43 LYS N N 43 114.484 117.704 -3.220 1
1 488 . 17 1 1 A 44 44 ASP H H 44 8.388 8.719 -0.331 1
1 489 . 17 1 1 A 44 44 ASP HA H 44 4.349 4.076 0.273 1
1 492 . 17 1 1 A 44 44 ASP C C 44 173.376 174.205 -0.829 1
1 493 . 17 1 1 A 44 44 ASP CA C 44 54.842 54.835 0.007 1
1 494 . 17 1 1 A 44 44 ASP CB C 44 39.991 39.422 0.569 1
1 495 . 17 1 1 A 44 44 ASP N N 44 115.453 118.413 -2.960 1
1 496 . 17 1 1 A 45 45 PRO HA H 45 4.652 4.439 0.213 1
1 503 . 17 1 1 A 45 45 PRO C C 45 176.914 175.244 1.670 1
1 504 . 17 1 1 A 45 45 PRO CA C 45 63.490 62.427 1.063 1
1 505 . 17 1 1 A 45 45 PRO CB C 45 34.892 32.752 2.140 1
1 508 . 17 1 1 A 46 46 ALA H H 46 8.112 7.988 0.124 1
1 509 . 17 1 1 A 46 46 ALA HA H 46 5.455 4.619 0.836 1
1 513 . 17 1 1 A 46 46 ALA C C 46 177.234 176.525 0.709 1
1 514 . 17 1 1 A 46 46 ALA CA C 46 51.560 50.445 1.115 1
1 515 . 17 1 1 A 46 46 ALA CB C 46 20.122 19.662 0.460 1
1 516 . 17 1 1 A 46 46 ALA N N 46 120.155 122.909 -2.754 1
1 517 . 17 1 1 A 47 47 PHE H H 47 8.717 8.928 -0.211 1
1 518 . 17 1 1 A 47 47 PHE HA H 47 4.795 4.888 -0.093 1
1 526 . 17 1 1 A 47 47 PHE C C 47 172.588 173.976 -1.388 1
1 527 . 17 1 1 A 47 47 PHE CA C 47 57.348 56.402 0.946 1
1 528 . 17 1 1 A 47 47 PHE CB C 47 47.123 43.554 3.569 1
1 534 . 17 1 1 A 47 47 PHE N N 47 129.946 119.862 10.084 1
1 535 . 17 1 1 A 48 48 LEU H H 48 7.883 8.272 -0.389 1
1 536 . 17 1 1 A 48 48 LEU HA H 48 5.198 5.258 -0.060 1
1 546 . 17 1 1 A 48 48 LEU C C 48 173.569 174.444 -0.875 1
1 547 . 17 1 1 A 48 48 LEU CA C 48 53.290 53.573 -0.283 1
1 548 . 17 1 1 A 48 48 LEU CB C 48 45.502 44.839 0.663 1
1 552 . 17 1 1 A 48 48 LEU N N 48 121.108 123.770 -2.662 1
1 553 . 17 1 1 A 49 49 HIS H H 49 8.606 8.924 -0.318 1
1 554 . 17 1 1 A 49 49 HIS HA H 49 5.035 5.139 -0.104 1
1 559 . 17 1 1 A 49 49 HIS C C 49 173.993 174.014 -0.021 1
1 560 . 17 1 1 A 49 49 HIS CA C 49 56.483 54.142 2.341 1
1 561 . 17 1 1 A 49 49 HIS CB C 49 35.919 33.568 2.351 1
1 564 . 17 1 1 A 49 49 HIS N N 49 121.199 125.907 -4.708 1
1 565 . 17 1 1 A 50 50 TYR H H 50 7.777 8.706 -0.929 1
1 566 . 17 1 1 A 50 50 TYR HA H 50 5.695 5.666 0.029 1
1 573 . 17 1 1 A 50 50 TYR C C 50 174.284 172.094 2.190 1
1 574 . 17 1 1 A 50 50 TYR CA C 50 53.430 55.481 -2.051 1
1 575 . 17 1 1 A 50 50 TYR CB C 50 38.552 41.318 -2.766 1
1 580 . 17 1 1 A 50 50 TYR N N 50 114.156 117.467 -3.311 1
1 581 . 17 1 1 A 51 51 TYR H H 51 9.323 9.417 -0.094 1
1 582 . 17 1 1 A 51 51 TYR HA H 51 4.600 4.825 -0.225 1
1 589 . 17 1 1 A 51 51 TYR C C 51 175.352 174.228 1.124 1
1 590 . 17 1 1 A 51 51 TYR CA C 51 57.330 56.158 1.172 1
1 591 . 17 1 1 A 51 51 TYR CB C 51 41.683 41.851 -0.168 1
1 596 . 17 1 1 A 51 51 TYR N N 51 119.100 119.422 -0.322 1
1 597 . 17 1 1 A 52 52 ASP H H 52 9.375 8.551 0.824 1
1 598 . 17 1 1 A 52 52 ASP HA H 52 5.064 4.877 0.187 1
1 601 . 17 1 1 A 52 52 ASP C C 52 175.484 175.712 -0.228 1
1 602 . 17 1 1 A 52 52 ASP CA C 52 51.313 51.245 0.068 1
1 603 . 17 1 1 A 52 52 ASP CB C 52 41.883 42.069 -0.186 1
1 604 . 17 1 1 A 52 52 ASP N N 52 124.636 124.207 0.429 1
1 605 . 17 1 1 A 53 53 PRO HA H 53 4.678 4.597 0.081 1
1 612 . 17 1 1 A 53 53 PRO C C 53 176.781 177.918 -1.137 1
1 613 . 17 1 1 A 53 53 PRO CA C 53 64.054 64.041 0.013 1
1 614 . 17 1 1 A 53 53 PRO CB C 53 32.589 32.066 0.523 1
1 617 . 17 1 1 A 54 54 SER H H 54 8.685 8.085 0.600 1
1 618 . 17 1 1 A 54 54 SER HA H 54 4.483 4.419 0.064 1
1 621 . 17 1 1 A 54 54 SER C C 54 174.006 174.420 -0.414 1
1 622 . 17 1 1 A 54 54 SER CA C 54 59.378 60.596 -1.218 1
1 623 . 17 1 1 A 54 54 SER CB C 54 64.132 63.606 0.526 1
1 624 . 17 1 1 A 54 54 SER N N 54 113.769 112.440 1.329 1
1 625 . 17 1 1 A 55 55 LYS H H 55 7.706 7.766 -0.060 1
1 626 . 17 1 1 A 55 55 LYS HA H 55 4.580 4.720 -0.140 1
1 635 . 17 1 1 A 55 55 LYS C C 55 175.969 175.647 0.322 1
1 636 . 17 1 1 A 55 55 LYS CA C 55 55.160 54.961 0.199 1
1 637 . 17 1 1 A 55 55 LYS CB C 55 34.069 34.231 -0.162 1
1 641 . 17 1 1 A 55 55 LYS N N 55 122.222 120.163 2.059 1
1 642 . 17 1 1 A 56 56 GLU H H 56 8.666 8.635 0.031 1
1 643 . 17 1 1 A 56 56 GLU HA H 56 4.174 5.062 -0.888 1
1 648 . 17 1 1 A 56 56 GLU C C 56 177.084 174.694 2.390 1
1 649 . 17 1 1 A 56 56 GLU CA C 56 57.099 55.317 1.782 1
1 650 . 17 1 1 A 56 56 GLU CB C 56 29.694 31.239 -1.545 1
1 652 . 17 1 1 A 56 56 GLU N N 56 122.015 119.249 2.766 1
1 653 . 17 1 1 A 57 57 GLU H H 57 8.303 8.947 -0.644 1
1 654 . 17 1 1 A 57 57 GLU HA H 57 4.214 4.978 -0.764 1
1 659 . 17 1 1 A 57 57 GLU CA C 57 56.960 54.744 2.216 1
1 660 . 17 1 1 A 57 57 GLU CB C 57 30.264 33.745 -3.481 1
1 662 . 17 1 1 A 57 57 GLU N N 57 119.884 122.369 -2.485 1
1 663 . 17 1 1 A 58 58 ASN HA H 58 4.768 4.872 -0.104 1
1 668 . 17 1 1 A 58 58 ASN C C 58 174.902 173.596 1.306 1
1 669 . 17 1 1 A 58 58 ASN CA C 58 52.740 53.047 -0.307 1
1 670 . 17 1 1 A 58 58 ASN CB C 58 38.116 36.422 1.694 1
1 672 . 17 1 1 A 59 59 ARG H H 59 7.805 7.736 0.069 1
1 673 . 17 1 1 A 59 59 ARG HA H 59 4.762 4.636 0.126 1
1 680 . 17 1 1 A 59 59 ARG CA C 59 53.151 53.744 -0.593 1
1 681 . 17 1 1 A 59 59 ARG CB C 59 31.519 34.176 -2.657 1
1 684 . 17 1 1 A 59 59 ARG N N 59 121.060 119.528 1.532 1
1 685 . 17 1 1 A 60 60 PRO HA H 60 3.357 4.011 -0.654 1
1 692 . 17 1 1 A 60 60 PRO C C 60 176.817 176.300 0.517 1
1 693 . 17 1 1 A 60 60 PRO CA C 60 63.031 61.843 1.188 1
1 694 . 17 1 1 A 60 60 PRO CB C 60 31.273 32.531 -1.258 1
1 697 . 17 1 1 A 61 61 VAL H H 61 8.627 8.630 -0.003 1
1 698 . 17 1 1 A 61 61 VAL HA H 61 3.966 3.706 0.260 1
1 706 . 17 1 1 A 61 61 VAL C C 61 176.503 176.028 0.475 1
1 707 . 17 1 1 A 61 61 VAL CA C 61 63.154 63.526 -0.372 1
1 708 . 17 1 1 A 61 61 VAL CB C 61 32.048 31.845 0.203 1
1 711 . 17 1 1 A 61 61 VAL N N 61 119.185 118.514 0.671 1
1 712 . 17 1 1 A 62 62 GLY H H 62 6.715 7.123 -0.408 1
1 713 . 17 1 1 A 62 62 GLY HA2 H 62 3.940 3.949 -0.009 1
1 714 . 17 1 1 A 62 62 GLY HA3 H 62 3.538 3.974 -0.436 1
1 715 . 17 1 1 A 62 62 GLY C C 62 169.983 174.334 -4.351 1
1 716 . 17 1 1 A 62 62 GLY CA C 62 44.465 45.546 -1.081 1
1 717 . 17 1 1 A 62 62 GLY N N 62 105.813 108.517 -2.704 1
1 718 . 17 1 1 A 63 63 GLY H H 63 8.004 7.961 0.043 1
1 719 . 17 1 1 A 63 63 GLY HA2 H 63 4.095 3.341 0.754 1
1 720 . 17 1 1 A 63 63 GLY HA3 H 63 3.813 4.001 -0.188 1
1 721 . 17 1 1 A 63 63 GLY C C 63 171.870 172.452 -0.582 1
1 722 . 17 1 1 A 63 63 GLY CA C 63 47.148 44.330 2.818 1
1 723 . 17 1 1 A 63 63 GLY N N 63 105.089 110.237 -5.148 1
1 724 . 17 1 1 A 64 64 PHE H H 64 7.967 7.200 0.767 1
1 725 . 17 1 1 A 64 64 PHE HA H 64 4.934 5.356 -0.422 1
1 733 . 17 1 1 A 64 64 PHE C C 64 173.140 173.857 -0.717 1
1 734 . 17 1 1 A 64 64 PHE CA C 64 55.248 55.420 -0.172 1
1 735 . 17 1 1 A 64 64 PHE CB C 64 40.238 41.453 -1.215 1
1 741 . 17 1 1 A 64 64 PHE N N 64 113.387 115.856 -2.469 1
1 742 . 17 1 1 A 65 65 SER H H 65 8.518 8.992 -0.474 1
1 743 . 17 1 1 A 65 65 SER HA H 65 3.264 5.096 -1.832 1
1 746 . 17 1 1 A 65 65 SER C C 65 176.417 174.869 1.548 1
1 747 . 17 1 1 A 65 65 SER CA C 65 56.819 58.182 -1.363 1
1 748 . 17 1 1 A 65 65 SER CB C 65 63.391 64.847 -1.456 1
1 749 . 17 1 1 A 65 65 SER N N 65 114.674 115.719 -1.045 1
1 750 . 17 1 1 A 66 66 LEU H H 66 7.404 8.625 -1.221 1
1 751 . 17 1 1 A 66 66 LEU HA H 66 4.470 4.417 0.053 1
1 761 . 17 1 1 A 66 66 LEU C C 66 177.993 178.594 -0.601 1
1 762 . 17 1 1 A 66 66 LEU CA C 66 54.242 56.536 -2.294 1
1 763 . 17 1 1 A 66 66 LEU CB C 66 42.787 42.273 0.514 1
1 767 . 17 1 1 A 66 66 LEU N N 66 123.988 123.101 0.887 1
1 768 . 17 1 1 A 67 67 ARG H H 67 7.865 8.082 -0.217 1
1 769 . 17 1 1 A 67 67 ARG HA H 67 4.175 3.965 0.210 1
1 776 . 17 1 1 A 67 67 ARG C C 67 178.562 178.005 0.557 1
1 777 . 17 1 1 A 67 67 ARG CA C 67 58.143 59.247 -1.104 1
1 778 . 17 1 1 A 67 67 ARG CB C 67 29.052 30.060 -1.008 1
1 781 . 17 1 1 A 67 67 ARG N N 67 122.494 118.041 4.453 1
1 782 . 17 1 1 A 68 68 GLY H H 68 9.398 8.177 1.221 1
1 783 . 17 1 1 A 68 68 GLY HA2 H 68 4.066 3.960 0.106 1
1 784 . 17 1 1 A 68 68 GLY HA3 H 68 3.908 3.973 -0.065 1
1 785 . 17 1 1 A 68 68 GLY C C 68 173.982 174.133 -0.151 1
1 786 . 17 1 1 A 68 68 GLY CA C 68 46.230 46.215 0.015 1
1 787 . 17 1 1 A 68 68 GLY N N 68 117.548 107.947 9.601 1
1 788 . 17 1 1 A 69 69 SER H H 69 7.829 8.293 -0.464 1
1 789 . 17 1 1 A 69 69 SER HA H 69 4.807 5.206 -0.399 1
1 792 . 17 1 1 A 69 69 SER C C 69 172.854 173.017 -0.163 1
1 793 . 17 1 1 A 69 69 SER CA C 69 59.290 56.306 2.984 1
1 794 . 17 1 1 A 69 69 SER CB C 69 65.366 66.179 -0.813 1
1 795 . 17 1 1 A 69 69 SER N N 69 115.188 113.282 1.906 1
1 796 . 17 1 1 A 70 70 LEU H H 70 8.805 8.627 0.178 1
1 797 . 17 1 1 A 70 70 LEU HA H 70 4.846 4.849 -0.003 1
1 807 . 17 1 1 A 70 70 LEU C C 70 175.775 174.364 1.411 1
1 808 . 17 1 1 A 70 70 LEU CA C 70 53.907 54.340 -0.433 1
1 809 . 17 1 1 A 70 70 LEU CB C 70 45.337 46.169 -0.832 1
1 813 . 17 1 1 A 70 70 LEU N N 70 121.265 122.790 -1.525 1
1 814 . 17 1 1 A 71 71 VAL H H 71 8.644 8.755 -0.111 1
1 815 . 17 1 1 A 71 71 VAL HA H 71 5.555 5.189 0.366 1
1 823 . 17 1 1 A 71 71 VAL C C 71 173.636 173.379 0.257 1
1 824 . 17 1 1 A 71 71 VAL CA C 71 58.760 59.508 -0.748 1
1 825 . 17 1 1 A 71 71 VAL CB C 71 34.891 35.819 -0.928 1
1 828 . 17 1 1 A 71 71 VAL N N 71 122.315 123.125 -0.810 1
1 829 . 17 1 1 A 72 72 SER H H 72 8.750 8.622 0.128 1
1 830 . 17 1 1 A 72 72 SER HA H 72 4.742 4.988 -0.246 1
1 833 . 17 1 1 A 72 72 SER C C 72 173.058 172.379 0.679 1
1 834 . 17 1 1 A 72 72 SER CA C 72 57.190 57.862 -0.672 1
1 835 . 17 1 1 A 72 72 SER CB C 72 65.612 67.658 -2.046 1
1 836 . 17 1 1 A 72 72 SER N N 72 118.611 122.030 -3.419 1
1 837 . 17 1 1 A 73 73 ALA H H 73 9.009 8.860 0.149 1
1 838 . 17 1 1 A 73 73 ALA HA H 73 4.406 5.134 -0.728 1
1 842 . 17 1 1 A 73 73 ALA C C 73 176.708 176.512 0.196 1
1 843 . 17 1 1 A 73 73 ALA CA C 73 52.672 50.026 2.646 1
1 844 . 17 1 1 A 73 73 ALA CB C 73 18.812 21.392 -2.580 1
1 845 . 17 1 1 A 73 73 ALA N N 73 125.694 125.387 0.307 1
1 846 . 17 1 1 A 74 74 LEU H H 74 7.800 8.538 -0.738 1
1 847 . 17 1 1 A 74 74 LEU HA H 74 4.716 4.593 0.123 1
1 857 . 17 1 1 A 74 74 LEU C C 74 176.551 175.704 0.847 1
1 858 . 17 1 1 A 74 74 LEU CA C 74 53.784 54.281 -0.497 1
1 859 . 17 1 1 A 74 74 LEU CB C 74 43.446 41.206 2.240 1
1 863 . 17 1 1 A 74 74 LEU N N 74 122.271 122.893 -0.622 1
1 864 . 17 1 1 A 75 75 GLU H H 75 8.855 9.062 -0.207 1
1 865 . 17 1 1 A 75 75 GLU HA H 75 4.336 4.776 -0.440 1
1 870 . 17 1 1 A 75 75 GLU C C 75 176.465 174.643 1.822 1
1 871 . 17 1 1 A 75 75 GLU CA C 75 56.507 55.484 1.023 1
1 872 . 17 1 1 A 75 75 GLU CB C 75 30.245 30.006 0.239 1
1 874 . 17 1 1 A 75 75 GLU N N 75 122.678 124.688 -2.010 1
1 875 . 17 1 1 A 76 76 ASP H H 76 8.542 8.705 -0.163 1
1 876 . 17 1 1 A 76 76 ASP HA H 76 4.665 5.141 -0.476 1
1 879 . 17 1 1 A 76 76 ASP C C 76 176.087 174.265 1.822 1
1 880 . 17 1 1 A 76 76 ASP CA C 76 55.107 53.955 1.152 1
1 881 . 17 1 1 A 76 76 ASP CB C 76 41.431 42.714 -1.283 1
1 882 . 17 1 1 A 76 76 ASP N N 76 121.488 122.749 -1.261 1
1 883 . 17 1 1 A 77 77 ASN H H 77 8.322 8.951 -0.629 1
1 884 . 17 1 1 A 77 77 ASN HA H 77 4.729 4.479 0.250 1
1 889 . 17 1 1 A 77 77 ASN C C 77 175.566 175.889 -0.323 1
1 890 . 17 1 1 A 77 77 ASN CA C 77 53.131 54.357 -1.226 1
1 891 . 17 1 1 A 77 77 ASN CB C 77 38.617 38.095 0.522 1
1 892 . 17 1 1 A 77 77 ASN N N 77 118.676 124.417 -5.741 1
1 894 . 17 1 1 A 78 78 GLY H H 78 8.311 8.572 -0.261 1
1 895 . 17 1 1 A 78 78 GLY HA2 H 78 3.897 4.121 -0.224 1
1 896 . 17 1 1 A 78 78 GLY HA3 H 78 3.897 4.126 -0.229 1
1 897 . 17 1 1 A 78 78 GLY C C 78 173.376 174.422 -1.046 1
1 898 . 17 1 1 A 78 78 GLY CA C 78 45.224 45.625 -0.401 1
1 899 . 17 1 1 A 78 78 GLY N N 78 108.939 112.969 -4.030 1
1 900 . 17 1 1 A 79 79 VAL H H 79 7.882 8.150 -0.268 1
1 901 . 17 1 1 A 79 79 VAL HA H 79 4.345 3.944 0.401 1
1 909 . 17 1 1 A 79 79 VAL CA C 79 59.995 62.911 -2.916 1
1 910 . 17 1 1 A 79 79 VAL CB C 79 32.589 30.871 1.718 1
1 913 . 17 1 1 A 79 79 VAL N N 79 121.135 111.842 9.293 1
1 914 . 17 1 1 A 80 80 PRO HA H 80 4.461 5.008 -0.547 1
1 921 . 17 1 1 A 80 80 PRO C C 80 176.979 177.192 -0.213 1
1 922 . 17 1 1 A 80 80 PRO CA C 80 63.101 62.448 0.653 1
1 923 . 17 1 1 A 80 80 PRO CB C 80 32.177 29.651 2.526 1
1 926 . 17 1 1 A 81 81 THR H H 81 8.281 9.146 -0.865 1
1 927 . 17 1 1 A 81 81 THR HA H 81 4.095 4.088 0.007 1
1 932 . 17 1 1 A 81 81 THR C C 81 175.270 174.872 0.398 1
1 933 . 17 1 1 A 81 81 THR CA C 81 62.872 62.735 0.137 1
1 934 . 17 1 1 A 81 81 THR CB C 81 69.642 67.659 1.983 1
1 936 . 17 1 1 A 81 81 THR N N 81 114.684 111.690 2.994 1
1 937 . 17 1 1 A 82 82 GLY H H 82 8.338 8.564 -0.226 1
1 938 . 17 1 1 A 82 82 GLY HA2 H 82 4.095 3.850 0.245 1
1 939 . 17 1 1 A 82 82 GLY HA3 H 82 3.668 3.860 -0.192 1
1 940 . 17 1 1 A 82 82 GLY C C 82 174.139 175.038 -0.899 1
1 941 . 17 1 1 A 82 82 GLY CA C 82 45.083 47.153 -2.070 1
1 942 . 17 1 1 A 82 82 GLY N N 82 111.289 113.632 -2.343 1
1 943 . 17 1 1 A 83 83 VAL H H 83 7.668 8.128 -0.460 1
1 944 . 17 1 1 A 83 83 VAL HA H 83 3.985 3.762 0.223 1
1 952 . 17 1 1 A 83 83 VAL C C 83 176.054 175.208 0.846 1
1 953 . 17 1 1 A 83 83 VAL CA C 83 62.431 63.607 -1.176 1
1 954 . 17 1 1 A 83 83 VAL CB C 83 32.260 29.492 2.768 1
1 957 . 17 1 1 A 83 83 VAL N N 83 120.003 118.160 1.843 1
1 958 . 17 1 1 A 84 84 LYS H H 84 8.645 8.422 0.223 1
1 959 . 17 1 1 A 84 84 LYS HA H 84 4.276 3.922 0.354 1
1 968 . 17 1 1 A 84 84 LYS C C 84 176.832 176.546 0.286 1
1 969 . 17 1 1 A 84 84 LYS CA C 84 56.272 57.392 -1.120 1
1 970 . 17 1 1 A 84 84 LYS CB C 84 32.876 30.753 2.123 1
1 974 . 17 1 1 A 84 84 LYS N N 84 126.447 114.792 11.655 1
1 975 . 17 1 1 A 85 85 GLY H H 85 8.410 8.347 0.063 1
1 976 . 17 1 1 A 85 85 GLY HA2 H 85 4.066 4.167 -0.101 1
1 977 . 17 1 1 A 85 85 GLY HA3 H 85 3.781 4.187 -0.406 1
1 978 . 17 1 1 A 85 85 GLY C C 85 173.969 171.524 2.445 1
1 979 . 17 1 1 A 85 85 GLY CA C 85 45.146 45.117 0.029 1
1 980 . 17 1 1 A 85 85 GLY N N 85 109.957 105.038 4.919 1
1 981 . 17 1 1 A 86 86 ASN H H 86 8.298 8.417 -0.119 1
1 982 . 17 1 1 A 86 86 ASN HA H 86 4.665 5.170 -0.505 1
1 987 . 17 1 1 A 86 86 ASN C C 86 174.987 172.945 2.042 1
1 988 . 17 1 1 A 86 86 ASN CA C 86 52.989 52.839 0.150 1
1 989 . 17 1 1 A 86 86 ASN CB C 86 38.376 41.826 -3.450 1
1 990 . 17 1 1 A 86 86 ASN N N 86 118.457 120.435 -1.978 1
1 992 . 17 1 1 A 87 87 VAL H H 87 7.660 8.338 -0.678 1
1 993 . 17 1 1 A 87 87 VAL HA H 87 3.946 4.404 -0.458 1
1 1001 . 17 1 1 A 87 87 VAL C C 87 174.902 175.550 -0.648 1
1 1002 . 17 1 1 A 87 87 VAL CA C 87 62.307 59.493 2.814 1
1 1003 . 17 1 1 A 87 87 VAL CB C 87 32.548 35.554 -3.006 1
1 1006 . 17 1 1 A 87 87 VAL N N 87 120.557 121.515 -0.958 1
1 1007 . 17 1 1 A 88 88 GLN H H 88 8.115 8.045 0.070 1
1 1008 . 17 1 1 A 88 88 GLN HA H 88 4.302 4.330 -0.028 1
1 1015 . 17 1 1 A 88 88 GLN C C 88 175.637 175.309 0.328 1
1 1016 . 17 1 1 A 88 88 GLN CA C 88 55.336 55.175 0.161 1
1 1017 . 17 1 1 A 88 88 GLN CB C 88 30.574 30.077 0.497 1
1 1019 . 17 1 1 A 88 88 GLN N N 88 122.280 122.246 0.034 1
1 1021 . 17 1 1 A 89 89 GLY H H 89 8.544 8.490 0.054 1
1 1022 . 17 1 1 A 89 89 GLY HA2 H 89 3.885 4.276 -0.391 1
1 1023 . 17 1 1 A 89 89 GLY HA3 H 89 3.885 4.285 -0.400 1
1 1024 . 17 1 1 A 89 89 GLY C C 89 172.861 173.852 -0.991 1
1 1025 . 17 1 1 A 89 89 GLY CA C 89 44.889 43.673 1.216 1
1 1026 . 17 1 1 A 89 89 GLY N N 89 110.135 109.218 0.917 1
1 1027 . 17 1 1 A 90 90 ASN H H 90 8.451 8.764 -0.313 1
1 1028 . 17 1 1 A 90 90 ASN HA H 90 4.222 4.257 -0.035 1
1 1033 . 17 1 1 A 90 90 ASN C C 90 174.926 174.260 0.666 1
1 1034 . 17 1 1 A 90 90 ASN CA C 90 54.613 54.234 0.379 1
1 1035 . 17 1 1 A 90 90 ASN CB C 90 37.852 36.821 1.031 1
1 1036 . 17 1 1 A 90 90 ASN N N 90 114.322 116.452 -2.130 1
1 1038 . 17 1 1 A 91 91 LEU H H 91 8.933 7.495 1.438 1
1 1039 . 17 1 1 A 91 91 LEU HA H 91 5.367 5.167 0.200 1
1 1049 . 17 1 1 A 91 91 LEU C C 91 178.732 175.659 3.073 1
1 1050 . 17 1 1 A 91 91 LEU CA C 91 55.160 53.166 1.994 1
1 1051 . 17 1 1 A 91 91 LEU CB C 91 45.461 45.165 0.296 1
1 1055 . 17 1 1 A 91 91 LEU N N 91 120.057 118.753 1.304 1
1 1056 . 17 1 1 A 92 92 PHE H H 92 9.901 8.383 1.518 1
1 1057 . 17 1 1 A 92 92 PHE HA H 92 5.105 5.109 -0.004 1
1 1065 . 17 1 1 A 92 92 PHE C C 92 170.140 172.642 -2.502 1
1 1066 . 17 1 1 A 92 92 PHE CA C 92 56.236 56.060 0.176 1
1 1067 . 17 1 1 A 92 92 PHE CB C 92 42.664 41.130 1.534 1
1 1073 . 17 1 1 A 92 92 PHE N N 92 119.740 116.935 2.805 1
1 1074 . 17 1 1 A 93 93 LYS H H 93 9.154 8.834 0.320 1
1 1075 . 17 1 1 A 93 93 LYS HA H 93 5.584 5.275 0.309 1
1 1083 . 17 1 1 A 93 93 LYS C C 93 174.830 175.138 -0.308 1
1 1084 . 17 1 1 A 93 93 LYS CA C 93 53.148 53.897 -0.749 1
1 1085 . 17 1 1 A 93 93 LYS CB C 93 36.660 36.323 0.337 1
1 1089 . 17 1 1 A 93 93 LYS N N 93 117.710 118.532 -0.822 1
1 1090 . 17 1 1 A 94 94 VAL H H 94 8.507 8.947 -0.440 1
1 1091 . 17 1 1 A 94 94 VAL HA H 94 4.872 4.955 -0.083 1
1 1099 . 17 1 1 A 94 94 VAL C C 94 174.408 175.057 -0.649 1
1 1100 . 17 1 1 A 94 94 VAL CA C 94 60.525 61.605 -1.080 1
1 1101 . 17 1 1 A 94 94 VAL CB C 94 34.862 33.718 1.144 1
1 1104 . 17 1 1 A 94 94 VAL N N 94 121.741 120.671 1.070 1
1 1105 . 17 1 1 A 95 95 ILE H H 95 8.959 9.011 -0.052 1
1 1106 . 17 1 1 A 95 95 ILE HA H 95 4.794 4.660 0.134 1
1 1116 . 17 1 1 A 95 95 ILE C C 95 177.642 176.225 1.417 1
1 1117 . 17 1 1 A 95 95 ILE CA C 95 59.713 60.432 -0.719 1
1 1118 . 17 1 1 A 95 95 ILE CB C 95 40.032 37.945 2.087 1
1 1122 . 17 1 1 A 95 95 ILE N N 95 126.794 128.436 -1.642 1
1 1123 . 17 1 1 A 96 96 THR H H 96 8.765 8.869 -0.104 1
1 1124 . 17 1 1 A 96 96 THR HA H 96 4.584 4.839 -0.255 1
1 1129 . 17 1 1 A 96 96 THR C C 96 177.023 175.633 1.390 1
1 1130 . 17 1 1 A 96 96 THR CA C 96 61.372 60.567 0.805 1
1 1131 . 17 1 1 A 96 96 THR CB C 96 70.794 71.700 -0.906 1
1 1133 . 17 1 1 A 96 96 THR N N 96 117.225 119.957 -2.732 1
1 1134 . 17 1 1 A 97 97 LYS H H 97 8.736 9.002 -0.266 1
1 1135 . 17 1 1 A 97 97 LYS HA H 97 4.101 4.037 0.064 1
1 1144 . 17 1 1 A 97 97 LYS C C 97 176.490 177.284 -0.794 1
1 1145 . 17 1 1 A 97 97 LYS CA C 97 58.583 59.247 -0.664 1
1 1146 . 17 1 1 A 97 97 LYS CB C 97 31.848 32.472 -0.624 1
1 1150 . 17 1 1 A 97 97 LYS N N 97 120.457 122.626 -2.169 1
1 1151 . 17 1 1 A 98 98 ASP H H 98 7.762 7.607 0.155 1
1 1152 . 17 1 1 A 98 98 ASP HA H 98 4.633 4.784 -0.151 1
1 1155 . 17 1 1 A 98 98 ASP C C 98 175.270 175.293 -0.023 1
1 1156 . 17 1 1 A 98 98 ASP CA C 98 53.272 53.974 -0.702 1
1 1157 . 17 1 1 A 98 98 ASP CB C 98 39.909 40.817 -0.908 1
1 1158 . 17 1 1 A 98 98 ASP N N 98 116.281 116.459 -0.178 1
1 1159 . 17 1 1 A 99 99 ASP H H 99 8.340 8.633 -0.293 1
1 1160 . 17 1 1 A 99 99 ASP HA H 99 4.245 4.548 -0.303 1
1 1163 . 17 1 1 A 99 99 ASP C C 99 175.315 175.595 -0.280 1
1 1164 . 17 1 1 A 99 99 ASP CA C 99 55.989 54.987 1.002 1
1 1165 . 17 1 1 A 99 99 ASP CB C 99 39.827 38.586 1.241 1
1 1166 . 17 1 1 A 99 99 ASP N N 99 116.687 118.432 -1.745 1
1 1167 . 17 1 1 A 100 100 THR H H 100 7.511 7.842 -0.331 1
1 1168 . 17 1 1 A 100 100 THR HA H 100 4.185 3.898 0.287 1
1 1173 . 17 1 1 A 100 100 THR C C 100 173.376 174.511 -1.135 1
1 1174 . 17 1 1 A 100 100 THR CA C 100 63.489 65.747 -2.258 1
1 1175 . 17 1 1 A 100 100 THR CB C 100 67.909 69.401 -1.492 1
1 1177 . 17 1 1 A 100 100 THR N N 100 116.525 111.764 4.761 1
1 1178 . 17 1 1 A 101 101 HIS H H 101 8.753 8.267 0.486 1
1 1179 . 17 1 1 A 101 101 HIS HA H 101 4.898 4.254 0.644 1
1 1184 . 17 1 1 A 101 101 HIS C C 101 174.345 173.640 0.705 1
1 1185 . 17 1 1 A 101 101 HIS CA C 101 55.072 56.160 -1.088 1
1 1186 . 17 1 1 A 101 101 HIS CB C 101 32.835 27.990 4.845 1
1 1189 . 17 1 1 A 101 101 HIS N N 101 125.953 116.658 9.295 1
1 1190 . 17 1 1 A 102 102 TYR H H 102 9.023 8.917 0.106 1
1 1191 . 17 1 1 A 102 102 TYR HA H 102 4.545 4.922 -0.377 1
1 1198 . 17 1 1 A 102 102 TYR C C 102 174.126 174.970 -0.844 1
1 1199 . 17 1 1 A 102 102 TYR CA C 102 57.260 56.383 0.877 1
1 1200 . 17 1 1 A 102 102 TYR CB C 102 40.381 39.550 0.831 1
1 1205 . 17 1 1 A 102 102 TYR N N 102 121.975 122.532 -0.557 1
1 1206 . 17 1 1 A 103 103 TYR H H 103 8.899 8.842 0.057 1
1 1207 . 17 1 1 A 103 103 TYR HA H 103 4.729 4.721 0.008 1
1 1214 . 17 1 1 A 103 103 TYR C C 103 174.139 175.859 -1.720 1
1 1215 . 17 1 1 A 103 103 TYR CA C 103 58.036 58.142 -0.106 1
1 1216 . 17 1 1 A 103 103 TYR CB C 103 40.485 39.197 1.288 1
1 1221 . 17 1 1 A 103 103 TYR N N 103 122.012 123.737 -1.725 1
1 1222 . 17 1 1 A 104 104 ILE H H 104 8.605 8.830 -0.225 1
1 1223 . 17 1 1 A 104 104 ILE HA H 104 4.859 4.664 0.195 1
1 1233 . 17 1 1 A 104 104 ILE C C 104 172.769 173.601 -0.832 1
1 1234 . 17 1 1 A 104 104 ILE CA C 104 59.554 59.134 0.420 1
1 1235 . 17 1 1 A 104 104 ILE CB C 104 40.631 40.842 -0.211 1
1 1239 . 17 1 1 A 104 104 ILE N N 104 123.443 123.439 0.004 1
1 1240 . 17 1 1 A 105 105 GLN H H 105 9.369 8.744 0.625 1
1 1241 . 17 1 1 A 105 105 GLN HA H 105 4.895 5.128 -0.233 1
1 1248 . 17 1 1 A 105 105 GLN C C 105 175.642 175.604 0.038 1
1 1249 . 17 1 1 A 105 105 GLN CA C 105 54.965 53.896 1.069 1
1 1250 . 17 1 1 A 105 105 GLN CB C 105 32.856 32.330 0.526 1
1 1252 . 17 1 1 A 105 105 GLN N N 105 125.079 125.016 0.063 1
1 1254 . 17 1 1 A 106 106 ALA H H 106 8.513 8.584 -0.071 1
1 1255 . 17 1 1 A 106 106 ALA HA H 106 4.962 4.802 0.160 1
1 1259 . 17 1 1 A 106 106 ALA C C 106 175.854 178.004 -2.150 1
1 1260 . 17 1 1 A 106 106 ALA CA C 106 50.272 51.294 -1.022 1
1 1261 . 17 1 1 A 106 106 ALA CB C 106 21.197 21.242 -0.045 1
1 1262 . 17 1 1 A 106 106 ALA N N 106 129.303 128.955 0.348 1
1 1263 . 17 1 1 A 107 107 SER H H 107 9.468 9.214 0.254 1
1 1264 . 17 1 1 A 107 107 SER HA H 107 4.447 4.553 -0.106 1
1 1267 . 17 1 1 A 107 107 SER C C 107 173.785 173.439 0.346 1
1 1268 . 17 1 1 A 107 107 SER CA C 107 60.048 61.044 -0.996 1
1 1269 . 17 1 1 A 107 107 SER CB C 107 64.643 63.558 1.085 1
1 1270 . 17 1 1 A 107 107 SER N N 107 112.962 114.393 -1.431 1
1 1271 . 17 1 1 A 108 108 SER H H 108 7.555 8.274 -0.719 1
1 1272 . 17 1 1 A 108 108 SER HA H 108 4.665 4.984 -0.319 1
1 1275 . 17 1 1 A 108 108 SER C C 108 174.381 174.780 -0.399 1
1 1276 . 17 1 1 A 108 108 SER CA C 108 56.907 57.465 -0.558 1
1 1277 . 17 1 1 A 108 108 SER CB C 108 66.370 65.666 0.704 1
1 1278 . 17 1 1 A 108 108 SER N N 108 112.243 113.497 -1.254 1
1 1279 . 17 1 1 A 109 109 LYS H H 109 8.978 8.830 0.148 1
1 1280 . 17 1 1 A 109 109 LYS HA H 109 4.777 3.913 0.864 1
1 1287 . 17 1 1 A 109 109 LYS C C 109 179.992 178.158 1.834 1
1 1288 . 17 1 1 A 109 109 LYS CA C 109 59.766 60.590 -0.824 1
1 1289 . 17 1 1 A 109 109 LYS CB C 109 32.342 32.347 -0.005 1
1 1293 . 17 1 1 A 109 109 LYS N N 109 123.170 125.118 -1.948 1
1 1294 . 17 1 1 A 110 110 ALA H H 110 8.608 7.960 0.648 1
1 1295 . 17 1 1 A 110 110 ALA HA H 110 4.178 4.088 0.090 1
1 1299 . 17 1 1 A 110 110 ALA C C 110 179.895 179.175 0.720 1
1 1300 . 17 1 1 A 110 110 ALA CA C 110 54.871 55.335 -0.464 1
1 1301 . 17 1 1 A 110 110 ALA CB C 110 18.065 18.393 -0.328 1
1 1302 . 17 1 1 A 110 110 ALA N N 110 123.750 120.941 2.809 1
1 1303 . 17 1 1 A 111 111 GLU H H 111 8.185 8.300 -0.115 1
1 1304 . 17 1 1 A 111 111 GLU HA H 111 4.180 4.012 0.168 1
1 1309 . 17 1 1 A 111 111 GLU C C 111 178.587 178.914 -0.327 1
1 1310 . 17 1 1 A 111 111 GLU CA C 111 59.466 59.898 -0.432 1
1 1311 . 17 1 1 A 111 111 GLU CB C 111 31.067 29.486 1.581 1
1 1313 . 17 1 1 A 111 111 GLU N N 111 119.757 118.661 1.096 1
1 1314 . 17 1 1 A 112 112 ARG H H 112 8.008 8.137 -0.129 1
1 1315 . 17 1 1 A 112 112 ARG HA H 112 3.642 4.180 -0.538 1
1 1322 . 17 1 1 A 112 112 ARG C C 112 176.481 178.248 -1.767 1
1 1323 . 17 1 1 A 112 112 ARG CA C 112 60.419 59.798 0.621 1
1 1324 . 17 1 1 A 112 112 ARG CB C 112 29.957 30.176 -0.219 1
1 1327 . 17 1 1 A 112 112 ARG N N 112 118.430 120.216 -1.786 1
1 1328 . 17 1 1 A 113 113 ALA H H 113 7.985 7.807 0.178 1
1 1329 . 17 1 1 A 113 113 ALA HA H 113 3.925 4.107 -0.182 1
1 1333 . 17 1 1 A 113 113 ALA C C 113 180.117 179.735 0.382 1
1 1334 . 17 1 1 A 113 113 ALA CA C 113 55.372 55.089 0.283 1
1 1335 . 17 1 1 A 113 113 ALA CB C 113 17.825 18.588 -0.763 1
1 1336 . 17 1 1 A 113 113 ALA N N 113 119.980 120.649 -0.669 1
1 1337 . 17 1 1 A 114 114 GLU H H 114 8.093 8.544 -0.451 1
1 1338 . 17 1 1 A 114 114 GLU HA H 114 3.936 3.924 0.012 1
1 1343 . 17 1 1 A 114 114 GLU C C 114 180.586 179.064 1.522 1
1 1344 . 17 1 1 A 114 114 GLU CA C 114 59.148 59.094 0.054 1
1 1345 . 17 1 1 A 114 114 GLU CB C 114 30.080 29.066 1.014 1
1 1347 . 17 1 1 A 114 114 GLU N N 114 117.168 117.351 -0.183 1
1 1348 . 17 1 1 A 115 115 TRP H H 115 7.980 9.132 -1.152 1
1 1349 . 17 1 1 A 115 115 TRP HA H 115 3.775 4.360 -0.585 1
1 1358 . 17 1 1 A 115 115 TRP C C 115 177.714 178.565 -0.851 1
1 1359 . 17 1 1 A 115 115 TRP CA C 115 62.696 59.888 2.808 1
1 1360 . 17 1 1 A 115 115 TRP CB C 115 29.052 28.993 0.059 1
1 1366 . 17 1 1 A 115 115 TRP N N 115 120.974 120.742 0.232 1
1 1368 . 17 1 1 A 116 116 ILE H H 116 8.297 8.249 0.048 1
1 1369 . 17 1 1 A 116 116 ILE HA H 116 3.270 3.434 -0.164 1
1 1379 . 17 1 1 A 116 116 ILE C C 116 177.568 177.635 -0.067 1
1 1380 . 17 1 1 A 116 116 ILE CA C 116 66.643 64.442 2.201 1
1 1381 . 17 1 1 A 116 116 ILE CB C 116 37.606 37.530 0.076 1
1 1385 . 17 1 1 A 116 116 ILE N N 116 118.408 120.153 -1.745 1
1 1386 . 17 1 1 A 117 117 GLU H H 117 8.026 8.692 -0.666 1
1 1387 . 17 1 1 A 117 117 GLU HA H 117 3.880 3.997 -0.117 1
1 1392 . 17 1 1 A 117 117 GLU C C 117 178.476 178.965 -0.489 1
1 1393 . 17 1 1 A 117 117 GLU CA C 117 59.219 59.725 -0.506 1
1 1394 . 17 1 1 A 117 117 GLU CB C 117 29.381 29.639 -0.258 1
1 1396 . 17 1 1 A 117 117 GLU N N 117 117.096 120.382 -3.286 1
1 1397 . 17 1 1 A 118 118 ALA H H 118 7.555 8.428 -0.873 1
1 1398 . 17 1 1 A 118 118 ALA HA H 118 3.952 4.054 -0.102 1
1 1402 . 17 1 1 A 118 118 ALA C C 118 179.862 180.135 -0.273 1
1 1403 . 17 1 1 A 118 118 ALA CA C 118 54.772 55.098 -0.326 1
1 1404 . 17 1 1 A 118 118 ALA CB C 118 18.277 18.477 -0.200 1
1 1405 . 17 1 1 A 118 118 ALA N N 118 119.817 121.312 -1.495 1
1 1406 . 17 1 1 A 119 119 ILE H H 119 8.167 7.977 0.190 1
1 1407 . 17 1 1 A 119 119 ILE HA H 119 3.558 3.747 -0.189 1
1 1417 . 17 1 1 A 119 119 ILE C C 119 178.564 178.108 0.456 1
1 1418 . 17 1 1 A 119 119 ILE CA C 119 65.766 65.244 0.522 1
1 1419 . 17 1 1 A 119 119 ILE CB C 119 38.840 38.026 0.814 1
1 1423 . 17 1 1 A 119 119 ILE N N 119 116.280 117.814 -1.534 1
1 1424 . 17 1 1 A 120 120 LYS H H 120 8.790 7.961 0.829 1
1 1425 . 17 1 1 A 120 120 LYS HA H 120 3.965 4.315 -0.350 1
1 1434 . 17 1 1 A 120 120 LYS C C 120 179.673 179.386 0.287 1
1 1435 . 17 1 1 A 120 120 LYS CA C 120 60.031 60.415 -0.384 1
1 1436 . 17 1 1 A 120 120 LYS CB C 120 32.547 32.232 0.315 1
1 1440 . 17 1 1 A 120 120 LYS N N 120 119.650 118.835 0.815 1
1 1441 . 17 1 1 A 121 121 LYS H H 121 7.594 9.052 -1.458 1
1 1442 . 17 1 1 A 121 121 LYS HA H 121 4.095 3.932 0.163 1
1 1451 . 17 1 1 A 121 121 LYS C C 121 177.962 179.121 -1.159 1
1 1452 . 17 1 1 A 121 121 LYS CA C 121 58.848 59.574 -0.726 1
1 1453 . 17 1 1 A 121 121 LYS CB C 121 32.547 32.401 0.146 1
1 1457 . 17 1 1 A 121 121 LYS N N 121 117.197 119.680 -2.483 1
1 1458 . 17 1 1 A 122 122 LEU H H 122 7.586 7.959 -0.373 1
1 1459 . 17 1 1 A 122 122 LEU HA H 122 4.535 3.994 0.541 1
1 1469 . 17 1 1 A 122 122 LEU C C 122 177.902 177.793 0.109 1
1 1470 . 17 1 1 A 122 122 LEU CA C 122 55.071 57.944 -2.873 1
1 1471 . 17 1 1 A 122 122 LEU CB C 122 42.888 41.721 1.167 1
1 1475 . 17 1 1 A 122 122 LEU N N 122 116.861 120.403 -3.542 1
1 1476 . 17 1 1 A 123 123 THR H H 123 7.636 7.902 -0.266 1
1 1477 . 17 1 1 A 123 123 THR HA H 123 4.445 4.343 0.102 1
1 1482 . 17 1 1 A 123 123 THR C C 123 175.714 174.520 1.194 1
1 1483 . 17 1 1 A 123 123 THR CA C 123 62.643 61.725 0.918 1
1 1484 . 17 1 1 A 123 123 THR CB C 123 70.259 68.050 2.209 1
1 1486 . 17 1 1 A 123 123 THR N N 123 108.963 109.476 -0.513 1
1 1487 . 17 1 1 A 124 124 SER H H 124 7.912 8.340 -0.428 1
1 1488 . 17 1 1 A 124 124 SER HA H 124 4.626 4.298 0.328 1
1 1491 . 17 1 1 A 124 124 SER C C 124 174.405 174.391 0.014 1
1 1492 . 17 1 1 A 124 124 SER CA C 124 58.390 60.147 -1.757 1
1 1493 . 17 1 1 A 124 124 SER CB C 124 64.255 63.534 0.721 1
1 1494 . 17 1 1 A 124 124 SER N N 124 116.876 122.374 -5.498 1
1 1495 . 17 1 1 A 125 125 GLY H H 125 8.307 8.371 -0.064 1
1 1496 . 17 1 1 A 125 125 GLY HA2 H 125 4.166 4.044 0.122 1
1 1497 . 17 1 1 A 125 125 GLY HA3 H 125 4.166 4.046 0.120 1
1 1498 . 17 1 1 A 125 125 GLY C C 125 171.921 174.474 -2.553 1
1 1499 . 17 1 1 A 125 125 GLY CA C 125 44.748 45.999 -1.251 1
1 1500 . 17 1 1 A 125 125 GLY N N 125 110.006 113.419 -3.413 1
1 1501 . 17 1 1 A 126 126 PRO HA H 126 4.510 4.296 0.214 1
1 1508 . 17 1 1 A 126 126 PRO C C 126 177.471 177.023 0.448 1
1 1509 . 17 1 1 A 126 126 PRO CA C 126 63.419 65.198 -1.779 1
1 1510 . 17 1 1 A 126 126 PRO CB C 126 32.106 31.378 0.728 1
1 1513 . 17 1 1 A 127 127 SER H H 127 8.607 7.659 0.948 1
1 1514 . 17 1 1 A 127 127 SER C C 127 174.628 173.775 0.853 1
1 1515 . 17 1 1 A 127 127 SER CA C 127 58.513 59.282 -0.769 1
1 1516 . 17 1 1 A 127 127 SER CB C 127 63.679 65.818 -2.139 1
1 1517 . 17 1 1 A 127 127 SER N N 127 116.390 111.740 4.650 1
1 1518 . 17 1 1 A 128 128 SER H H 128 8.272 7.734 0.538 1
1 1519 . 17 1 1 A 128 128 SER HA H 128 4.496 4.659 -0.163 1
1 1520 . 17 1 1 A 128 128 SER C C 128 173.921 172.366 1.555 1
1 1521 . 17 1 1 A 128 128 SER CA C 128 58.442 57.261 1.181 1
1 1522 . 17 1 1 A 128 128 SER CB C 128 64.173 65.209 -1.036 1
1 1523 . 17 1 1 A 128 128 SER N N 128 117.506 112.389 5.117 1
1 1 . 18 1 1 A 7 7 GLY HA2 H 7 3.978 4.160 -0.182 1
1 2 . 18 1 1 A 7 7 GLY HA3 H 7 3.978 4.162 -0.184 1
1 3 . 18 1 1 A 7 7 GLY C C 7 174.274 174.296 -0.022 1
1 4 . 18 1 1 A 7 7 GLY CA C 7 45.383 44.649 0.734 1
1 5 . 18 1 1 A 8 8 SER H H 8 8.211 8.583 -0.372 1
1 6 . 18 1 1 A 8 8 SER HA H 8 4.425 4.596 -0.171 1
1 9 . 18 1 1 A 8 8 SER C C 8 174.635 173.949 0.686 1
1 10 . 18 1 1 A 8 8 SER CA C 8 58.425 59.699 -1.274 1
1 11 . 18 1 1 A 8 8 SER CB C 8 63.885 65.404 -1.519 1
1 12 . 18 1 1 A 8 8 SER N N 8 115.732 117.083 -1.351 1
1 13 . 18 1 1 A 9 9 LEU H H 9 8.316 7.676 0.640 1
1 14 . 18 1 1 A 9 9 LEU HA H 9 4.334 4.591 -0.257 1
1 24 . 18 1 1 A 9 9 LEU C C 9 177.447 174.537 2.910 1
1 25 . 18 1 1 A 9 9 LEU CA C 9 55.407 54.903 0.504 1
1 26 . 18 1 1 A 9 9 LEU CB C 9 42.171 42.883 -0.712 1
1 30 . 18 1 1 A 9 9 LEU N N 9 123.943 120.333 3.610 1
1 31 . 18 1 1 A 10 10 SER H H 10 8.304 8.747 -0.443 1
1 32 . 18 1 1 A 10 10 SER HA H 10 4.424 5.041 -0.617 1
1 35 . 18 1 1 A 10 10 SER C C 10 175.025 172.671 2.354 1
1 36 . 18 1 1 A 10 10 SER CA C 10 58.425 57.824 0.601 1
1 37 . 18 1 1 A 10 10 SER CB C 10 63.638 65.855 -2.217 1
1 38 . 18 1 1 A 10 10 SER N N 10 116.718 119.723 -3.005 1
1 39 . 18 1 1 A 11 11 THR H H 11 8.003 8.834 -0.831 1
1 40 . 18 1 1 A 11 11 THR HA H 11 4.196 5.111 -0.915 1
1 45 . 18 1 1 A 11 11 THR C C 11 176.296 173.997 2.299 1
1 46 . 18 1 1 A 11 11 THR CA C 11 62.483 60.654 1.829 1
1 47 . 18 1 1 A 11 11 THR CB C 11 69.266 71.780 -2.514 1
1 49 . 18 1 1 A 11 11 THR N N 11 114.902 121.295 -6.393 1
1 50 . 18 1 1 A 12 12 VAL H H 12 8.095 8.491 -0.396 1
1 51 . 18 1 1 A 12 12 VAL HA H 12 3.826 4.146 -0.320 1
1 59 . 18 1 1 A 12 12 VAL C C 12 178.501 176.819 1.682 1
1 60 . 18 1 1 A 12 12 VAL CA C 12 64.760 63.538 1.222 1
1 61 . 18 1 1 A 12 12 VAL CB C 12 32.013 32.976 -0.963 1
1 64 . 18 1 1 A 12 12 VAL N N 12 122.111 120.780 1.331 1
1 65 . 18 1 1 A 13 13 GLU H H 13 8.151 8.736 -0.585 1
1 66 . 18 1 1 A 13 13 GLU HA H 13 3.244 3.308 -0.064 1
1 71 . 18 1 1 A 13 13 GLU C C 13 175.702 178.087 -2.385 1
1 72 . 18 1 1 A 13 13 GLU CA C 13 58.354 59.035 -0.681 1
1 73 . 18 1 1 A 13 13 GLU CB C 13 28.843 28.385 0.458 1
1 75 . 18 1 1 A 13 13 GLU N N 13 120.316 122.659 -2.343 1
1 76 . 18 1 1 A 14 14 LEU H H 14 7.067 7.460 -0.393 1
1 77 . 18 1 1 A 14 14 LEU HA H 14 4.157 4.213 -0.056 1
1 87 . 18 1 1 A 14 14 LEU C C 14 176.863 176.770 0.093 1
1 88 . 18 1 1 A 14 14 LEU CA C 14 53.324 54.352 -1.028 1
1 89 . 18 1 1 A 14 14 LEU CB C 14 41.636 41.196 0.440 1
1 93 . 18 1 1 A 14 14 LEU N N 14 117.035 118.651 -1.616 1
1 94 . 18 1 1 A 15 15 SER H H 15 7.645 7.901 -0.256 1
1 95 . 18 1 1 A 15 15 SER HA H 15 4.305 4.601 -0.296 1
1 98 . 18 1 1 A 15 15 SER C C 15 175.340 172.926 2.414 1
1 99 . 18 1 1 A 15 15 SER CA C 15 59.783 57.266 2.517 1
1 100 . 18 1 1 A 15 15 SER CB C 15 64.625 61.956 2.669 1
1 101 . 18 1 1 A 15 15 SER N N 15 114.216 115.984 -1.768 1
1 102 . 18 1 1 A 16 16 GLY H H 16 8.506 8.294 0.212 1
1 103 . 18 1 1 A 16 16 GLY HA2 H 16 4.237 4.299 -0.062 1
1 104 . 18 1 1 A 16 16 GLY HA3 H 16 3.927 4.319 -0.392 1
1 105 . 18 1 1 A 16 16 GLY C C 16 173.661 172.209 1.452 1
1 106 . 18 1 1 A 16 16 GLY CA C 16 44.995 44.385 0.610 1
1 107 . 18 1 1 A 16 16 GLY N N 16 111.838 112.075 -0.237 1
1 108 . 18 1 1 A 17 17 THR H H 17 8.482 9.033 -0.551 1
1 109 . 18 1 1 A 17 17 THR HA H 17 4.319 4.504 -0.185 1
1 114 . 18 1 1 A 17 17 THR C C 17 174.758 174.682 0.076 1
1 115 . 18 1 1 A 17 17 THR CA C 17 62.272 63.009 -0.737 1
1 116 . 18 1 1 A 17 17 THR CB C 17 70.706 69.319 1.387 1
1 118 . 18 1 1 A 17 17 THR N N 17 116.679 115.179 1.500 1
1 119 . 18 1 1 A 18 18 VAL H H 18 8.948 8.706 0.242 1
1 120 . 18 1 1 A 18 18 VAL HA H 18 3.950 4.198 -0.248 1
1 128 . 18 1 1 A 18 18 VAL C C 18 176.669 176.766 -0.097 1
1 129 . 18 1 1 A 18 18 VAL CA C 18 64.813 63.453 1.360 1
1 130 . 18 1 1 A 18 18 VAL CB C 18 31.807 31.738 0.069 1
1 133 . 18 1 1 A 18 18 VAL N N 18 127.156 126.067 1.089 1
1 134 . 18 1 1 A 19 19 VAL H H 19 9.359 9.473 -0.114 1
1 135 . 18 1 1 A 19 19 VAL HA H 19 4.234 4.347 -0.113 1
1 143 . 18 1 1 A 19 19 VAL C C 19 175.738 175.826 -0.088 1
1 144 . 18 1 1 A 19 19 VAL CA C 19 62.060 62.277 -0.217 1
1 145 . 18 1 1 A 19 19 VAL CB C 19 33.822 33.236 0.586 1
1 148 . 18 1 1 A 19 19 VAL N N 19 125.162 121.738 3.424 1
1 149 . 18 1 1 A 20 20 LYS H H 20 7.584 7.278 0.306 1
1 150 . 18 1 1 A 20 20 LYS HA H 20 4.346 4.601 -0.255 1
1 159 . 18 1 1 A 20 20 LYS C C 20 172.818 173.960 -1.142 1
1 160 . 18 1 1 A 20 20 LYS CA C 20 56.801 55.548 1.253 1
1 161 . 18 1 1 A 20 20 LYS CB C 20 36.624 35.384 1.240 1
1 165 . 18 1 1 A 20 20 LYS N N 20 121.024 120.569 0.455 1
1 166 . 18 1 1 A 21 21 GLN H H 21 8.625 8.499 0.126 1
1 167 . 18 1 1 A 21 21 GLN HA H 21 6.003 5.380 0.623 1
1 174 . 18 1 1 A 21 21 GLN C C 21 174.914 175.182 -0.268 1
1 175 . 18 1 1 A 21 21 GLN CA C 21 54.207 54.482 -0.275 1
1 176 . 18 1 1 A 21 21 GLN CB C 21 33.452 32.990 0.462 1
1 178 . 18 1 1 A 21 21 GLN N N 21 122.108 124.090 -1.982 1
1 180 . 18 1 1 A 22 22 GLY H H 22 8.964 8.461 0.503 1
1 181 . 18 1 1 A 22 22 GLY HA2 H 22 4.665 4.303 0.362 1
1 182 . 18 1 1 A 22 22 GLY HA3 H 22 4.295 4.554 -0.259 1
1 183 . 18 1 1 A 22 22 GLY C C 22 170.879 171.386 -0.507 1
1 184 . 18 1 1 A 22 22 GLY CA C 22 45.683 45.984 -0.301 1
1 185 . 18 1 1 A 22 22 GLY N N 22 108.508 109.043 -0.535 1
1 186 . 18 1 1 A 23 23 TYR H H 23 9.145 8.687 0.458 1
1 187 . 18 1 1 A 23 23 TYR HA H 23 5.595 5.761 -0.166 1
1 194 . 18 1 1 A 23 23 TYR C C 23 175.824 175.507 0.317 1
1 195 . 18 1 1 A 23 23 TYR CA C 23 58.019 56.474 1.545 1
1 196 . 18 1 1 A 23 23 TYR CB C 23 39.251 40.576 -1.325 1
1 201 . 18 1 1 A 23 23 TYR N N 23 120.809 119.746 1.063 1
1 202 . 18 1 1 A 24 24 LEU H H 24 8.935 9.521 -0.586 1
1 203 . 18 1 1 A 24 24 LEU HA H 24 4.716 5.014 -0.298 1
1 213 . 18 1 1 A 24 24 LEU C C 24 174.648 175.878 -1.230 1
1 214 . 18 1 1 A 24 24 LEU CA C 24 53.907 53.229 0.678 1
1 215 . 18 1 1 A 24 24 LEU CB C 24 46.078 45.508 0.570 1
1 219 . 18 1 1 A 24 24 LEU N N 24 122.887 124.548 -1.661 1
1 220 . 18 1 1 A 25 25 ALA H H 25 8.145 8.546 -0.401 1
1 221 . 18 1 1 A 25 25 ALA HA H 25 5.477 5.814 -0.337 1
1 225 . 18 1 1 A 25 25 ALA C C 25 175.751 175.768 -0.017 1
1 226 . 18 1 1 A 25 25 ALA CA C 25 50.719 50.373 0.346 1
1 227 . 18 1 1 A 25 25 ALA CB C 25 21.074 21.663 -0.589 1
1 228 . 18 1 1 A 25 25 ALA N N 25 122.280 123.306 -1.026 1
1 229 . 18 1 1 A 26 26 LYS H H 26 9.167 8.694 0.473 1
1 230 . 18 1 1 A 26 26 LYS HA H 26 5.221 4.618 0.603 1
1 239 . 18 1 1 A 26 26 LYS C C 26 175.421 174.956 0.465 1
1 240 . 18 1 1 A 26 26 LYS CA C 26 54.383 54.771 -0.388 1
1 241 . 18 1 1 A 26 26 LYS CB C 26 36.125 34.366 1.759 1
1 245 . 18 1 1 A 26 26 LYS N N 26 120.638 123.012 -2.374 1
1 246 . 18 1 1 A 27 27 GLN H H 27 7.866 7.789 0.077 1
1 247 . 18 1 1 A 27 27 GLN HA H 27 3.525 4.447 -0.922 1
1 254 . 18 1 1 A 27 27 GLN C C 27 177.022 174.474 2.548 1
1 255 . 18 1 1 A 27 27 GLN CA C 27 55.778 53.789 1.989 1
1 256 . 18 1 1 A 27 27 GLN CB C 27 29.864 29.708 0.156 1
1 258 . 18 1 1 A 27 27 GLN N N 27 130.194 122.627 7.567 1
1 260 . 18 1 1 A 28 28 GLY H H 28 8.565 8.049 0.516 1
1 261 . 18 1 1 A 28 28 GLY HA2 H 28 4.125 3.937 0.188 1
1 262 . 18 1 1 A 28 28 GLY HA3 H 28 4.034 4.104 -0.070 1
1 263 . 18 1 1 A 28 28 GLY C C 28 174.030 172.527 1.503 1
1 264 . 18 1 1 A 28 28 GLY CA C 28 45.665 45.867 -0.202 1
1 265 . 18 1 1 A 28 28 GLY N N 28 115.528 111.599 3.929 1
1 266 . 18 1 1 A 29 29 HIS HA H 29 4.355 5.442 -1.087 1
1 271 . 18 1 1 A 29 29 HIS CA C 29 58.795 53.928 4.867 1
1 272 . 18 1 1 A 29 29 HIS CB C 29 31.283 31.092 0.191 1
1 275 . 18 1 1 A 30 30 LYS HA H 30 4.096 4.455 -0.359 1
1 284 . 18 1 1 A 30 30 LYS CA C 30 57.290 57.576 -0.286 1
1 285 . 18 1 1 A 30 30 LYS CB C 30 31.951 35.356 -3.405 1
1 289 . 18 1 1 A 31 31 ARG HA H 31 3.975 4.682 -0.707 1
1 296 . 18 1 1 A 31 31 ARG CA C 31 55.973 55.413 0.560 1
1 297 . 18 1 1 A 31 31 ARG CB C 31 29.902 33.208 -3.306 1
1 300 . 18 1 1 A 32 32 LYS HA H 32 4.160 4.327 -0.167 1
1 309 . 18 1 1 A 32 32 LYS C C 32 175.678 177.145 -1.467 1
1 310 . 18 1 1 A 32 32 LYS CA C 32 56.254 57.530 -1.276 1
1 311 . 18 1 1 A 32 32 LYS CB C 32 31.602 31.943 -0.341 1
1 315 . 18 1 1 A 33 33 ASN H H 33 7.925 8.765 -0.840 1
1 316 . 18 1 1 A 33 33 ASN HA H 33 4.799 4.539 0.260 1
1 321 . 18 1 1 A 33 33 ASN C C 33 174.005 175.353 -1.348 1
1 322 . 18 1 1 A 33 33 ASN CA C 33 52.407 55.961 -3.554 1
1 323 . 18 1 1 A 33 33 ASN CB C 33 39.879 39.208 0.671 1
1 324 . 18 1 1 A 33 33 ASN N N 33 116.990 120.871 -3.881 1
1 326 . 18 1 1 A 34 34 TRP H H 34 8.798 7.828 0.970 1
1 327 . 18 1 1 A 34 34 TRP HA H 34 4.755 5.329 -0.574 1
1 336 . 18 1 1 A 34 34 TRP C C 34 176.090 175.158 0.932 1
1 337 . 18 1 1 A 34 34 TRP CA C 34 57.119 55.896 1.223 1
1 338 . 18 1 1 A 34 34 TRP CB C 34 30.596 32.219 -1.623 1
1 344 . 18 1 1 A 34 34 TRP N N 34 121.917 115.729 6.188 1
1 346 . 18 1 1 A 35 35 LYS H H 35 8.404 8.489 -0.085 1
1 347 . 18 1 1 A 35 35 LYS HA H 35 4.846 4.845 0.001 1
1 354 . 18 1 1 A 35 35 LYS C C 35 176.088 176.388 -0.300 1
1 355 . 18 1 1 A 35 35 LYS CA C 35 54.418 54.856 -0.438 1
1 356 . 18 1 1 A 35 35 LYS CB C 35 36.125 34.609 1.516 1
1 360 . 18 1 1 A 35 35 LYS N N 35 120.864 123.645 -2.781 1
1 361 . 18 1 1 A 36 36 VAL H H 36 8.977 8.586 0.391 1
1 362 . 18 1 1 A 36 36 VAL HA H 36 4.274 4.431 -0.157 1
1 370 . 18 1 1 A 36 36 VAL C C 36 176.733 176.232 0.501 1
1 371 . 18 1 1 A 36 36 VAL CA C 36 64.319 63.044 1.275 1
1 372 . 18 1 1 A 36 36 VAL CB C 36 31.602 32.346 -0.744 1
1 375 . 18 1 1 A 36 36 VAL N N 36 124.314 123.982 0.332 1
1 376 . 18 1 1 A 37 37 ARG H H 37 9.498 9.736 -0.238 1
1 377 . 18 1 1 A 37 37 ARG HA H 37 5.053 4.960 0.093 1
1 384 . 18 1 1 A 37 37 ARG C C 37 174.442 173.967 0.475 1
1 385 . 18 1 1 A 37 37 ARG CA C 37 53.272 54.931 -1.659 1
1 386 . 18 1 1 A 37 37 ARG CB C 37 34.563 34.595 -0.032 1
1 389 . 18 1 1 A 37 37 ARG N N 37 128.121 125.494 2.627 1
1 390 . 18 1 1 A 38 38 ARG H H 38 8.755 9.181 -0.426 1
1 391 . 18 1 1 A 38 38 ARG HA H 38 4.626 4.756 -0.130 1
1 398 . 18 1 1 A 38 38 ARG C C 38 175.514 174.777 0.737 1
1 399 . 18 1 1 A 38 38 ARG CA C 38 55.601 54.934 0.667 1
1 400 . 18 1 1 A 38 38 ARG CB C 38 32.219 31.501 0.718 1
1 403 . 18 1 1 A 38 38 ARG N N 38 121.442 125.063 -3.621 1
1 404 . 18 1 1 A 39 39 PHE H H 39 9.865 9.134 0.731 1
1 405 . 18 1 1 A 39 39 PHE HA H 39 5.424 5.112 0.312 1
1 413 . 18 1 1 A 39 39 PHE C C 39 175.423 174.758 0.665 1
1 414 . 18 1 1 A 39 39 PHE CA C 39 57.419 56.983 0.436 1
1 415 . 18 1 1 A 39 39 PHE CB C 39 42.623 40.758 1.865 1
1 421 . 18 1 1 A 39 39 PHE N N 39 130.027 126.651 3.376 1
1 422 . 18 1 1 A 40 40 VAL H H 40 9.300 10.131 -0.831 1
1 423 . 18 1 1 A 40 40 VAL HA H 40 4.846 5.318 -0.472 1
1 431 . 18 1 1 A 40 40 VAL C C 40 174.477 173.463 1.014 1
1 432 . 18 1 1 A 40 40 VAL CA C 40 62.343 59.879 2.464 1
1 433 . 18 1 1 A 40 40 VAL CB C 40 35.755 35.100 0.655 1
1 436 . 18 1 1 A 40 40 VAL N N 40 119.369 122.539 -3.170 1
1 437 . 18 1 1 A 41 41 LEU H H 41 9.557 9.582 -0.025 1
1 438 . 18 1 1 A 41 41 LEU HA H 41 5.292 5.275 0.017 1
1 448 . 18 1 1 A 41 41 LEU C C 41 174.632 175.305 -0.673 1
1 449 . 18 1 1 A 41 41 LEU CA C 41 53.571 53.525 0.046 1
1 450 . 18 1 1 A 41 41 LEU CB C 41 45.337 44.979 0.358 1
1 454 . 18 1 1 A 41 41 LEU N N 41 132.121 129.145 2.976 1
1 455 . 18 1 1 A 42 42 ARG H H 42 9.396 9.002 0.394 1
1 456 . 18 1 1 A 42 42 ARG HA H 42 5.366 5.760 -0.394 1
1 464 . 18 1 1 A 42 42 ARG C C 42 173.997 175.196 -1.199 1
1 465 . 18 1 1 A 42 42 ARG CA C 42 54.631 54.170 0.461 1
1 466 . 18 1 1 A 42 42 ARG CB C 42 35.550 33.963 1.587 1
1 469 . 18 1 1 A 42 42 ARG N N 42 128.120 125.282 2.838 1
1 471 . 18 1 1 A 43 43 LYS H H 43 8.597 9.662 -1.065 1
1 472 . 18 1 1 A 43 43 LYS HA H 43 4.558 4.948 -0.390 1
1 481 . 18 1 1 A 43 43 LYS C C 43 174.648 175.321 -0.673 1
1 482 . 18 1 1 A 43 43 LYS CA C 43 53.378 54.718 -1.340 1
1 483 . 18 1 1 A 43 43 LYS CB C 43 37.303 35.835 1.468 1
1 487 . 18 1 1 A 43 43 LYS N N 43 114.484 119.651 -5.167 1
1 488 . 18 1 1 A 44 44 ASP H H 44 8.388 9.020 -0.632 1
1 489 . 18 1 1 A 44 44 ASP HA H 44 4.349 4.316 0.033 1
1 492 . 18 1 1 A 44 44 ASP C C 44 173.376 174.323 -0.947 1
1 493 . 18 1 1 A 44 44 ASP CA C 44 54.842 54.973 -0.131 1
1 494 . 18 1 1 A 44 44 ASP CB C 44 39.991 39.519 0.472 1
1 495 . 18 1 1 A 44 44 ASP N N 44 115.453 119.468 -4.015 1
1 496 . 18 1 1 A 45 45 PRO HA H 45 4.652 4.649 0.003 1
1 503 . 18 1 1 A 45 45 PRO C C 45 176.914 175.614 1.300 1
1 504 . 18 1 1 A 45 45 PRO CA C 45 63.490 62.669 0.821 1
1 505 . 18 1 1 A 45 45 PRO CB C 45 34.892 32.661 2.231 1
1 508 . 18 1 1 A 46 46 ALA H H 46 8.112 8.483 -0.371 1
1 509 . 18 1 1 A 46 46 ALA HA H 46 5.455 4.693 0.762 1
1 513 . 18 1 1 A 46 46 ALA C C 46 177.234 176.713 0.521 1
1 514 . 18 1 1 A 46 46 ALA CA C 46 51.560 51.005 0.555 1
1 515 . 18 1 1 A 46 46 ALA CB C 46 20.122 19.621 0.501 1
1 516 . 18 1 1 A 46 46 ALA N N 46 120.155 123.658 -3.503 1
1 517 . 18 1 1 A 47 47 PHE H H 47 8.717 9.049 -0.332 1
1 518 . 18 1 1 A 47 47 PHE HA H 47 4.795 5.074 -0.279 1
1 526 . 18 1 1 A 47 47 PHE C C 47 172.588 174.366 -1.778 1
1 527 . 18 1 1 A 47 47 PHE CA C 47 57.348 56.260 1.088 1
1 528 . 18 1 1 A 47 47 PHE CB C 47 47.123 44.171 2.952 1
1 534 . 18 1 1 A 47 47 PHE N N 47 129.946 119.801 10.145 1
1 535 . 18 1 1 A 48 48 LEU H H 48 7.883 8.080 -0.197 1
1 536 . 18 1 1 A 48 48 LEU HA H 48 5.198 5.113 0.085 1
1 546 . 18 1 1 A 48 48 LEU C C 48 173.569 174.396 -0.827 1
1 547 . 18 1 1 A 48 48 LEU CA C 48 53.290 54.214 -0.924 1
1 548 . 18 1 1 A 48 48 LEU CB C 48 45.502 45.645 -0.143 1
1 552 . 18 1 1 A 48 48 LEU N N 48 121.108 121.583 -0.475 1
1 553 . 18 1 1 A 49 49 HIS H H 49 8.606 9.003 -0.397 1
1 554 . 18 1 1 A 49 49 HIS HA H 49 5.035 5.090 -0.055 1
1 559 . 18 1 1 A 49 49 HIS C C 49 173.993 173.814 0.179 1
1 560 . 18 1 1 A 49 49 HIS CA C 49 56.483 53.935 2.548 1
1 561 . 18 1 1 A 49 49 HIS CB C 49 35.919 33.871 2.048 1
1 564 . 18 1 1 A 49 49 HIS N N 49 121.199 125.666 -4.467 1
1 565 . 18 1 1 A 50 50 TYR H H 50 7.777 8.279 -0.502 1
1 566 . 18 1 1 A 50 50 TYR HA H 50 5.695 5.721 -0.026 1
1 573 . 18 1 1 A 50 50 TYR C C 50 174.284 172.188 2.096 1
1 574 . 18 1 1 A 50 50 TYR CA C 50 53.430 55.526 -2.096 1
1 575 . 18 1 1 A 50 50 TYR CB C 50 38.552 41.325 -2.773 1
1 580 . 18 1 1 A 50 50 TYR N N 50 114.156 117.158 -3.002 1
1 581 . 18 1 1 A 51 51 TYR H H 51 9.323 9.796 -0.473 1
1 582 . 18 1 1 A 51 51 TYR HA H 51 4.600 5.040 -0.440 1
1 589 . 18 1 1 A 51 51 TYR C C 51 175.352 174.436 0.916 1
1 590 . 18 1 1 A 51 51 TYR CA C 51 57.330 56.348 0.982 1
1 591 . 18 1 1 A 51 51 TYR CB C 51 41.683 42.746 -1.063 1
1 596 . 18 1 1 A 51 51 TYR N N 51 119.100 119.586 -0.486 1
1 597 . 18 1 1 A 52 52 ASP H H 52 9.375 8.704 0.671 1
1 598 . 18 1 1 A 52 52 ASP HA H 52 5.064 4.962 0.102 1
1 601 . 18 1 1 A 52 52 ASP C C 52 175.484 175.850 -0.366 1
1 602 . 18 1 1 A 52 52 ASP CA C 52 51.313 51.357 -0.044 1
1 603 . 18 1 1 A 52 52 ASP CB C 52 41.883 42.308 -0.425 1
1 604 . 18 1 1 A 52 52 ASP N N 52 124.636 123.709 0.927 1
1 605 . 18 1 1 A 53 53 PRO HA H 53 4.678 4.672 0.006 1
1 612 . 18 1 1 A 53 53 PRO C C 53 176.781 177.563 -0.782 1
1 613 . 18 1 1 A 53 53 PRO CA C 53 64.054 64.220 -0.166 1
1 614 . 18 1 1 A 53 53 PRO CB C 53 32.589 32.093 0.496 1
1 617 . 18 1 1 A 54 54 SER H H 54 8.685 9.610 -0.925 1
1 618 . 18 1 1 A 54 54 SER HA H 54 4.483 4.388 0.095 1
1 621 . 18 1 1 A 54 54 SER C C 54 174.006 174.668 -0.662 1
1 622 . 18 1 1 A 54 54 SER CA C 54 59.378 60.511 -1.133 1
1 623 . 18 1 1 A 54 54 SER CB C 54 64.132 64.143 -0.011 1
1 624 . 18 1 1 A 54 54 SER N N 54 113.769 112.904 0.865 1
1 625 . 18 1 1 A 55 55 LYS H H 55 7.706 8.014 -0.308 1
1 626 . 18 1 1 A 55 55 LYS HA H 55 4.580 4.712 -0.132 1
1 635 . 18 1 1 A 55 55 LYS C C 55 175.969 175.591 0.378 1
1 636 . 18 1 1 A 55 55 LYS CA C 55 55.160 55.004 0.156 1
1 637 . 18 1 1 A 55 55 LYS CB C 55 34.069 34.248 -0.179 1
1 641 . 18 1 1 A 55 55 LYS N N 55 122.222 119.924 2.298 1
1 642 . 18 1 1 A 56 56 GLU H H 56 8.666 8.658 0.008 1
1 643 . 18 1 1 A 56 56 GLU HA H 56 4.174 4.999 -0.825 1
1 648 . 18 1 1 A 56 56 GLU C C 56 177.084 174.639 2.445 1
1 649 . 18 1 1 A 56 56 GLU CA C 56 57.099 55.548 1.551 1
1 650 . 18 1 1 A 56 56 GLU CB C 56 29.694 30.818 -1.124 1
1 652 . 18 1 1 A 56 56 GLU N N 56 122.015 119.328 2.687 1
1 653 . 18 1 1 A 57 57 GLU H H 57 8.303 8.587 -0.284 1
1 654 . 18 1 1 A 57 57 GLU HA H 57 4.214 4.693 -0.479 1
1 659 . 18 1 1 A 57 57 GLU CA C 57 56.960 55.424 1.536 1
1 660 . 18 1 1 A 57 57 GLU CB C 57 30.264 33.903 -3.639 1
1 662 . 18 1 1 A 57 57 GLU N N 57 119.884 124.283 -4.399 1
1 663 . 18 1 1 A 58 58 ASN HA H 58 4.768 4.862 -0.094 1
1 668 . 18 1 1 A 58 58 ASN C C 58 174.902 174.428 0.474 1
1 669 . 18 1 1 A 58 58 ASN CA C 58 52.740 52.944 -0.204 1
1 670 . 18 1 1 A 58 58 ASN CB C 58 38.116 36.641 1.475 1
1 672 . 18 1 1 A 59 59 ARG H H 59 7.805 8.265 -0.460 1
1 673 . 18 1 1 A 59 59 ARG HA H 59 4.762 4.766 -0.004 1
1 680 . 18 1 1 A 59 59 ARG CA C 59 53.151 54.696 -1.545 1
1 681 . 18 1 1 A 59 59 ARG CB C 59 31.519 33.419 -1.900 1
1 684 . 18 1 1 A 59 59 ARG N N 59 121.060 123.899 -2.839 1
1 685 . 18 1 1 A 60 60 PRO HA H 60 3.357 4.075 -0.718 1
1 692 . 18 1 1 A 60 60 PRO C C 60 176.817 176.163 0.654 1
1 693 . 18 1 1 A 60 60 PRO CA C 60 63.031 61.856 1.175 1
1 694 . 18 1 1 A 60 60 PRO CB C 60 31.273 32.210 -0.937 1
1 697 . 18 1 1 A 61 61 VAL H H 61 8.627 8.790 -0.163 1
1 698 . 18 1 1 A 61 61 VAL HA H 61 3.966 3.942 0.024 1
1 706 . 18 1 1 A 61 61 VAL C C 61 176.503 175.827 0.676 1
1 707 . 18 1 1 A 61 61 VAL CA C 61 63.154 63.633 -0.479 1
1 708 . 18 1 1 A 61 61 VAL CB C 61 32.048 32.371 -0.323 1
1 711 . 18 1 1 A 61 61 VAL N N 61 119.185 119.528 -0.343 1
1 712 . 18 1 1 A 62 62 GLY H H 62 6.715 6.202 0.513 1
1 713 . 18 1 1 A 62 62 GLY HA2 H 62 3.940 3.885 0.055 1
1 714 . 18 1 1 A 62 62 GLY HA3 H 62 3.538 3.908 -0.370 1
1 715 . 18 1 1 A 62 62 GLY C C 62 169.983 171.507 -1.524 1
1 716 . 18 1 1 A 62 62 GLY CA C 62 44.465 45.622 -1.157 1
1 717 . 18 1 1 A 62 62 GLY N N 62 105.813 106.231 -0.418 1
1 718 . 18 1 1 A 63 63 GLY H H 63 8.004 8.474 -0.470 1
1 719 . 18 1 1 A 63 63 GLY HA2 H 63 4.095 3.353 0.742 1
1 720 . 18 1 1 A 63 63 GLY HA3 H 63 3.813 3.879 -0.066 1
1 721 . 18 1 1 A 63 63 GLY C C 63 171.870 172.540 -0.670 1
1 722 . 18 1 1 A 63 63 GLY CA C 63 47.148 44.550 2.598 1
1 723 . 18 1 1 A 63 63 GLY N N 63 105.089 107.861 -2.772 1
1 724 . 18 1 1 A 64 64 PHE H H 64 7.967 7.477 0.490 1
1 725 . 18 1 1 A 64 64 PHE HA H 64 4.934 5.647 -0.713 1
1 733 . 18 1 1 A 64 64 PHE C C 64 173.140 173.401 -0.261 1
1 734 . 18 1 1 A 64 64 PHE CA C 64 55.248 55.198 0.050 1
1 735 . 18 1 1 A 64 64 PHE CB C 64 40.238 42.418 -2.180 1
1 741 . 18 1 1 A 64 64 PHE N N 64 113.387 120.100 -6.713 1
1 742 . 18 1 1 A 65 65 SER H H 65 8.518 8.597 -0.079 1
1 743 . 18 1 1 A 65 65 SER HA H 65 3.264 4.164 -0.900 1
1 746 . 18 1 1 A 65 65 SER C C 65 176.417 175.053 1.364 1
1 747 . 18 1 1 A 65 65 SER CA C 65 56.819 57.107 -0.288 1
1 748 . 18 1 1 A 65 65 SER CB C 65 63.391 63.561 -0.170 1
1 749 . 18 1 1 A 65 65 SER N N 65 114.674 116.253 -1.579 1
1 750 . 18 1 1 A 66 66 LEU H H 66 7.404 8.370 -0.966 1
1 751 . 18 1 1 A 66 66 LEU HA H 66 4.470 4.115 0.355 1
1 761 . 18 1 1 A 66 66 LEU C C 66 177.993 177.582 0.411 1
1 762 . 18 1 1 A 66 66 LEU CA C 66 54.242 57.456 -3.214 1
1 763 . 18 1 1 A 66 66 LEU CB C 66 42.787 42.123 0.664 1
1 767 . 18 1 1 A 66 66 LEU N N 66 123.988 129.022 -5.034 1
1 768 . 18 1 1 A 67 67 ARG H H 67 7.865 7.421 0.444 1
1 769 . 18 1 1 A 67 67 ARG HA H 67 4.175 4.032 0.143 1
1 776 . 18 1 1 A 67 67 ARG C C 67 178.562 177.143 1.419 1
1 777 . 18 1 1 A 67 67 ARG CA C 67 58.143 58.123 0.020 1
1 778 . 18 1 1 A 67 67 ARG CB C 67 29.052 29.993 -0.941 1
1 781 . 18 1 1 A 67 67 ARG N N 67 122.494 118.396 4.098 1
1 782 . 18 1 1 A 68 68 GLY H H 68 9.398 8.714 0.684 1
1 783 . 18 1 1 A 68 68 GLY HA2 H 68 4.066 3.959 0.107 1
1 784 . 18 1 1 A 68 68 GLY HA3 H 68 3.908 3.962 -0.054 1
1 785 . 18 1 1 A 68 68 GLY C C 68 173.982 173.901 0.081 1
1 786 . 18 1 1 A 68 68 GLY CA C 68 46.230 45.657 0.573 1
1 787 . 18 1 1 A 68 68 GLY N N 68 117.548 113.401 4.147 1
1 788 . 18 1 1 A 69 69 SER H H 69 7.829 8.037 -0.208 1
1 789 . 18 1 1 A 69 69 SER HA H 69 4.807 4.971 -0.164 1
1 792 . 18 1 1 A 69 69 SER C C 69 172.854 173.001 -0.147 1
1 793 . 18 1 1 A 69 69 SER CA C 69 59.290 57.269 2.021 1
1 794 . 18 1 1 A 69 69 SER CB C 69 65.366 66.833 -1.467 1
1 795 . 18 1 1 A 69 69 SER N N 69 115.188 115.430 -0.242 1
1 796 . 18 1 1 A 70 70 LEU H H 70 8.805 8.683 0.122 1
1 797 . 18 1 1 A 70 70 LEU HA H 70 4.846 4.863 -0.017 1
1 807 . 18 1 1 A 70 70 LEU C C 70 175.775 174.289 1.486 1
1 808 . 18 1 1 A 70 70 LEU CA C 70 53.907 53.875 0.032 1
1 809 . 18 1 1 A 70 70 LEU CB C 70 45.337 45.205 0.132 1
1 813 . 18 1 1 A 70 70 LEU N N 70 121.265 122.888 -1.623 1
1 814 . 18 1 1 A 71 71 VAL H H 71 8.644 8.660 -0.016 1
1 815 . 18 1 1 A 71 71 VAL HA H 71 5.555 5.140 0.415 1
1 823 . 18 1 1 A 71 71 VAL C C 71 173.636 173.322 0.314 1
1 824 . 18 1 1 A 71 71 VAL CA C 71 58.760 60.050 -1.290 1
1 825 . 18 1 1 A 71 71 VAL CB C 71 34.891 35.514 -0.623 1
1 828 . 18 1 1 A 71 71 VAL N N 71 122.315 122.356 -0.041 1
1 829 . 18 1 1 A 72 72 SER H H 72 8.750 8.822 -0.072 1
1 830 . 18 1 1 A 72 72 SER HA H 72 4.742 4.951 -0.209 1
1 833 . 18 1 1 A 72 72 SER C C 72 173.058 172.583 0.475 1
1 834 . 18 1 1 A 72 72 SER CA C 72 57.190 57.843 -0.653 1
1 835 . 18 1 1 A 72 72 SER CB C 72 65.612 67.594 -1.982 1
1 836 . 18 1 1 A 72 72 SER N N 72 118.611 121.508 -2.897 1
1 837 . 18 1 1 A 73 73 ALA H H 73 9.009 8.664 0.345 1
1 838 . 18 1 1 A 73 73 ALA HA H 73 4.406 5.038 -0.632 1
1 842 . 18 1 1 A 73 73 ALA C C 73 176.708 176.977 -0.269 1
1 843 . 18 1 1 A 73 73 ALA CA C 73 52.672 50.393 2.279 1
1 844 . 18 1 1 A 73 73 ALA CB C 73 18.812 20.649 -1.837 1
1 845 . 18 1 1 A 73 73 ALA N N 73 125.694 125.680 0.014 1
1 846 . 18 1 1 A 74 74 LEU H H 74 7.800 8.983 -1.183 1
1 847 . 18 1 1 A 74 74 LEU HA H 74 4.716 4.436 0.280 1
1 857 . 18 1 1 A 74 74 LEU C C 74 176.551 177.914 -1.363 1
1 858 . 18 1 1 A 74 74 LEU CA C 74 53.784 54.605 -0.821 1
1 859 . 18 1 1 A 74 74 LEU CB C 74 43.446 40.803 2.643 1
1 863 . 18 1 1 A 74 74 LEU N N 74 122.271 122.556 -0.285 1
1 864 . 18 1 1 A 75 75 GLU H H 75 8.855 8.636 0.219 1
1 865 . 18 1 1 A 75 75 GLU HA H 75 4.336 4.585 -0.249 1
1 870 . 18 1 1 A 75 75 GLU C C 75 176.465 175.452 1.013 1
1 871 . 18 1 1 A 75 75 GLU CA C 75 56.507 56.141 0.366 1
1 872 . 18 1 1 A 75 75 GLU CB C 75 30.245 29.174 1.071 1
1 874 . 18 1 1 A 75 75 GLU N N 75 122.678 120.941 1.737 1
1 875 . 18 1 1 A 76 76 ASP H H 76 8.542 7.635 0.907 1
1 876 . 18 1 1 A 76 76 ASP HA H 76 4.665 5.133 -0.468 1
1 879 . 18 1 1 A 76 76 ASP C C 76 176.087 175.247 0.840 1
1 880 . 18 1 1 A 76 76 ASP CA C 76 55.107 52.985 2.122 1
1 881 . 18 1 1 A 76 76 ASP CB C 76 41.431 42.327 -0.896 1
1 882 . 18 1 1 A 76 76 ASP N N 76 121.488 121.152 0.336 1
1 883 . 18 1 1 A 77 77 ASN H H 77 8.322 8.768 -0.446 1
1 884 . 18 1 1 A 77 77 ASN HA H 77 4.729 4.765 -0.036 1
1 889 . 18 1 1 A 77 77 ASN C C 77 175.566 175.620 -0.054 1
1 890 . 18 1 1 A 77 77 ASN CA C 77 53.131 53.960 -0.829 1
1 891 . 18 1 1 A 77 77 ASN CB C 77 38.617 36.968 1.649 1
1 892 . 18 1 1 A 77 77 ASN N N 77 118.676 123.144 -4.468 1
1 894 . 18 1 1 A 78 78 GLY H H 78 8.311 8.284 0.027 1
1 895 . 18 1 1 A 78 78 GLY HA2 H 78 3.897 4.076 -0.179 1
1 896 . 18 1 1 A 78 78 GLY HA3 H 78 3.897 4.081 -0.184 1
1 897 . 18 1 1 A 78 78 GLY C C 78 173.376 173.276 0.100 1
1 898 . 18 1 1 A 78 78 GLY CA C 78 45.224 45.635 -0.411 1
1 899 . 18 1 1 A 78 78 GLY N N 78 108.939 110.851 -1.912 1
1 900 . 18 1 1 A 79 79 VAL H H 79 7.882 8.589 -0.707 1
1 901 . 18 1 1 A 79 79 VAL HA H 79 4.345 4.327 0.018 1
1 909 . 18 1 1 A 79 79 VAL CA C 79 59.995 60.989 -0.994 1
1 910 . 18 1 1 A 79 79 VAL CB C 79 32.589 31.477 1.112 1
1 913 . 18 1 1 A 79 79 VAL N N 79 121.135 119.665 1.470 1
1 914 . 18 1 1 A 80 80 PRO HA H 80 4.461 4.644 -0.183 1
1 921 . 18 1 1 A 80 80 PRO C C 80 176.979 176.559 0.420 1
1 922 . 18 1 1 A 80 80 PRO CA C 80 63.101 62.234 0.867 1
1 923 . 18 1 1 A 80 80 PRO CB C 80 32.177 32.624 -0.447 1
1 926 . 18 1 1 A 81 81 THR H H 81 8.281 8.437 -0.156 1
1 927 . 18 1 1 A 81 81 THR HA H 81 4.095 3.813 0.282 1
1 932 . 18 1 1 A 81 81 THR C C 81 175.270 175.961 -0.691 1
1 933 . 18 1 1 A 81 81 THR CA C 81 62.872 64.512 -1.640 1
1 934 . 18 1 1 A 81 81 THR CB C 81 69.642 68.379 1.263 1
1 936 . 18 1 1 A 81 81 THR N N 81 114.684 116.976 -2.292 1
1 937 . 18 1 1 A 82 82 GLY H H 82 8.338 8.798 -0.460 1
1 938 . 18 1 1 A 82 82 GLY HA2 H 82 4.095 3.825 0.270 1
1 939 . 18 1 1 A 82 82 GLY HA3 H 82 3.668 3.844 -0.176 1
1 940 . 18 1 1 A 82 82 GLY C C 82 174.139 174.619 -0.480 1
1 941 . 18 1 1 A 82 82 GLY CA C 82 45.083 47.035 -1.952 1
1 942 . 18 1 1 A 82 82 GLY N N 82 111.289 113.494 -2.205 1
1 943 . 18 1 1 A 83 83 VAL H H 83 7.668 7.925 -0.257 1
1 944 . 18 1 1 A 83 83 VAL HA H 83 3.985 3.792 0.193 1
1 952 . 18 1 1 A 83 83 VAL C C 83 176.054 175.929 0.125 1
1 953 . 18 1 1 A 83 83 VAL CA C 83 62.431 62.469 -0.038 1
1 954 . 18 1 1 A 83 83 VAL CB C 83 32.260 30.261 1.999 1
1 957 . 18 1 1 A 83 83 VAL N N 83 120.003 121.758 -1.755 1
1 958 . 18 1 1 A 84 84 LYS H H 84 8.645 8.121 0.524 1
1 959 . 18 1 1 A 84 84 LYS HA H 84 4.276 4.053 0.223 1
1 968 . 18 1 1 A 84 84 LYS C C 84 176.832 179.905 -3.073 1
1 969 . 18 1 1 A 84 84 LYS CA C 84 56.272 59.242 -2.970 1
1 970 . 18 1 1 A 84 84 LYS CB C 84 32.876 32.116 0.760 1
1 974 . 18 1 1 A 84 84 LYS N N 84 126.447 126.257 0.190 1
1 975 . 18 1 1 A 85 85 GLY H H 85 8.410 8.411 -0.001 1
1 976 . 18 1 1 A 85 85 GLY HA2 H 85 4.066 4.006 0.060 1
1 977 . 18 1 1 A 85 85 GLY HA3 H 85 3.781 4.251 -0.470 1
1 978 . 18 1 1 A 85 85 GLY C C 85 173.969 174.098 -0.129 1
1 979 . 18 1 1 A 85 85 GLY CA C 85 45.146 46.868 -1.722 1
1 980 . 18 1 1 A 85 85 GLY N N 85 109.957 107.863 2.094 1
1 981 . 18 1 1 A 86 86 ASN H H 86 8.298 9.024 -0.726 1
1 982 . 18 1 1 A 86 86 ASN HA H 86 4.665 4.324 0.341 1
1 987 . 18 1 1 A 86 86 ASN C C 86 174.987 173.927 1.060 1
1 988 . 18 1 1 A 86 86 ASN CA C 86 52.989 54.160 -1.171 1
1 989 . 18 1 1 A 86 86 ASN CB C 86 38.376 36.846 1.530 1
1 990 . 18 1 1 A 86 86 ASN N N 86 118.457 114.575 3.882 1
1 992 . 18 1 1 A 87 87 VAL H H 87 7.660 8.000 -0.340 1
1 993 . 18 1 1 A 87 87 VAL HA H 87 3.946 4.226 -0.280 1
1 1001 . 18 1 1 A 87 87 VAL C C 87 174.902 175.129 -0.227 1
1 1002 . 18 1 1 A 87 87 VAL CA C 87 62.307 61.071 1.236 1
1 1003 . 18 1 1 A 87 87 VAL CB C 87 32.548 32.778 -0.230 1
1 1006 . 18 1 1 A 87 87 VAL N N 87 120.557 117.794 2.763 1
1 1007 . 18 1 1 A 88 88 GLN H H 88 8.115 8.399 -0.284 1
1 1008 . 18 1 1 A 88 88 GLN HA H 88 4.302 4.457 -0.155 1
1 1015 . 18 1 1 A 88 88 GLN C C 88 175.637 176.927 -1.290 1
1 1016 . 18 1 1 A 88 88 GLN CA C 88 55.336 56.633 -1.297 1
1 1017 . 18 1 1 A 88 88 GLN CB C 88 30.574 29.766 0.808 1
1 1019 . 18 1 1 A 88 88 GLN N N 88 122.280 124.847 -2.567 1
1 1021 . 18 1 1 A 89 89 GLY H H 89 8.544 8.221 0.323 1
1 1022 . 18 1 1 A 89 89 GLY HA2 H 89 3.885 3.753 0.132 1
1 1023 . 18 1 1 A 89 89 GLY HA3 H 89 3.885 3.774 0.111 1
1 1024 . 18 1 1 A 89 89 GLY C C 89 172.861 174.187 -1.326 1
1 1025 . 18 1 1 A 89 89 GLY CA C 89 44.889 47.260 -2.371 1
1 1026 . 18 1 1 A 89 89 GLY N N 89 110.135 109.209 0.926 1
1 1027 . 18 1 1 A 90 90 ASN H H 90 8.451 8.483 -0.032 1
1 1028 . 18 1 1 A 90 90 ASN HA H 90 4.222 4.980 -0.758 1
1 1033 . 18 1 1 A 90 90 ASN C C 90 174.926 174.472 0.454 1
1 1034 . 18 1 1 A 90 90 ASN CA C 90 54.613 52.106 2.507 1
1 1035 . 18 1 1 A 90 90 ASN CB C 90 37.852 39.502 -1.650 1
1 1036 . 18 1 1 A 90 90 ASN N N 90 114.322 122.776 -8.454 1
1 1038 . 18 1 1 A 91 91 LEU H H 91 8.933 7.195 1.738 1
1 1039 . 18 1 1 A 91 91 LEU HA H 91 5.367 4.338 1.029 1
1 1049 . 18 1 1 A 91 91 LEU C C 91 178.732 176.214 2.518 1
1 1050 . 18 1 1 A 91 91 LEU CA C 91 55.160 55.021 0.139 1
1 1051 . 18 1 1 A 91 91 LEU CB C 91 45.461 42.583 2.878 1
1 1055 . 18 1 1 A 91 91 LEU N N 91 120.057 121.346 -1.289 1
1 1056 . 18 1 1 A 92 92 PHE H H 92 9.901 7.769 2.132 1
1 1057 . 18 1 1 A 92 92 PHE HA H 92 5.105 5.471 -0.366 1
1 1065 . 18 1 1 A 92 92 PHE C C 92 170.140 172.690 -2.550 1
1 1066 . 18 1 1 A 92 92 PHE CA C 92 56.236 55.484 0.752 1
1 1067 . 18 1 1 A 92 92 PHE CB C 92 42.664 42.691 -0.027 1
1 1073 . 18 1 1 A 92 92 PHE N N 92 119.740 116.205 3.535 1
1 1074 . 18 1 1 A 93 93 LYS H H 93 9.154 9.149 0.005 1
1 1075 . 18 1 1 A 93 93 LYS HA H 93 5.584 5.199 0.385 1
1 1083 . 18 1 1 A 93 93 LYS C C 93 174.830 174.785 0.045 1
1 1084 . 18 1 1 A 93 93 LYS CA C 93 53.148 53.930 -0.782 1
1 1085 . 18 1 1 A 93 93 LYS CB C 93 36.660 36.519 0.141 1
1 1089 . 18 1 1 A 93 93 LYS N N 93 117.710 118.181 -0.471 1
1 1090 . 18 1 1 A 94 94 VAL H H 94 8.507 8.572 -0.065 1
1 1091 . 18 1 1 A 94 94 VAL HA H 94 4.872 5.288 -0.416 1
1 1099 . 18 1 1 A 94 94 VAL C C 94 174.408 174.545 -0.137 1
1 1100 . 18 1 1 A 94 94 VAL CA C 94 60.525 61.109 -0.584 1
1 1101 . 18 1 1 A 94 94 VAL CB C 94 34.862 34.988 -0.126 1
1 1104 . 18 1 1 A 94 94 VAL N N 94 121.741 119.786 1.955 1
1 1105 . 18 1 1 A 95 95 ILE H H 95 8.959 8.951 0.008 1
1 1106 . 18 1 1 A 95 95 ILE HA H 95 4.794 5.572 -0.778 1
1 1116 . 18 1 1 A 95 95 ILE C C 95 177.642 176.383 1.259 1
1 1117 . 18 1 1 A 95 95 ILE CA C 95 59.713 60.072 -0.359 1
1 1118 . 18 1 1 A 95 95 ILE CB C 95 40.032 39.153 0.879 1
1 1122 . 18 1 1 A 95 95 ILE N N 95 126.794 129.146 -2.352 1
1 1123 . 18 1 1 A 96 96 THR H H 96 8.765 8.787 -0.022 1
1 1124 . 18 1 1 A 96 96 THR HA H 96 4.584 4.732 -0.148 1
1 1129 . 18 1 1 A 96 96 THR C C 96 177.023 176.093 0.930 1
1 1130 . 18 1 1 A 96 96 THR CA C 96 61.372 60.701 0.671 1
1 1131 . 18 1 1 A 96 96 THR CB C 96 70.794 71.588 -0.794 1
1 1133 . 18 1 1 A 96 96 THR N N 96 117.225 120.684 -3.459 1
1 1134 . 18 1 1 A 97 97 LYS H H 97 8.736 9.059 -0.323 1
1 1135 . 18 1 1 A 97 97 LYS HA H 97 4.101 4.013 0.088 1
1 1144 . 18 1 1 A 97 97 LYS C C 97 176.490 178.424 -1.934 1
1 1145 . 18 1 1 A 97 97 LYS CA C 97 58.583 59.173 -0.590 1
1 1146 . 18 1 1 A 97 97 LYS CB C 97 31.848 32.279 -0.431 1
1 1150 . 18 1 1 A 97 97 LYS N N 97 120.457 120.010 0.447 1
1 1151 . 18 1 1 A 98 98 ASP H H 98 7.762 7.956 -0.194 1
1 1152 . 18 1 1 A 98 98 ASP HA H 98 4.633 4.472 0.161 1
1 1155 . 18 1 1 A 98 98 ASP C C 98 175.270 175.234 0.036 1
1 1156 . 18 1 1 A 98 98 ASP CA C 98 53.272 56.858 -3.586 1
1 1157 . 18 1 1 A 98 98 ASP CB C 98 39.909 41.199 -1.290 1
1 1158 . 18 1 1 A 98 98 ASP N N 98 116.281 119.658 -3.377 1
1 1159 . 18 1 1 A 99 99 ASP H H 99 8.340 7.445 0.895 1
1 1160 . 18 1 1 A 99 99 ASP HA H 99 4.245 4.795 -0.550 1
1 1163 . 18 1 1 A 99 99 ASP C C 99 175.315 176.306 -0.991 1
1 1164 . 18 1 1 A 99 99 ASP CA C 99 55.989 55.395 0.594 1
1 1165 . 18 1 1 A 99 99 ASP CB C 99 39.827 41.881 -2.054 1
1 1166 . 18 1 1 A 99 99 ASP N N 99 116.687 118.167 -1.480 1
1 1167 . 18 1 1 A 100 100 THR H H 100 7.511 7.760 -0.249 1
1 1168 . 18 1 1 A 100 100 THR HA H 100 4.185 4.201 -0.016 1
1 1173 . 18 1 1 A 100 100 THR C C 100 173.376 174.462 -1.086 1
1 1174 . 18 1 1 A 100 100 THR CA C 100 63.489 63.948 -0.459 1
1 1175 . 18 1 1 A 100 100 THR CB C 100 67.909 69.412 -1.503 1
1 1177 . 18 1 1 A 100 100 THR N N 100 116.525 115.403 1.122 1
1 1178 . 18 1 1 A 101 101 HIS H H 101 8.753 9.015 -0.262 1
1 1179 . 18 1 1 A 101 101 HIS HA H 101 4.898 5.266 -0.368 1
1 1184 . 18 1 1 A 101 101 HIS C C 101 174.345 173.682 0.663 1
1 1185 . 18 1 1 A 101 101 HIS CA C 101 55.072 53.833 1.239 1
1 1186 . 18 1 1 A 101 101 HIS CB C 101 32.835 31.795 1.040 1
1 1189 . 18 1 1 A 101 101 HIS N N 101 125.953 123.213 2.740 1
1 1190 . 18 1 1 A 102 102 TYR H H 102 9.023 9.392 -0.369 1
1 1191 . 18 1 1 A 102 102 TYR HA H 102 4.545 5.058 -0.513 1
1 1198 . 18 1 1 A 102 102 TYR C C 102 174.126 174.777 -0.651 1
1 1199 . 18 1 1 A 102 102 TYR CA C 102 57.260 56.461 0.799 1
1 1200 . 18 1 1 A 102 102 TYR CB C 102 40.381 39.238 1.143 1
1 1205 . 18 1 1 A 102 102 TYR N N 102 121.975 123.273 -1.298 1
1 1206 . 18 1 1 A 103 103 TYR H H 103 8.899 9.006 -0.107 1
1 1207 . 18 1 1 A 103 103 TYR HA H 103 4.729 4.977 -0.248 1
1 1214 . 18 1 1 A 103 103 TYR C C 103 174.139 175.726 -1.587 1
1 1215 . 18 1 1 A 103 103 TYR CA C 103 58.036 57.761 0.275 1
1 1216 . 18 1 1 A 103 103 TYR CB C 103 40.485 39.840 0.645 1
1 1221 . 18 1 1 A 103 103 TYR N N 103 122.012 123.699 -1.687 1
1 1222 . 18 1 1 A 104 104 ILE H H 104 8.605 8.546 0.059 1
1 1223 . 18 1 1 A 104 104 ILE HA H 104 4.859 4.824 0.035 1
1 1233 . 18 1 1 A 104 104 ILE C C 104 172.769 174.471 -1.702 1
1 1234 . 18 1 1 A 104 104 ILE CA C 104 59.554 59.723 -0.169 1
1 1235 . 18 1 1 A 104 104 ILE CB C 104 40.631 42.036 -1.405 1
1 1239 . 18 1 1 A 104 104 ILE N N 104 123.443 123.706 -0.263 1
1 1240 . 18 1 1 A 105 105 GLN H H 105 9.369 8.306 1.063 1
1 1241 . 18 1 1 A 105 105 GLN HA H 105 4.895 5.046 -0.151 1
1 1248 . 18 1 1 A 105 105 GLN C C 105 175.642 175.408 0.234 1
1 1249 . 18 1 1 A 105 105 GLN CA C 105 54.965 53.842 1.123 1
1 1250 . 18 1 1 A 105 105 GLN CB C 105 32.856 32.379 0.477 1
1 1252 . 18 1 1 A 105 105 GLN N N 105 125.079 124.030 1.049 1
1 1254 . 18 1 1 A 106 106 ALA H H 106 8.513 8.424 0.089 1
1 1255 . 18 1 1 A 106 106 ALA HA H 106 4.962 4.745 0.217 1
1 1259 . 18 1 1 A 106 106 ALA C C 106 175.854 177.732 -1.878 1
1 1260 . 18 1 1 A 106 106 ALA CA C 106 50.272 51.116 -0.844 1
1 1261 . 18 1 1 A 106 106 ALA CB C 106 21.197 21.084 0.113 1
1 1262 . 18 1 1 A 106 106 ALA N N 106 129.303 128.438 0.865 1
1 1263 . 18 1 1 A 107 107 SER H H 107 9.468 9.178 0.290 1
1 1264 . 18 1 1 A 107 107 SER HA H 107 4.447 4.439 0.008 1
1 1267 . 18 1 1 A 107 107 SER C C 107 173.785 173.609 0.176 1
1 1268 . 18 1 1 A 107 107 SER CA C 107 60.048 60.081 -0.033 1
1 1269 . 18 1 1 A 107 107 SER CB C 107 64.643 64.324 0.319 1
1 1270 . 18 1 1 A 107 107 SER N N 107 112.962 114.148 -1.186 1
1 1271 . 18 1 1 A 108 108 SER H H 108 7.555 7.988 -0.433 1
1 1272 . 18 1 1 A 108 108 SER HA H 108 4.665 4.868 -0.203 1
1 1275 . 18 1 1 A 108 108 SER C C 108 174.381 174.422 -0.041 1
1 1276 . 18 1 1 A 108 108 SER CA C 108 56.907 57.253 -0.346 1
1 1277 . 18 1 1 A 108 108 SER CB C 108 66.370 67.004 -0.634 1
1 1278 . 18 1 1 A 108 108 SER N N 108 112.243 113.195 -0.952 1
1 1279 . 18 1 1 A 109 109 LYS H H 109 8.978 8.786 0.192 1
1 1280 . 18 1 1 A 109 109 LYS HA H 109 4.777 3.955 0.822 1
1 1287 . 18 1 1 A 109 109 LYS C C 109 179.992 177.880 2.112 1
1 1288 . 18 1 1 A 109 109 LYS CA C 109 59.766 60.226 -0.460 1
1 1289 . 18 1 1 A 109 109 LYS CB C 109 32.342 31.949 0.393 1
1 1293 . 18 1 1 A 109 109 LYS N N 109 123.170 124.907 -1.737 1
1 1294 . 18 1 1 A 110 110 ALA H H 110 8.608 8.138 0.470 1
1 1295 . 18 1 1 A 110 110 ALA HA H 110 4.178 4.050 0.128 1
1 1299 . 18 1 1 A 110 110 ALA C C 110 179.895 179.023 0.872 1
1 1300 . 18 1 1 A 110 110 ALA CA C 110 54.871 55.329 -0.458 1
1 1301 . 18 1 1 A 110 110 ALA CB C 110 18.065 18.139 -0.074 1
1 1302 . 18 1 1 A 110 110 ALA N N 110 123.750 120.533 3.217 1
1 1303 . 18 1 1 A 111 111 GLU H H 111 8.185 8.333 -0.148 1
1 1304 . 18 1 1 A 111 111 GLU HA H 111 4.180 4.074 0.106 1
1 1309 . 18 1 1 A 111 111 GLU C C 111 178.587 179.195 -0.608 1
1 1310 . 18 1 1 A 111 111 GLU CA C 111 59.466 59.679 -0.213 1
1 1311 . 18 1 1 A 111 111 GLU CB C 111 31.067 29.294 1.773 1
1 1313 . 18 1 1 A 111 111 GLU N N 111 119.757 118.463 1.294 1
1 1314 . 18 1 1 A 112 112 ARG H H 112 8.008 7.806 0.202 1
1 1315 . 18 1 1 A 112 112 ARG HA H 112 3.642 4.106 -0.464 1
1 1322 . 18 1 1 A 112 112 ARG C C 112 176.481 178.365 -1.884 1
1 1323 . 18 1 1 A 112 112 ARG CA C 112 60.419 59.171 1.248 1
1 1324 . 18 1 1 A 112 112 ARG CB C 112 29.957 30.167 -0.210 1
1 1327 . 18 1 1 A 112 112 ARG N N 112 118.430 118.942 -0.512 1
1 1328 . 18 1 1 A 113 113 ALA H H 113 7.985 7.679 0.306 1
1 1329 . 18 1 1 A 113 113 ALA HA H 113 3.925 4.034 -0.109 1
1 1333 . 18 1 1 A 113 113 ALA C C 113 180.117 179.969 0.148 1
1 1334 . 18 1 1 A 113 113 ALA CA C 113 55.372 55.333 0.039 1
1 1335 . 18 1 1 A 113 113 ALA CB C 113 17.825 18.589 -0.764 1
1 1336 . 18 1 1 A 113 113 ALA N N 113 119.980 121.833 -1.853 1
1 1337 . 18 1 1 A 114 114 GLU H H 114 8.093 8.290 -0.197 1
1 1338 . 18 1 1 A 114 114 GLU HA H 114 3.936 3.932 0.004 1
1 1343 . 18 1 1 A 114 114 GLU C C 114 180.586 179.558 1.028 1
1 1344 . 18 1 1 A 114 114 GLU CA C 114 59.148 59.425 -0.277 1
1 1345 . 18 1 1 A 114 114 GLU CB C 114 30.080 29.215 0.865 1
1 1347 . 18 1 1 A 114 114 GLU N N 114 117.168 117.504 -0.336 1
1 1348 . 18 1 1 A 115 115 TRP H H 115 7.980 8.452 -0.472 1
1 1349 . 18 1 1 A 115 115 TRP HA H 115 3.775 4.387 -0.612 1
1 1358 . 18 1 1 A 115 115 TRP C C 115 177.714 178.623 -0.909 1
1 1359 . 18 1 1 A 115 115 TRP CA C 115 62.696 59.438 3.258 1
1 1360 . 18 1 1 A 115 115 TRP CB C 115 29.052 29.331 -0.279 1
1 1366 . 18 1 1 A 115 115 TRP N N 115 120.974 120.812 0.162 1
1 1368 . 18 1 1 A 116 116 ILE H H 116 8.297 9.855 -1.558 1
1 1369 . 18 1 1 A 116 116 ILE HA H 116 3.270 3.394 -0.124 1
1 1379 . 18 1 1 A 116 116 ILE C C 116 177.568 177.748 -0.180 1
1 1380 . 18 1 1 A 116 116 ILE CA C 116 66.643 64.845 1.798 1
1 1381 . 18 1 1 A 116 116 ILE CB C 116 37.606 37.394 0.212 1
1 1385 . 18 1 1 A 116 116 ILE N N 116 118.408 119.932 -1.524 1
1 1386 . 18 1 1 A 117 117 GLU H H 117 8.026 8.957 -0.931 1
1 1387 . 18 1 1 A 117 117 GLU HA H 117 3.880 3.974 -0.094 1
1 1392 . 18 1 1 A 117 117 GLU C C 117 178.476 178.668 -0.192 1
1 1393 . 18 1 1 A 117 117 GLU CA C 117 59.219 59.726 -0.507 1
1 1394 . 18 1 1 A 117 117 GLU CB C 117 29.381 29.480 -0.099 1
1 1396 . 18 1 1 A 117 117 GLU N N 117 117.096 120.335 -3.239 1
1 1397 . 18 1 1 A 118 118 ALA H H 118 7.555 8.021 -0.466 1
1 1398 . 18 1 1 A 118 118 ALA HA H 118 3.952 4.034 -0.082 1
1 1402 . 18 1 1 A 118 118 ALA C C 118 179.862 179.918 -0.056 1
1 1403 . 18 1 1 A 118 118 ALA CA C 118 54.772 55.146 -0.374 1
1 1404 . 18 1 1 A 118 118 ALA CB C 118 18.277 18.499 -0.222 1
1 1405 . 18 1 1 A 118 118 ALA N N 118 119.817 121.250 -1.433 1
1 1406 . 18 1 1 A 119 119 ILE H H 119 8.167 8.168 -0.001 1
1 1407 . 18 1 1 A 119 119 ILE HA H 119 3.558 3.717 -0.159 1
1 1417 . 18 1 1 A 119 119 ILE C C 119 178.564 178.037 0.527 1
1 1418 . 18 1 1 A 119 119 ILE CA C 119 65.766 65.423 0.343 1
1 1419 . 18 1 1 A 119 119 ILE CB C 119 38.840 38.310 0.530 1
1 1423 . 18 1 1 A 119 119 ILE N N 119 116.280 118.154 -1.874 1
1 1424 . 18 1 1 A 120 120 LYS H H 120 8.790 8.207 0.583 1
1 1425 . 18 1 1 A 120 120 LYS HA H 120 3.965 4.310 -0.345 1
1 1434 . 18 1 1 A 120 120 LYS C C 120 179.673 179.303 0.370 1
1 1435 . 18 1 1 A 120 120 LYS CA C 120 60.031 60.381 -0.350 1
1 1436 . 18 1 1 A 120 120 LYS CB C 120 32.547 32.160 0.387 1
1 1440 . 18 1 1 A 120 120 LYS N N 120 119.650 118.807 0.843 1
1 1441 . 18 1 1 A 121 121 LYS H H 121 7.594 8.746 -1.152 1
1 1442 . 18 1 1 A 121 121 LYS HA H 121 4.095 3.946 0.149 1
1 1451 . 18 1 1 A 121 121 LYS C C 121 177.962 179.177 -1.215 1
1 1452 . 18 1 1 A 121 121 LYS CA C 121 58.848 59.274 -0.426 1
1 1453 . 18 1 1 A 121 121 LYS CB C 121 32.547 32.301 0.246 1
1 1457 . 18 1 1 A 121 121 LYS N N 121 117.197 119.649 -2.452 1
1 1458 . 18 1 1 A 122 122 LEU H H 122 7.586 7.857 -0.271 1
1 1459 . 18 1 1 A 122 122 LEU HA H 122 4.535 3.964 0.571 1
1 1469 . 18 1 1 A 122 122 LEU C C 122 177.902 177.308 0.594 1
1 1470 . 18 1 1 A 122 122 LEU CA C 122 55.071 57.946 -2.875 1
1 1471 . 18 1 1 A 122 122 LEU CB C 122 42.888 42.054 0.834 1
1 1475 . 18 1 1 A 122 122 LEU N N 122 116.861 119.720 -2.859 1
1 1476 . 18 1 1 A 123 123 THR H H 123 7.636 7.766 -0.130 1
1 1477 . 18 1 1 A 123 123 THR HA H 123 4.445 4.328 0.117 1
1 1482 . 18 1 1 A 123 123 THR C C 123 175.714 174.106 1.608 1
1 1483 . 18 1 1 A 123 123 THR CA C 123 62.643 61.030 1.613 1
1 1484 . 18 1 1 A 123 123 THR CB C 123 70.259 71.005 -0.746 1
1 1486 . 18 1 1 A 123 123 THR N N 123 108.963 112.138 -3.175 1
1 1487 . 18 1 1 A 124 124 SER H H 124 7.912 8.589 -0.677 1
1 1488 . 18 1 1 A 124 124 SER HA H 124 4.626 4.439 0.187 1
1 1491 . 18 1 1 A 124 124 SER C C 124 174.405 174.188 0.217 1
1 1492 . 18 1 1 A 124 124 SER CA C 124 58.390 59.192 -0.802 1
1 1493 . 18 1 1 A 124 124 SER CB C 124 64.255 62.463 1.792 1
1 1494 . 18 1 1 A 124 124 SER N N 124 116.876 118.875 -1.999 1
1 1495 . 18 1 1 A 125 125 GLY H H 125 8.307 8.526 -0.219 1
1 1496 . 18 1 1 A 125 125 GLY HA2 H 125 4.166 3.957 0.209 1
1 1497 . 18 1 1 A 125 125 GLY HA3 H 125 4.166 3.958 0.208 1
1 1498 . 18 1 1 A 125 125 GLY C C 125 171.921 174.257 -2.336 1
1 1499 . 18 1 1 A 125 125 GLY CA C 125 44.748 45.389 -0.641 1
1 1500 . 18 1 1 A 125 125 GLY N N 125 110.006 113.360 -3.354 1
1 1501 . 18 1 1 A 126 126 PRO HA H 126 4.510 4.572 -0.062 1
1 1508 . 18 1 1 A 126 126 PRO C C 126 177.471 177.156 0.315 1
1 1509 . 18 1 1 A 126 126 PRO CA C 126 63.419 62.393 1.026 1
1 1510 . 18 1 1 A 126 126 PRO CB C 126 32.106 29.550 2.556 1
1 1513 . 18 1 1 A 127 127 SER H H 127 8.607 8.313 0.294 1
1 1514 . 18 1 1 A 127 127 SER C C 127 174.628 172.484 2.144 1
1 1515 . 18 1 1 A 127 127 SER CA C 127 58.513 60.404 -1.891 1
1 1516 . 18 1 1 A 127 127 SER CB C 127 63.679 62.106 1.573 1
1 1517 . 18 1 1 A 127 127 SER N N 127 116.390 112.814 3.576 1
1 1518 . 18 1 1 A 128 128 SER H H 128 8.272 8.398 -0.126 1
1 1519 . 18 1 1 A 128 128 SER HA H 128 4.496 5.256 -0.760 1
1 1520 . 18 1 1 A 128 128 SER C C 128 173.921 173.101 0.820 1
1 1521 . 18 1 1 A 128 128 SER CA C 128 58.442 56.530 1.912 1
1 1522 . 18 1 1 A 128 128 SER CB C 128 64.173 66.390 -2.217 1
1 1523 . 18 1 1 A 128 128 SER N N 128 117.506 117.383 0.123 1
1 1 . 19 1 1 A 7 7 GLY HA2 H 7 3.978 4.020 -0.042 1
1 2 . 19 1 1 A 7 7 GLY HA3 H 7 3.978 4.021 -0.043 1
1 3 . 19 1 1 A 7 7 GLY C C 7 174.274 174.512 -0.238 1
1 4 . 19 1 1 A 7 7 GLY CA C 7 45.383 44.646 0.737 1
1 5 . 19 1 1 A 8 8 SER H H 8 8.211 8.080 0.131 1
1 6 . 19 1 1 A 8 8 SER HA H 8 4.425 5.112 -0.687 1
1 9 . 19 1 1 A 8 8 SER C C 8 174.635 172.666 1.969 1
1 10 . 19 1 1 A 8 8 SER CA C 8 58.425 57.059 1.366 1
1 11 . 19 1 1 A 8 8 SER CB C 8 63.885 63.819 0.066 1
1 12 . 19 1 1 A 8 8 SER N N 8 115.732 116.715 -0.983 1
1 13 . 19 1 1 A 9 9 LEU H H 9 8.316 8.829 -0.513 1
1 14 . 19 1 1 A 9 9 LEU HA H 9 4.334 4.952 -0.618 1
1 24 . 19 1 1 A 9 9 LEU C C 9 177.447 176.167 1.280 1
1 25 . 19 1 1 A 9 9 LEU CA C 9 55.407 53.421 1.986 1
1 26 . 19 1 1 A 9 9 LEU CB C 9 42.171 44.261 -2.090 1
1 30 . 19 1 1 A 9 9 LEU N N 9 123.943 126.980 -3.037 1
1 31 . 19 1 1 A 10 10 SER H H 10 8.304 8.632 -0.328 1
1 32 . 19 1 1 A 10 10 SER HA H 10 4.424 4.739 -0.315 1
1 35 . 19 1 1 A 10 10 SER C C 10 175.025 174.441 0.584 1
1 36 . 19 1 1 A 10 10 SER CA C 10 58.425 58.444 -0.019 1
1 37 . 19 1 1 A 10 10 SER CB C 10 63.638 63.912 -0.274 1
1 38 . 19 1 1 A 10 10 SER N N 10 116.718 118.092 -1.374 1
1 39 . 19 1 1 A 11 11 THR H H 11 8.003 8.663 -0.660 1
1 40 . 19 1 1 A 11 11 THR HA H 11 4.196 4.341 -0.145 1
1 45 . 19 1 1 A 11 11 THR C C 11 176.296 174.279 2.017 1
1 46 . 19 1 1 A 11 11 THR CA C 11 62.483 63.543 -1.060 1
1 47 . 19 1 1 A 11 11 THR CB C 11 69.266 69.254 0.012 1
1 49 . 19 1 1 A 11 11 THR N N 11 114.902 120.459 -5.557 1
1 50 . 19 1 1 A 12 12 VAL H H 12 8.095 8.401 -0.306 1
1 51 . 19 1 1 A 12 12 VAL HA H 12 3.826 4.175 -0.349 1
1 59 . 19 1 1 A 12 12 VAL C C 12 178.501 176.893 1.608 1
1 60 . 19 1 1 A 12 12 VAL CA C 12 64.760 63.581 1.179 1
1 61 . 19 1 1 A 12 12 VAL CB C 12 32.013 33.167 -1.154 1
1 64 . 19 1 1 A 12 12 VAL N N 12 122.111 121.705 0.406 1
1 65 . 19 1 1 A 13 13 GLU H H 13 8.151 8.785 -0.634 1
1 66 . 19 1 1 A 13 13 GLU HA H 13 3.244 3.546 -0.302 1
1 71 . 19 1 1 A 13 13 GLU C C 13 175.702 178.642 -2.940 1
1 72 . 19 1 1 A 13 13 GLU CA C 13 58.354 59.049 -0.695 1
1 73 . 19 1 1 A 13 13 GLU CB C 13 28.843 28.354 0.489 1
1 75 . 19 1 1 A 13 13 GLU N N 13 120.316 122.644 -2.328 1
1 76 . 19 1 1 A 14 14 LEU H H 14 7.067 7.559 -0.492 1
1 77 . 19 1 1 A 14 14 LEU HA H 14 4.157 4.138 0.019 1
1 87 . 19 1 1 A 14 14 LEU C C 14 176.863 177.492 -0.629 1
1 88 . 19 1 1 A 14 14 LEU CA C 14 53.324 55.383 -2.059 1
1 89 . 19 1 1 A 14 14 LEU CB C 14 41.636 41.395 0.241 1
1 93 . 19 1 1 A 14 14 LEU N N 14 117.035 119.789 -2.754 1
1 94 . 19 1 1 A 15 15 SER H H 15 7.645 7.806 -0.161 1
1 95 . 19 1 1 A 15 15 SER HA H 15 4.305 4.528 -0.223 1
1 98 . 19 1 1 A 15 15 SER C C 15 175.340 173.089 2.251 1
1 99 . 19 1 1 A 15 15 SER CA C 15 59.783 57.502 2.281 1
1 100 . 19 1 1 A 15 15 SER CB C 15 64.625 61.884 2.741 1
1 101 . 19 1 1 A 15 15 SER N N 15 114.216 115.080 -0.864 1
1 102 . 19 1 1 A 16 16 GLY H H 16 8.506 8.000 0.506 1
1 103 . 19 1 1 A 16 16 GLY HA2 H 16 4.237 4.360 -0.123 1
1 104 . 19 1 1 A 16 16 GLY HA3 H 16 3.927 4.381 -0.454 1
1 105 . 19 1 1 A 16 16 GLY C C 16 173.661 172.135 1.526 1
1 106 . 19 1 1 A 16 16 GLY CA C 16 44.995 44.142 0.853 1
1 107 . 19 1 1 A 16 16 GLY N N 16 111.838 111.001 0.837 1
1 108 . 19 1 1 A 17 17 THR H H 17 8.482 8.807 -0.325 1
1 109 . 19 1 1 A 17 17 THR HA H 17 4.319 4.458 -0.139 1
1 114 . 19 1 1 A 17 17 THR C C 17 174.758 174.639 0.119 1
1 115 . 19 1 1 A 17 17 THR CA C 17 62.272 62.918 -0.646 1
1 116 . 19 1 1 A 17 17 THR CB C 17 70.706 69.363 1.343 1
1 118 . 19 1 1 A 17 17 THR N N 17 116.679 115.080 1.599 1
1 119 . 19 1 1 A 18 18 VAL H H 18 8.948 8.704 0.244 1
1 120 . 19 1 1 A 18 18 VAL HA H 18 3.950 4.300 -0.350 1
1 128 . 19 1 1 A 18 18 VAL C C 18 176.669 176.777 -0.108 1
1 129 . 19 1 1 A 18 18 VAL CA C 18 64.813 63.230 1.583 1
1 130 . 19 1 1 A 18 18 VAL CB C 18 31.807 31.810 -0.003 1
1 133 . 19 1 1 A 18 18 VAL N N 18 127.156 125.818 1.338 1
1 134 . 19 1 1 A 19 19 VAL H H 19 9.359 9.347 0.012 1
1 135 . 19 1 1 A 19 19 VAL HA H 19 4.234 4.372 -0.138 1
1 143 . 19 1 1 A 19 19 VAL C C 19 175.738 175.779 -0.041 1
1 144 . 19 1 1 A 19 19 VAL CA C 19 62.060 62.185 -0.125 1
1 145 . 19 1 1 A 19 19 VAL CB C 19 33.822 33.407 0.415 1
1 148 . 19 1 1 A 19 19 VAL N N 19 125.162 121.287 3.875 1
1 149 . 19 1 1 A 20 20 LYS H H 20 7.584 7.243 0.341 1
1 150 . 19 1 1 A 20 20 LYS HA H 20 4.346 4.601 -0.255 1
1 159 . 19 1 1 A 20 20 LYS C C 20 172.818 173.973 -1.155 1
1 160 . 19 1 1 A 20 20 LYS CA C 20 56.801 55.532 1.269 1
1 161 . 19 1 1 A 20 20 LYS CB C 20 36.624 35.510 1.114 1
1 165 . 19 1 1 A 20 20 LYS N N 20 121.024 120.676 0.348 1
1 166 . 19 1 1 A 21 21 GLN H H 21 8.625 8.532 0.093 1
1 167 . 19 1 1 A 21 21 GLN HA H 21 6.003 5.361 0.642 1
1 174 . 19 1 1 A 21 21 GLN C C 21 174.914 175.218 -0.304 1
1 175 . 19 1 1 A 21 21 GLN CA C 21 54.207 54.613 -0.406 1
1 176 . 19 1 1 A 21 21 GLN CB C 21 33.452 33.156 0.296 1
1 178 . 19 1 1 A 21 21 GLN N N 21 122.108 124.236 -2.128 1
1 180 . 19 1 1 A 22 22 GLY H H 22 8.964 8.463 0.501 1
1 181 . 19 1 1 A 22 22 GLY HA2 H 22 4.665 4.455 0.210 1
1 182 . 19 1 1 A 22 22 GLY HA3 H 22 4.295 4.622 -0.327 1
1 183 . 19 1 1 A 22 22 GLY C C 22 170.879 171.494 -0.615 1
1 184 . 19 1 1 A 22 22 GLY CA C 22 45.683 46.153 -0.470 1
1 185 . 19 1 1 A 22 22 GLY N N 22 108.508 109.448 -0.940 1
1 186 . 19 1 1 A 23 23 TYR H H 23 9.145 8.779 0.366 1
1 187 . 19 1 1 A 23 23 TYR HA H 23 5.595 5.836 -0.241 1
1 194 . 19 1 1 A 23 23 TYR C C 23 175.824 175.245 0.579 1
1 195 . 19 1 1 A 23 23 TYR CA C 23 58.019 56.714 1.305 1
1 196 . 19 1 1 A 23 23 TYR CB C 23 39.251 40.925 -1.674 1
1 201 . 19 1 1 A 23 23 TYR N N 23 120.809 120.137 0.672 1
1 202 . 19 1 1 A 24 24 LEU H H 24 8.935 9.624 -0.689 1
1 203 . 19 1 1 A 24 24 LEU HA H 24 4.716 5.034 -0.318 1
1 213 . 19 1 1 A 24 24 LEU C C 24 174.648 175.965 -1.317 1
1 214 . 19 1 1 A 24 24 LEU CA C 24 53.907 53.261 0.646 1
1 215 . 19 1 1 A 24 24 LEU CB C 24 46.078 45.006 1.072 1
1 219 . 19 1 1 A 24 24 LEU N N 24 122.887 124.540 -1.653 1
1 220 . 19 1 1 A 25 25 ALA H H 25 8.145 8.869 -0.724 1
1 221 . 19 1 1 A 25 25 ALA HA H 25 5.477 5.848 -0.371 1
1 225 . 19 1 1 A 25 25 ALA C C 25 175.751 175.305 0.446 1
1 226 . 19 1 1 A 25 25 ALA CA C 25 50.719 50.392 0.327 1
1 227 . 19 1 1 A 25 25 ALA CB C 25 21.074 21.566 -0.492 1
1 228 . 19 1 1 A 25 25 ALA N N 25 122.280 123.070 -0.790 1
1 229 . 19 1 1 A 26 26 LYS H H 26 9.167 8.970 0.197 1
1 230 . 19 1 1 A 26 26 LYS HA H 26 5.221 4.755 0.466 1
1 239 . 19 1 1 A 26 26 LYS C C 26 175.421 175.114 0.307 1
1 240 . 19 1 1 A 26 26 LYS CA C 26 54.383 54.706 -0.323 1
1 241 . 19 1 1 A 26 26 LYS CB C 26 36.125 34.065 2.060 1
1 245 . 19 1 1 A 26 26 LYS N N 26 120.638 124.464 -3.826 1
1 246 . 19 1 1 A 27 27 GLN H H 27 7.866 7.839 0.027 1
1 247 . 19 1 1 A 27 27 GLN HA H 27 3.525 3.845 -0.320 1
1 254 . 19 1 1 A 27 27 GLN C C 27 177.022 174.926 2.096 1
1 255 . 19 1 1 A 27 27 GLN CA C 27 55.778 54.018 1.760 1
1 256 . 19 1 1 A 27 27 GLN CB C 27 29.864 27.195 2.669 1
1 258 . 19 1 1 A 27 27 GLN N N 27 130.194 124.804 5.390 1
1 260 . 19 1 1 A 28 28 GLY H H 28 8.565 7.852 0.713 1
1 261 . 19 1 1 A 28 28 GLY HA2 H 28 4.125 3.966 0.159 1
1 262 . 19 1 1 A 28 28 GLY HA3 H 28 4.034 4.036 -0.002 1
1 263 . 19 1 1 A 28 28 GLY C C 28 174.030 174.191 -0.161 1
1 264 . 19 1 1 A 28 28 GLY CA C 28 45.665 45.028 0.637 1
1 265 . 19 1 1 A 28 28 GLY N N 28 115.528 112.260 3.268 1
1 266 . 19 1 1 A 29 29 HIS HA H 29 4.355 4.587 -0.232 1
1 271 . 19 1 1 A 29 29 HIS CA C 29 58.795 56.215 2.580 1
1 272 . 19 1 1 A 29 29 HIS CB C 29 31.283 31.151 0.132 1
1 275 . 19 1 1 A 30 30 LYS HA H 30 4.096 3.828 0.268 1
1 284 . 19 1 1 A 30 30 LYS CA C 30 57.290 59.792 -2.502 1
1 285 . 19 1 1 A 30 30 LYS CB C 30 31.951 32.033 -0.082 1
1 289 . 19 1 1 A 31 31 ARG HA H 31 3.975 4.004 -0.029 1
1 296 . 19 1 1 A 31 31 ARG CA C 31 55.973 57.343 -1.370 1
1 297 . 19 1 1 A 31 31 ARG CB C 31 29.902 28.893 1.009 1
1 300 . 19 1 1 A 32 32 LYS HA H 32 4.160 4.200 -0.040 1
1 309 . 19 1 1 A 32 32 LYS C C 32 175.678 175.549 0.129 1
1 310 . 19 1 1 A 32 32 LYS CA C 32 56.254 58.524 -2.270 1
1 311 . 19 1 1 A 32 32 LYS CB C 32 31.602 32.475 -0.873 1
1 315 . 19 1 1 A 33 33 ASN H H 33 7.925 8.857 -0.932 1
1 316 . 19 1 1 A 33 33 ASN HA H 33 4.799 5.058 -0.259 1
1 321 . 19 1 1 A 33 33 ASN C C 33 174.005 175.010 -1.005 1
1 322 . 19 1 1 A 33 33 ASN CA C 33 52.407 54.041 -1.634 1
1 323 . 19 1 1 A 33 33 ASN CB C 33 39.879 40.797 -0.918 1
1 324 . 19 1 1 A 33 33 ASN N N 33 116.990 116.115 0.875 1
1 326 . 19 1 1 A 34 34 TRP H H 34 8.798 8.083 0.715 1
1 327 . 19 1 1 A 34 34 TRP HA H 34 4.755 5.208 -0.453 1
1 336 . 19 1 1 A 34 34 TRP C C 34 176.090 175.846 0.244 1
1 337 . 19 1 1 A 34 34 TRP CA C 34 57.119 55.646 1.473 1
1 338 . 19 1 1 A 34 34 TRP CB C 34 30.596 33.277 -2.681 1
1 344 . 19 1 1 A 34 34 TRP N N 34 121.917 116.575 5.342 1
1 346 . 19 1 1 A 35 35 LYS H H 35 8.404 8.544 -0.140 1
1 347 . 19 1 1 A 35 35 LYS HA H 35 4.846 5.016 -0.170 1
1 354 . 19 1 1 A 35 35 LYS C C 35 176.088 175.640 0.448 1
1 355 . 19 1 1 A 35 35 LYS CA C 35 54.418 55.079 -0.661 1
1 356 . 19 1 1 A 35 35 LYS CB C 35 36.125 35.537 0.588 1
1 360 . 19 1 1 A 35 35 LYS N N 35 120.864 119.180 1.684 1
1 361 . 19 1 1 A 36 36 VAL H H 36 8.977 8.820 0.157 1
1 362 . 19 1 1 A 36 36 VAL HA H 36 4.274 4.560 -0.286 1
1 370 . 19 1 1 A 36 36 VAL C C 36 176.733 175.726 1.007 1
1 371 . 19 1 1 A 36 36 VAL CA C 36 64.319 63.288 1.031 1
1 372 . 19 1 1 A 36 36 VAL CB C 36 31.602 32.237 -0.635 1
1 375 . 19 1 1 A 36 36 VAL N N 36 124.314 125.027 -0.713 1
1 376 . 19 1 1 A 37 37 ARG H H 37 9.498 10.054 -0.556 1
1 377 . 19 1 1 A 37 37 ARG HA H 37 5.053 5.199 -0.146 1
1 384 . 19 1 1 A 37 37 ARG C C 37 174.442 174.387 0.055 1
1 385 . 19 1 1 A 37 37 ARG CA C 37 53.272 54.459 -1.187 1
1 386 . 19 1 1 A 37 37 ARG CB C 37 34.563 34.802 -0.239 1
1 389 . 19 1 1 A 37 37 ARG N N 37 128.121 126.413 1.708 1
1 390 . 19 1 1 A 38 38 ARG H H 38 8.755 8.751 0.004 1
1 391 . 19 1 1 A 38 38 ARG HA H 38 4.626 4.294 0.332 1
1 398 . 19 1 1 A 38 38 ARG C C 38 175.514 175.062 0.452 1
1 399 . 19 1 1 A 38 38 ARG CA C 38 55.601 55.520 0.081 1
1 400 . 19 1 1 A 38 38 ARG CB C 38 32.219 30.888 1.331 1
1 403 . 19 1 1 A 38 38 ARG N N 38 121.442 123.076 -1.634 1
1 404 . 19 1 1 A 39 39 PHE H H 39 9.865 9.052 0.813 1
1 405 . 19 1 1 A 39 39 PHE HA H 39 5.424 5.048 0.376 1
1 413 . 19 1 1 A 39 39 PHE C C 39 175.423 174.732 0.691 1
1 414 . 19 1 1 A 39 39 PHE CA C 39 57.419 56.957 0.462 1
1 415 . 19 1 1 A 39 39 PHE CB C 39 42.623 41.044 1.579 1
1 421 . 19 1 1 A 39 39 PHE N N 39 130.027 126.552 3.475 1
1 422 . 19 1 1 A 40 40 VAL H H 40 9.300 10.409 -1.109 1
1 423 . 19 1 1 A 40 40 VAL HA H 40 4.846 5.370 -0.524 1
1 431 . 19 1 1 A 40 40 VAL C C 40 174.477 173.564 0.913 1
1 432 . 19 1 1 A 40 40 VAL CA C 40 62.343 59.717 2.626 1
1 433 . 19 1 1 A 40 40 VAL CB C 40 35.755 34.802 0.953 1
1 436 . 19 1 1 A 40 40 VAL N N 40 119.369 122.471 -3.102 1
1 437 . 19 1 1 A 41 41 LEU H H 41 9.557 9.723 -0.166 1
1 438 . 19 1 1 A 41 41 LEU HA H 41 5.292 5.325 -0.033 1
1 448 . 19 1 1 A 41 41 LEU C C 41 174.632 175.490 -0.858 1
1 449 . 19 1 1 A 41 41 LEU CA C 41 53.571 53.849 -0.278 1
1 450 . 19 1 1 A 41 41 LEU CB C 41 45.337 44.466 0.871 1
1 454 . 19 1 1 A 41 41 LEU N N 41 132.121 129.443 2.678 1
1 455 . 19 1 1 A 42 42 ARG H H 42 9.396 9.159 0.237 1
1 456 . 19 1 1 A 42 42 ARG HA H 42 5.366 5.594 -0.228 1
1 464 . 19 1 1 A 42 42 ARG C C 42 173.997 175.351 -1.354 1
1 465 . 19 1 1 A 42 42 ARG CA C 42 54.631 54.537 0.094 1
1 466 . 19 1 1 A 42 42 ARG CB C 42 35.550 33.556 1.994 1
1 469 . 19 1 1 A 42 42 ARG N N 42 128.120 125.713 2.407 1
1 471 . 19 1 1 A 43 43 LYS H H 43 8.597 9.643 -1.046 1
1 472 . 19 1 1 A 43 43 LYS HA H 43 4.558 4.942 -0.384 1
1 481 . 19 1 1 A 43 43 LYS C C 43 174.648 175.369 -0.721 1
1 482 . 19 1 1 A 43 43 LYS CA C 43 53.378 54.556 -1.178 1
1 483 . 19 1 1 A 43 43 LYS CB C 43 37.303 35.853 1.450 1
1 487 . 19 1 1 A 43 43 LYS N N 43 114.484 119.909 -5.425 1
1 488 . 19 1 1 A 44 44 ASP H H 44 8.388 9.049 -0.661 1
1 489 . 19 1 1 A 44 44 ASP HA H 44 4.349 4.309 0.040 1
1 492 . 19 1 1 A 44 44 ASP C C 44 173.376 174.382 -1.006 1
1 493 . 19 1 1 A 44 44 ASP CA C 44 54.842 54.961 -0.119 1
1 494 . 19 1 1 A 44 44 ASP CB C 44 39.991 39.460 0.531 1
1 495 . 19 1 1 A 44 44 ASP N N 44 115.453 119.605 -4.152 1
1 496 . 19 1 1 A 45 45 PRO HA H 45 4.652 4.639 0.013 1
1 503 . 19 1 1 A 45 45 PRO C C 45 176.914 175.911 1.003 1
1 504 . 19 1 1 A 45 45 PRO CA C 45 63.490 62.722 0.768 1
1 505 . 19 1 1 A 45 45 PRO CB C 45 34.892 32.579 2.313 1
1 508 . 19 1 1 A 46 46 ALA H H 46 8.112 8.466 -0.354 1
1 509 . 19 1 1 A 46 46 ALA HA H 46 5.455 4.708 0.747 1
1 513 . 19 1 1 A 46 46 ALA C C 46 177.234 176.579 0.655 1
1 514 . 19 1 1 A 46 46 ALA CA C 46 51.560 51.256 0.304 1
1 515 . 19 1 1 A 46 46 ALA CB C 46 20.122 19.289 0.833 1
1 516 . 19 1 1 A 46 46 ALA N N 46 120.155 123.897 -3.742 1
1 517 . 19 1 1 A 47 47 PHE H H 47 8.717 9.169 -0.452 1
1 518 . 19 1 1 A 47 47 PHE HA H 47 4.795 5.149 -0.354 1
1 526 . 19 1 1 A 47 47 PHE C C 47 172.588 174.353 -1.765 1
1 527 . 19 1 1 A 47 47 PHE CA C 47 57.348 56.297 1.051 1
1 528 . 19 1 1 A 47 47 PHE CB C 47 47.123 44.278 2.845 1
1 534 . 19 1 1 A 47 47 PHE N N 47 129.946 120.078 9.868 1
1 535 . 19 1 1 A 48 48 LEU H H 48 7.883 8.093 -0.210 1
1 536 . 19 1 1 A 48 48 LEU HA H 48 5.198 5.078 0.120 1
1 546 . 19 1 1 A 48 48 LEU C C 48 173.569 174.278 -0.709 1
1 547 . 19 1 1 A 48 48 LEU CA C 48 53.290 54.205 -0.915 1
1 548 . 19 1 1 A 48 48 LEU CB C 48 45.502 45.616 -0.114 1
1 552 . 19 1 1 A 48 48 LEU N N 48 121.108 121.664 -0.556 1
1 553 . 19 1 1 A 49 49 HIS H H 49 8.606 8.937 -0.331 1
1 554 . 19 1 1 A 49 49 HIS HA H 49 5.035 5.136 -0.101 1
1 559 . 19 1 1 A 49 49 HIS C C 49 173.993 173.858 0.135 1
1 560 . 19 1 1 A 49 49 HIS CA C 49 56.483 54.080 2.403 1
1 561 . 19 1 1 A 49 49 HIS CB C 49 35.919 33.657 2.262 1
1 564 . 19 1 1 A 49 49 HIS N N 49 121.199 125.310 -4.111 1
1 565 . 19 1 1 A 50 50 TYR H H 50 7.777 8.645 -0.868 1
1 566 . 19 1 1 A 50 50 TYR HA H 50 5.695 5.604 0.091 1
1 573 . 19 1 1 A 50 50 TYR C C 50 174.284 172.062 2.222 1
1 574 . 19 1 1 A 50 50 TYR CA C 50 53.430 55.322 -1.892 1
1 575 . 19 1 1 A 50 50 TYR CB C 50 38.552 41.180 -2.628 1
1 580 . 19 1 1 A 50 50 TYR N N 50 114.156 117.370 -3.214 1
1 581 . 19 1 1 A 51 51 TYR H H 51 9.323 9.817 -0.494 1
1 582 . 19 1 1 A 51 51 TYR HA H 51 4.600 4.823 -0.223 1
1 589 . 19 1 1 A 51 51 TYR C C 51 175.352 174.409 0.943 1
1 590 . 19 1 1 A 51 51 TYR CA C 51 57.330 56.253 1.077 1
1 591 . 19 1 1 A 51 51 TYR CB C 51 41.683 41.764 -0.081 1
1 596 . 19 1 1 A 51 51 TYR N N 51 119.100 119.686 -0.586 1
1 597 . 19 1 1 A 52 52 ASP H H 52 9.375 8.584 0.791 1
1 598 . 19 1 1 A 52 52 ASP HA H 52 5.064 4.924 0.140 1
1 601 . 19 1 1 A 52 52 ASP C C 52 175.484 176.133 -0.649 1
1 602 . 19 1 1 A 52 52 ASP CA C 52 51.313 51.925 -0.612 1
1 603 . 19 1 1 A 52 52 ASP CB C 52 41.883 42.109 -0.226 1
1 604 . 19 1 1 A 52 52 ASP N N 52 124.636 124.059 0.577 1
1 605 . 19 1 1 A 53 53 PRO HA H 53 4.678 4.686 -0.008 1
1 612 . 19 1 1 A 53 53 PRO C C 53 176.781 177.908 -1.127 1
1 613 . 19 1 1 A 53 53 PRO CA C 53 64.054 64.339 -0.285 1
1 614 . 19 1 1 A 53 53 PRO CB C 53 32.589 31.974 0.615 1
1 617 . 19 1 1 A 54 54 SER H H 54 8.685 8.245 0.440 1
1 618 . 19 1 1 A 54 54 SER HA H 54 4.483 4.576 -0.093 1
1 621 . 19 1 1 A 54 54 SER C C 54 174.006 174.124 -0.118 1
1 622 . 19 1 1 A 54 54 SER CA C 54 59.378 59.507 -0.129 1
1 623 . 19 1 1 A 54 54 SER CB C 54 64.132 64.160 -0.028 1
1 624 . 19 1 1 A 54 54 SER N N 54 113.769 112.315 1.454 1
1 625 . 19 1 1 A 55 55 LYS H H 55 7.706 7.605 0.101 1
1 626 . 19 1 1 A 55 55 LYS HA H 55 4.580 4.657 -0.077 1
1 635 . 19 1 1 A 55 55 LYS C C 55 175.969 175.249 0.720 1
1 636 . 19 1 1 A 55 55 LYS CA C 55 55.160 55.802 -0.642 1
1 637 . 19 1 1 A 55 55 LYS CB C 55 34.069 34.307 -0.238 1
1 641 . 19 1 1 A 55 55 LYS N N 55 122.222 117.266 4.956 1
1 642 . 19 1 1 A 56 56 GLU H H 56 8.666 8.577 0.089 1
1 643 . 19 1 1 A 56 56 GLU HA H 56 4.174 4.919 -0.745 1
1 648 . 19 1 1 A 56 56 GLU C C 56 177.084 174.645 2.439 1
1 649 . 19 1 1 A 56 56 GLU CA C 56 57.099 55.611 1.488 1
1 650 . 19 1 1 A 56 56 GLU CB C 56 29.694 30.725 -1.031 1
1 652 . 19 1 1 A 56 56 GLU N N 56 122.015 120.067 1.948 1
1 653 . 19 1 1 A 57 57 GLU H H 57 8.303 8.561 -0.258 1
1 654 . 19 1 1 A 57 57 GLU HA H 57 4.214 4.723 -0.509 1
1 659 . 19 1 1 A 57 57 GLU CA C 57 56.960 55.421 1.539 1
1 660 . 19 1 1 A 57 57 GLU CB C 57 30.264 33.607 -3.343 1
1 662 . 19 1 1 A 57 57 GLU N N 57 119.884 124.520 -4.636 1
1 663 . 19 1 1 A 58 58 ASN HA H 58 4.768 4.585 0.183 1
1 668 . 19 1 1 A 58 58 ASN C C 58 174.902 175.388 -0.486 1
1 669 . 19 1 1 A 58 58 ASN CA C 58 52.740 54.788 -2.048 1
1 670 . 19 1 1 A 58 58 ASN CB C 58 38.116 38.663 -0.547 1
1 672 . 19 1 1 A 59 59 ARG H H 59 7.805 7.626 0.179 1
1 673 . 19 1 1 A 59 59 ARG HA H 59 4.762 4.592 0.170 1
1 680 . 19 1 1 A 59 59 ARG CA C 59 53.151 53.629 -0.478 1
1 681 . 19 1 1 A 59 59 ARG CB C 59 31.519 30.002 1.517 1
1 684 . 19 1 1 A 59 59 ARG N N 59 121.060 119.310 1.750 1
1 685 . 19 1 1 A 60 60 PRO HA H 60 3.357 3.829 -0.472 1
1 692 . 19 1 1 A 60 60 PRO C C 60 176.817 176.792 0.025 1
1 693 . 19 1 1 A 60 60 PRO CA C 60 63.031 61.676 1.355 1
1 694 . 19 1 1 A 60 60 PRO CB C 60 31.273 32.141 -0.868 1
1 697 . 19 1 1 A 61 61 VAL H H 61 8.627 8.825 -0.198 1
1 698 . 19 1 1 A 61 61 VAL HA H 61 3.966 3.731 0.235 1
1 706 . 19 1 1 A 61 61 VAL C C 61 176.503 176.089 0.414 1
1 707 . 19 1 1 A 61 61 VAL CA C 61 63.154 63.729 -0.575 1
1 708 . 19 1 1 A 61 61 VAL CB C 61 32.048 31.948 0.100 1
1 711 . 19 1 1 A 61 61 VAL N N 61 119.185 118.823 0.362 1
1 712 . 19 1 1 A 62 62 GLY H H 62 6.715 6.960 -0.245 1
1 713 . 19 1 1 A 62 62 GLY HA2 H 62 3.940 4.012 -0.072 1
1 714 . 19 1 1 A 62 62 GLY HA3 H 62 3.538 4.041 -0.503 1
1 715 . 19 1 1 A 62 62 GLY C C 62 169.983 174.367 -4.384 1
1 716 . 19 1 1 A 62 62 GLY CA C 62 44.465 45.483 -1.018 1
1 717 . 19 1 1 A 62 62 GLY N N 62 105.813 108.594 -2.781 1
1 718 . 19 1 1 A 63 63 GLY H H 63 8.004 8.069 -0.065 1
1 719 . 19 1 1 A 63 63 GLY HA2 H 63 4.095 3.394 0.701 1
1 720 . 19 1 1 A 63 63 GLY HA3 H 63 3.813 4.061 -0.248 1
1 721 . 19 1 1 A 63 63 GLY C C 63 171.870 172.558 -0.688 1
1 722 . 19 1 1 A 63 63 GLY CA C 63 47.148 44.573 2.575 1
1 723 . 19 1 1 A 63 63 GLY N N 63 105.089 109.552 -4.463 1
1 724 . 19 1 1 A 64 64 PHE H H 64 7.967 7.444 0.523 1
1 725 . 19 1 1 A 64 64 PHE HA H 64 4.934 5.462 -0.528 1
1 733 . 19 1 1 A 64 64 PHE C C 64 173.140 173.394 -0.254 1
1 734 . 19 1 1 A 64 64 PHE CA C 64 55.248 55.467 -0.219 1
1 735 . 19 1 1 A 64 64 PHE CB C 64 40.238 41.967 -1.729 1
1 741 . 19 1 1 A 64 64 PHE N N 64 113.387 116.039 -2.652 1
1 742 . 19 1 1 A 65 65 SER H H 65 8.518 8.968 -0.450 1
1 743 . 19 1 1 A 65 65 SER HA H 65 3.264 4.128 -0.864 1
1 746 . 19 1 1 A 65 65 SER C C 65 176.417 174.517 1.900 1
1 747 . 19 1 1 A 65 65 SER CA C 65 56.819 57.464 -0.645 1
1 748 . 19 1 1 A 65 65 SER CB C 65 63.391 64.024 -0.633 1
1 749 . 19 1 1 A 65 65 SER N N 65 114.674 115.626 -0.952 1
1 750 . 19 1 1 A 66 66 LEU H H 66 7.404 7.591 -0.187 1
1 751 . 19 1 1 A 66 66 LEU HA H 66 4.470 4.350 0.120 1
1 761 . 19 1 1 A 66 66 LEU C C 66 177.993 177.228 0.765 1
1 762 . 19 1 1 A 66 66 LEU CA C 66 54.242 55.677 -1.435 1
1 763 . 19 1 1 A 66 66 LEU CB C 66 42.787 42.117 0.670 1
1 767 . 19 1 1 A 66 66 LEU N N 66 123.988 124.748 -0.760 1
1 768 . 19 1 1 A 67 67 ARG H H 67 7.865 7.347 0.518 1
1 769 . 19 1 1 A 67 67 ARG HA H 67 4.175 4.063 0.112 1
1 776 . 19 1 1 A 67 67 ARG C C 67 178.562 177.105 1.457 1
1 777 . 19 1 1 A 67 67 ARG CA C 67 58.143 58.101 0.042 1
1 778 . 19 1 1 A 67 67 ARG CB C 67 29.052 30.022 -0.970 1
1 781 . 19 1 1 A 67 67 ARG N N 67 122.494 119.296 3.198 1
1 782 . 19 1 1 A 68 68 GLY H H 68 9.398 8.776 0.622 1
1 783 . 19 1 1 A 68 68 GLY HA2 H 68 4.066 3.958 0.108 1
1 784 . 19 1 1 A 68 68 GLY HA3 H 68 3.908 3.960 -0.052 1
1 785 . 19 1 1 A 68 68 GLY C C 68 173.982 173.967 0.015 1
1 786 . 19 1 1 A 68 68 GLY CA C 68 46.230 45.705 0.525 1
1 787 . 19 1 1 A 68 68 GLY N N 68 117.548 113.415 4.133 1
1 788 . 19 1 1 A 69 69 SER H H 69 7.829 8.242 -0.413 1
1 789 . 19 1 1 A 69 69 SER HA H 69 4.807 4.947 -0.140 1
1 792 . 19 1 1 A 69 69 SER C C 69 172.854 173.164 -0.310 1
1 793 . 19 1 1 A 69 69 SER CA C 69 59.290 57.313 1.977 1
1 794 . 19 1 1 A 69 69 SER CB C 69 65.366 66.501 -1.135 1
1 795 . 19 1 1 A 69 69 SER N N 69 115.188 115.556 -0.368 1
1 796 . 19 1 1 A 70 70 LEU H H 70 8.805 8.658 0.147 1
1 797 . 19 1 1 A 70 70 LEU HA H 70 4.846 4.828 0.018 1
1 807 . 19 1 1 A 70 70 LEU C C 70 175.775 174.177 1.598 1
1 808 . 19 1 1 A 70 70 LEU CA C 70 53.907 54.030 -0.123 1
1 809 . 19 1 1 A 70 70 LEU CB C 70 45.337 45.687 -0.350 1
1 813 . 19 1 1 A 70 70 LEU N N 70 121.265 122.995 -1.730 1
1 814 . 19 1 1 A 71 71 VAL H H 71 8.644 8.753 -0.109 1
1 815 . 19 1 1 A 71 71 VAL HA H 71 5.555 5.188 0.367 1
1 823 . 19 1 1 A 71 71 VAL C C 71 173.636 173.697 -0.061 1
1 824 . 19 1 1 A 71 71 VAL CA C 71 58.760 59.753 -0.993 1
1 825 . 19 1 1 A 71 71 VAL CB C 71 34.891 35.752 -0.861 1
1 828 . 19 1 1 A 71 71 VAL N N 71 122.315 122.666 -0.351 1
1 829 . 19 1 1 A 72 72 SER H H 72 8.750 9.304 -0.554 1
1 830 . 19 1 1 A 72 72 SER HA H 72 4.742 5.072 -0.330 1
1 833 . 19 1 1 A 72 72 SER C C 72 173.058 172.753 0.305 1
1 834 . 19 1 1 A 72 72 SER CA C 72 57.190 57.211 -0.021 1
1 835 . 19 1 1 A 72 72 SER CB C 72 65.612 66.442 -0.830 1
1 836 . 19 1 1 A 72 72 SER N N 72 118.611 120.908 -2.297 1
1 837 . 19 1 1 A 73 73 ALA H H 73 9.009 8.615 0.394 1
1 838 . 19 1 1 A 73 73 ALA HA H 73 4.406 5.177 -0.771 1
1 842 . 19 1 1 A 73 73 ALA C C 73 176.708 176.345 0.363 1
1 843 . 19 1 1 A 73 73 ALA CA C 73 52.672 50.742 1.930 1
1 844 . 19 1 1 A 73 73 ALA CB C 73 18.812 21.733 -2.921 1
1 845 . 19 1 1 A 73 73 ALA N N 73 125.694 125.045 0.649 1
1 846 . 19 1 1 A 74 74 LEU H H 74 7.800 8.231 -0.431 1
1 847 . 19 1 1 A 74 74 LEU HA H 74 4.716 5.296 -0.580 1
1 857 . 19 1 1 A 74 74 LEU C C 74 176.551 175.328 1.223 1
1 858 . 19 1 1 A 74 74 LEU CA C 74 53.784 53.273 0.511 1
1 859 . 19 1 1 A 74 74 LEU CB C 74 43.446 44.895 -1.449 1
1 863 . 19 1 1 A 74 74 LEU N N 74 122.271 120.089 2.182 1
1 864 . 19 1 1 A 75 75 GLU H H 75 8.855 8.768 0.087 1
1 865 . 19 1 1 A 75 75 GLU HA H 75 4.336 4.808 -0.472 1
1 870 . 19 1 1 A 75 75 GLU C C 75 176.465 174.809 1.656 1
1 871 . 19 1 1 A 75 75 GLU CA C 75 56.507 55.500 1.007 1
1 872 . 19 1 1 A 75 75 GLU CB C 75 30.245 29.462 0.783 1
1 874 . 19 1 1 A 75 75 GLU N N 75 122.678 121.282 1.396 1
1 875 . 19 1 1 A 76 76 ASP H H 76 8.542 8.500 0.042 1
1 876 . 19 1 1 A 76 76 ASP HA H 76 4.665 4.837 -0.172 1
1 879 . 19 1 1 A 76 76 ASP C C 76 176.087 175.249 0.838 1
1 880 . 19 1 1 A 76 76 ASP CA C 76 55.107 52.435 2.672 1
1 881 . 19 1 1 A 76 76 ASP CB C 76 41.431 40.333 1.098 1
1 882 . 19 1 1 A 76 76 ASP N N 76 121.488 122.421 -0.933 1
1 883 . 19 1 1 A 77 77 ASN H H 77 8.322 8.863 -0.541 1
1 884 . 19 1 1 A 77 77 ASN HA H 77 4.729 4.420 0.309 1
1 889 . 19 1 1 A 77 77 ASN C C 77 175.566 175.287 0.279 1
1 890 . 19 1 1 A 77 77 ASN CA C 77 53.131 54.386 -1.255 1
1 891 . 19 1 1 A 77 77 ASN CB C 77 38.617 37.280 1.337 1
1 892 . 19 1 1 A 77 77 ASN N N 77 118.676 124.553 -5.877 1
1 894 . 19 1 1 A 78 78 GLY H H 78 8.311 8.400 -0.089 1
1 895 . 19 1 1 A 78 78 GLY HA2 H 78 3.897 3.983 -0.086 1
1 896 . 19 1 1 A 78 78 GLY HA3 H 78 3.897 3.985 -0.088 1
1 897 . 19 1 1 A 78 78 GLY C C 78 173.376 174.118 -0.742 1
1 898 . 19 1 1 A 78 78 GLY CA C 78 45.224 45.597 -0.373 1
1 899 . 19 1 1 A 78 78 GLY N N 78 108.939 105.201 3.738 1
1 900 . 19 1 1 A 79 79 VAL H H 79 7.882 8.456 -0.574 1
1 901 . 19 1 1 A 79 79 VAL HA H 79 4.345 4.210 0.135 1
1 909 . 19 1 1 A 79 79 VAL CA C 79 59.995 62.385 -2.390 1
1 910 . 19 1 1 A 79 79 VAL CB C 79 32.589 30.085 2.504 1
1 913 . 19 1 1 A 79 79 VAL N N 79 121.135 123.473 -2.338 1
1 914 . 19 1 1 A 80 80 PRO HA H 80 4.461 4.496 -0.035 1
1 921 . 19 1 1 A 80 80 PRO C C 80 176.979 176.514 0.465 1
1 922 . 19 1 1 A 80 80 PRO CA C 80 63.101 62.246 0.855 1
1 923 . 19 1 1 A 80 80 PRO CB C 80 32.177 33.005 -0.828 1
1 926 . 19 1 1 A 81 81 THR H H 81 8.281 8.667 -0.386 1
1 927 . 19 1 1 A 81 81 THR HA H 81 4.095 4.461 -0.366 1
1 932 . 19 1 1 A 81 81 THR C C 81 175.270 174.746 0.524 1
1 933 . 19 1 1 A 81 81 THR CA C 81 62.872 61.672 1.200 1
1 934 . 19 1 1 A 81 81 THR CB C 81 69.642 69.193 0.449 1
1 936 . 19 1 1 A 81 81 THR N N 81 114.684 114.550 0.134 1
1 937 . 19 1 1 A 82 82 GLY H H 82 8.338 8.562 -0.224 1
1 938 . 19 1 1 A 82 82 GLY HA2 H 82 4.095 3.934 0.161 1
1 939 . 19 1 1 A 82 82 GLY HA3 H 82 3.668 3.944 -0.276 1
1 940 . 19 1 1 A 82 82 GLY C C 82 174.139 173.358 0.781 1
1 941 . 19 1 1 A 82 82 GLY CA C 82 45.083 46.698 -1.615 1
1 942 . 19 1 1 A 82 82 GLY N N 82 111.289 111.740 -0.451 1
1 943 . 19 1 1 A 83 83 VAL H H 83 7.668 7.984 -0.316 1
1 944 . 19 1 1 A 83 83 VAL HA H 83 3.985 4.497 -0.512 1
1 952 . 19 1 1 A 83 83 VAL C C 83 176.054 174.796 1.258 1
1 953 . 19 1 1 A 83 83 VAL CA C 83 62.431 61.491 0.940 1
1 954 . 19 1 1 A 83 83 VAL CB C 83 32.260 33.392 -1.132 1
1 957 . 19 1 1 A 83 83 VAL N N 83 120.003 125.801 -5.798 1
1 958 . 19 1 1 A 84 84 LYS H H 84 8.645 8.573 0.072 1
1 959 . 19 1 1 A 84 84 LYS HA H 84 4.276 4.097 0.179 1
1 968 . 19 1 1 A 84 84 LYS C C 84 176.832 176.665 0.167 1
1 969 . 19 1 1 A 84 84 LYS CA C 84 56.272 56.541 -0.269 1
1 970 . 19 1 1 A 84 84 LYS CB C 84 32.876 32.705 0.171 1
1 974 . 19 1 1 A 84 84 LYS N N 84 126.447 127.385 -0.938 1
1 975 . 19 1 1 A 85 85 GLY H H 85 8.410 8.833 -0.423 1
1 976 . 19 1 1 A 85 85 GLY HA2 H 85 4.066 3.839 0.227 1
1 977 . 19 1 1 A 85 85 GLY HA3 H 85 3.781 3.851 -0.070 1
1 978 . 19 1 1 A 85 85 GLY C C 85 173.969 174.520 -0.551 1
1 979 . 19 1 1 A 85 85 GLY CA C 85 45.146 46.999 -1.853 1
1 980 . 19 1 1 A 85 85 GLY N N 85 109.957 110.809 -0.852 1
1 981 . 19 1 1 A 86 86 ASN H H 86 8.298 8.346 -0.048 1
1 982 . 19 1 1 A 86 86 ASN HA H 86 4.665 4.624 0.041 1
1 987 . 19 1 1 A 86 86 ASN C C 86 174.987 173.743 1.244 1
1 988 . 19 1 1 A 86 86 ASN CA C 86 52.989 54.078 -1.089 1
1 989 . 19 1 1 A 86 86 ASN CB C 86 38.376 38.363 0.013 1
1 990 . 19 1 1 A 86 86 ASN N N 86 118.457 117.542 0.915 1
1 992 . 19 1 1 A 87 87 VAL H H 87 7.660 8.160 -0.500 1
1 993 . 19 1 1 A 87 87 VAL HA H 87 3.946 4.806 -0.860 1
1 1001 . 19 1 1 A 87 87 VAL C C 87 174.902 175.604 -0.702 1
1 1002 . 19 1 1 A 87 87 VAL CA C 87 62.307 59.638 2.669 1
1 1003 . 19 1 1 A 87 87 VAL CB C 87 32.548 34.952 -2.404 1
1 1006 . 19 1 1 A 87 87 VAL N N 87 120.557 119.068 1.489 1
1 1007 . 19 1 1 A 88 88 GLN H H 88 8.115 8.443 -0.328 1
1 1008 . 19 1 1 A 88 88 GLN HA H 88 4.302 3.782 0.520 1
1 1015 . 19 1 1 A 88 88 GLN C C 88 175.637 177.940 -2.303 1
1 1016 . 19 1 1 A 88 88 GLN CA C 88 55.336 59.030 -3.694 1
1 1017 . 19 1 1 A 88 88 GLN CB C 88 30.574 28.610 1.964 1
1 1019 . 19 1 1 A 88 88 GLN N N 88 122.280 125.143 -2.863 1
1 1021 . 19 1 1 A 89 89 GLY H H 89 8.544 8.083 0.461 1
1 1022 . 19 1 1 A 89 89 GLY HA2 H 89 3.885 4.016 -0.131 1
1 1023 . 19 1 1 A 89 89 GLY HA3 H 89 3.885 4.018 -0.133 1
1 1024 . 19 1 1 A 89 89 GLY C C 89 172.861 174.698 -1.837 1
1 1025 . 19 1 1 A 89 89 GLY CA C 89 44.889 44.807 0.082 1
1 1026 . 19 1 1 A 89 89 GLY N N 89 110.135 108.466 1.669 1
1 1027 . 19 1 1 A 90 90 ASN H H 90 8.451 8.264 0.187 1
1 1028 . 19 1 1 A 90 90 ASN HA H 90 4.222 4.758 -0.536 1
1 1033 . 19 1 1 A 90 90 ASN C C 90 174.926 176.080 -1.154 1
1 1034 . 19 1 1 A 90 90 ASN CA C 90 54.613 54.539 0.074 1
1 1035 . 19 1 1 A 90 90 ASN CB C 90 37.852 39.611 -1.759 1
1 1036 . 19 1 1 A 90 90 ASN N N 90 114.322 120.306 -5.984 1
1 1038 . 19 1 1 A 91 91 LEU H H 91 8.933 8.014 0.919 1
1 1039 . 19 1 1 A 91 91 LEU HA H 91 5.367 4.359 1.008 1
1 1049 . 19 1 1 A 91 91 LEU C C 91 178.732 175.964 2.768 1
1 1050 . 19 1 1 A 91 91 LEU CA C 91 55.160 57.130 -1.970 1
1 1051 . 19 1 1 A 91 91 LEU CB C 91 45.461 40.721 4.740 1
1 1055 . 19 1 1 A 91 91 LEU N N 91 120.057 118.477 1.580 1
1 1056 . 19 1 1 A 92 92 PHE H H 92 9.901 8.508 1.393 1
1 1057 . 19 1 1 A 92 92 PHE HA H 92 5.105 5.493 -0.388 1
1 1065 . 19 1 1 A 92 92 PHE C C 92 170.140 172.773 -2.633 1
1 1066 . 19 1 1 A 92 92 PHE CA C 92 56.236 55.811 0.425 1
1 1067 . 19 1 1 A 92 92 PHE CB C 92 42.664 42.043 0.621 1
1 1073 . 19 1 1 A 92 92 PHE N N 92 119.740 116.008 3.732 1
1 1074 . 19 1 1 A 93 93 LYS H H 93 9.154 9.732 -0.578 1
1 1075 . 19 1 1 A 93 93 LYS HA H 93 5.584 5.420 0.164 1
1 1083 . 19 1 1 A 93 93 LYS C C 93 174.830 175.217 -0.387 1
1 1084 . 19 1 1 A 93 93 LYS CA C 93 53.148 54.015 -0.867 1
1 1085 . 19 1 1 A 93 93 LYS CB C 93 36.660 36.426 0.234 1
1 1089 . 19 1 1 A 93 93 LYS N N 93 117.710 118.742 -1.032 1
1 1090 . 19 1 1 A 94 94 VAL H H 94 8.507 8.578 -0.071 1
1 1091 . 19 1 1 A 94 94 VAL HA H 94 4.872 5.008 -0.136 1
1 1099 . 19 1 1 A 94 94 VAL C C 94 174.408 174.529 -0.121 1
1 1100 . 19 1 1 A 94 94 VAL CA C 94 60.525 61.426 -0.901 1
1 1101 . 19 1 1 A 94 94 VAL CB C 94 34.862 34.752 0.110 1
1 1104 . 19 1 1 A 94 94 VAL N N 94 121.741 119.907 1.834 1
1 1105 . 19 1 1 A 95 95 ILE H H 95 8.959 9.185 -0.226 1
1 1106 . 19 1 1 A 95 95 ILE HA H 95 4.794 5.343 -0.549 1
1 1116 . 19 1 1 A 95 95 ILE C C 95 177.642 176.196 1.446 1
1 1117 . 19 1 1 A 95 95 ILE CA C 95 59.713 60.540 -0.827 1
1 1118 . 19 1 1 A 95 95 ILE CB C 95 40.032 37.981 2.051 1
1 1122 . 19 1 1 A 95 95 ILE N N 95 126.794 128.846 -2.052 1
1 1123 . 19 1 1 A 96 96 THR H H 96 8.765 8.631 0.134 1
1 1124 . 19 1 1 A 96 96 THR HA H 96 4.584 4.801 -0.217 1
1 1129 . 19 1 1 A 96 96 THR C C 96 177.023 176.368 0.655 1
1 1130 . 19 1 1 A 96 96 THR CA C 96 61.372 60.658 0.714 1
1 1131 . 19 1 1 A 96 96 THR CB C 96 70.794 71.791 -0.997 1
1 1133 . 19 1 1 A 96 96 THR N N 96 117.225 120.655 -3.430 1
1 1134 . 19 1 1 A 97 97 LYS H H 97 8.736 8.954 -0.218 1
1 1135 . 19 1 1 A 97 97 LYS HA H 97 4.101 4.065 0.036 1
1 1144 . 19 1 1 A 97 97 LYS C C 97 176.490 176.991 -0.501 1
1 1145 . 19 1 1 A 97 97 LYS CA C 97 58.583 58.572 0.011 1
1 1146 . 19 1 1 A 97 97 LYS CB C 97 31.848 32.088 -0.240 1
1 1150 . 19 1 1 A 97 97 LYS N N 97 120.457 119.621 0.836 1
1 1151 . 19 1 1 A 98 98 ASP H H 98 7.762 7.943 -0.181 1
1 1152 . 19 1 1 A 98 98 ASP HA H 98 4.633 4.769 -0.136 1
1 1155 . 19 1 1 A 98 98 ASP C C 98 175.270 175.272 -0.002 1
1 1156 . 19 1 1 A 98 98 ASP CA C 98 53.272 53.988 -0.716 1
1 1157 . 19 1 1 A 98 98 ASP CB C 98 39.909 40.862 -0.953 1
1 1158 . 19 1 1 A 98 98 ASP N N 98 116.281 118.567 -2.286 1
1 1159 . 19 1 1 A 99 99 ASP H H 99 8.340 8.135 0.205 1
1 1160 . 19 1 1 A 99 99 ASP HA H 99 4.245 4.325 -0.080 1
1 1163 . 19 1 1 A 99 99 ASP C C 99 175.315 174.885 0.430 1
1 1164 . 19 1 1 A 99 99 ASP CA C 99 55.989 54.963 1.026 1
1 1165 . 19 1 1 A 99 99 ASP CB C 99 39.827 38.484 1.343 1
1 1166 . 19 1 1 A 99 99 ASP N N 99 116.687 117.816 -1.129 1
1 1167 . 19 1 1 A 100 100 THR H H 100 7.511 7.781 -0.270 1
1 1168 . 19 1 1 A 100 100 THR HA H 100 4.185 4.431 -0.246 1
1 1173 . 19 1 1 A 100 100 THR C C 100 173.376 173.627 -0.251 1
1 1174 . 19 1 1 A 100 100 THR CA C 100 63.489 61.571 1.918 1
1 1175 . 19 1 1 A 100 100 THR CB C 100 67.909 69.520 -1.611 1
1 1177 . 19 1 1 A 100 100 THR N N 100 116.525 114.421 2.104 1
1 1178 . 19 1 1 A 101 101 HIS H H 101 8.753 8.781 -0.028 1
1 1179 . 19 1 1 A 101 101 HIS HA H 101 4.898 4.891 0.007 1
1 1184 . 19 1 1 A 101 101 HIS C C 101 174.345 173.671 0.674 1
1 1185 . 19 1 1 A 101 101 HIS CA C 101 55.072 54.335 0.737 1
1 1186 . 19 1 1 A 101 101 HIS CB C 101 32.835 28.990 3.845 1
1 1189 . 19 1 1 A 101 101 HIS N N 101 125.953 125.889 0.064 1
1 1190 . 19 1 1 A 102 102 TYR H H 102 9.023 9.015 0.008 1
1 1191 . 19 1 1 A 102 102 TYR HA H 102 4.545 4.589 -0.044 1
1 1198 . 19 1 1 A 102 102 TYR C C 102 174.126 174.554 -0.428 1
1 1199 . 19 1 1 A 102 102 TYR CA C 102 57.260 56.427 0.833 1
1 1200 . 19 1 1 A 102 102 TYR CB C 102 40.381 37.832 2.549 1
1 1205 . 19 1 1 A 102 102 TYR N N 102 121.975 124.206 -2.231 1
1 1206 . 19 1 1 A 103 103 TYR H H 103 8.899 8.619 0.280 1
1 1207 . 19 1 1 A 103 103 TYR HA H 103 4.729 4.942 -0.213 1
1 1214 . 19 1 1 A 103 103 TYR C C 103 174.139 175.348 -1.209 1
1 1215 . 19 1 1 A 103 103 TYR CA C 103 58.036 58.083 -0.047 1
1 1216 . 19 1 1 A 103 103 TYR CB C 103 40.485 38.230 2.255 1
1 1221 . 19 1 1 A 103 103 TYR N N 103 122.012 124.634 -2.622 1
1 1222 . 19 1 1 A 104 104 ILE H H 104 8.605 9.024 -0.419 1
1 1223 . 19 1 1 A 104 104 ILE HA H 104 4.859 5.170 -0.311 1
1 1233 . 19 1 1 A 104 104 ILE C C 104 172.769 174.173 -1.404 1
1 1234 . 19 1 1 A 104 104 ILE CA C 104 59.554 59.434 0.120 1
1 1235 . 19 1 1 A 104 104 ILE CB C 104 40.631 40.749 -0.118 1
1 1239 . 19 1 1 A 104 104 ILE N N 104 123.443 124.062 -0.619 1
1 1240 . 19 1 1 A 105 105 GLN H H 105 9.369 8.998 0.371 1
1 1241 . 19 1 1 A 105 105 GLN HA H 105 4.895 4.931 -0.036 1
1 1248 . 19 1 1 A 105 105 GLN C C 105 175.642 174.284 1.358 1
1 1249 . 19 1 1 A 105 105 GLN CA C 105 54.965 54.258 0.707 1
1 1250 . 19 1 1 A 105 105 GLN CB C 105 32.856 31.625 1.231 1
1 1252 . 19 1 1 A 105 105 GLN N N 105 125.079 123.782 1.297 1
1 1254 . 19 1 1 A 106 106 ALA H H 106 8.513 8.301 0.212 1
1 1255 . 19 1 1 A 106 106 ALA HA H 106 4.962 4.764 0.198 1
1 1259 . 19 1 1 A 106 106 ALA C C 106 175.854 177.564 -1.710 1
1 1260 . 19 1 1 A 106 106 ALA CA C 106 50.272 49.999 0.273 1
1 1261 . 19 1 1 A 106 106 ALA CB C 106 21.197 22.781 -1.584 1
1 1262 . 19 1 1 A 106 106 ALA N N 106 129.303 125.460 3.843 1
1 1263 . 19 1 1 A 107 107 SER H H 107 9.468 8.750 0.718 1
1 1264 . 19 1 1 A 107 107 SER HA H 107 4.447 4.395 0.052 1
1 1267 . 19 1 1 A 107 107 SER C C 107 173.785 174.105 -0.320 1
1 1268 . 19 1 1 A 107 107 SER CA C 107 60.048 61.388 -1.340 1
1 1269 . 19 1 1 A 107 107 SER CB C 107 64.643 63.495 1.148 1
1 1270 . 19 1 1 A 107 107 SER N N 107 112.962 115.412 -2.450 1
1 1271 . 19 1 1 A 108 108 SER H H 108 7.555 7.765 -0.210 1
1 1272 . 19 1 1 A 108 108 SER HA H 108 4.665 4.617 0.048 1
1 1275 . 19 1 1 A 108 108 SER C C 108 174.381 173.489 0.892 1
1 1276 . 19 1 1 A 108 108 SER CA C 108 56.907 56.480 0.427 1
1 1277 . 19 1 1 A 108 108 SER CB C 108 66.370 65.150 1.220 1
1 1278 . 19 1 1 A 108 108 SER N N 108 112.243 112.216 0.027 1
1 1279 . 19 1 1 A 109 109 LYS H H 109 8.978 9.146 -0.168 1
1 1280 . 19 1 1 A 109 109 LYS HA H 109 4.777 3.993 0.784 1
1 1287 . 19 1 1 A 109 109 LYS C C 109 179.992 179.127 0.865 1
1 1288 . 19 1 1 A 109 109 LYS CA C 109 59.766 59.732 0.034 1
1 1289 . 19 1 1 A 109 109 LYS CB C 109 32.342 32.069 0.273 1
1 1293 . 19 1 1 A 109 109 LYS N N 109 123.170 123.898 -0.728 1
1 1294 . 19 1 1 A 110 110 ALA H H 110 8.608 8.078 0.530 1
1 1295 . 19 1 1 A 110 110 ALA HA H 110 4.178 4.044 0.134 1
1 1299 . 19 1 1 A 110 110 ALA C C 110 179.895 179.321 0.574 1
1 1300 . 19 1 1 A 110 110 ALA CA C 110 54.871 55.448 -0.577 1
1 1301 . 19 1 1 A 110 110 ALA CB C 110 18.065 18.354 -0.289 1
1 1302 . 19 1 1 A 110 110 ALA N N 110 123.750 122.484 1.266 1
1 1303 . 19 1 1 A 111 111 GLU H H 111 8.185 8.265 -0.080 1
1 1304 . 19 1 1 A 111 111 GLU HA H 111 4.180 4.067 0.113 1
1 1309 . 19 1 1 A 111 111 GLU C C 111 178.587 179.060 -0.473 1
1 1310 . 19 1 1 A 111 111 GLU CA C 111 59.466 59.768 -0.302 1
1 1311 . 19 1 1 A 111 111 GLU CB C 111 31.067 29.287 1.780 1
1 1313 . 19 1 1 A 111 111 GLU N N 111 119.757 118.561 1.196 1
1 1314 . 19 1 1 A 112 112 ARG H H 112 8.008 7.748 0.260 1
1 1315 . 19 1 1 A 112 112 ARG HA H 112 3.642 4.067 -0.425 1
1 1322 . 19 1 1 A 112 112 ARG C C 112 176.481 178.345 -1.864 1
1 1323 . 19 1 1 A 112 112 ARG CA C 112 60.419 59.167 1.252 1
1 1324 . 19 1 1 A 112 112 ARG CB C 112 29.957 30.114 -0.157 1
1 1327 . 19 1 1 A 112 112 ARG N N 112 118.430 119.013 -0.583 1
1 1328 . 19 1 1 A 113 113 ALA H H 113 7.985 7.673 0.312 1
1 1329 . 19 1 1 A 113 113 ALA HA H 113 3.925 4.065 -0.140 1
1 1333 . 19 1 1 A 113 113 ALA C C 113 180.117 180.151 -0.034 1
1 1334 . 19 1 1 A 113 113 ALA CA C 113 55.372 55.494 -0.122 1
1 1335 . 19 1 1 A 113 113 ALA CB C 113 17.825 18.611 -0.786 1
1 1336 . 19 1 1 A 113 113 ALA N N 113 119.980 121.852 -1.872 1
1 1337 . 19 1 1 A 114 114 GLU H H 114 8.093 8.230 -0.137 1
1 1338 . 19 1 1 A 114 114 GLU HA H 114 3.936 3.920 0.016 1
1 1343 . 19 1 1 A 114 114 GLU C C 114 180.586 179.410 1.176 1
1 1344 . 19 1 1 A 114 114 GLU CA C 114 59.148 59.410 -0.262 1
1 1345 . 19 1 1 A 114 114 GLU CB C 114 30.080 29.166 0.914 1
1 1347 . 19 1 1 A 114 114 GLU N N 114 117.168 117.661 -0.493 1
1 1348 . 19 1 1 A 115 115 TRP H H 115 7.980 8.546 -0.566 1
1 1349 . 19 1 1 A 115 115 TRP HA H 115 3.775 4.387 -0.612 1
1 1358 . 19 1 1 A 115 115 TRP C C 115 177.714 178.606 -0.892 1
1 1359 . 19 1 1 A 115 115 TRP CA C 115 62.696 59.273 3.423 1
1 1360 . 19 1 1 A 115 115 TRP CB C 115 29.052 29.252 -0.200 1
1 1366 . 19 1 1 A 115 115 TRP N N 115 120.974 120.742 0.232 1
1 1368 . 19 1 1 A 116 116 ILE H H 116 8.297 9.864 -1.567 1
1 1369 . 19 1 1 A 116 116 ILE HA H 116 3.270 3.479 -0.209 1
1 1379 . 19 1 1 A 116 116 ILE C C 116 177.568 177.745 -0.177 1
1 1380 . 19 1 1 A 116 116 ILE CA C 116 66.643 64.927 1.716 1
1 1381 . 19 1 1 A 116 116 ILE CB C 116 37.606 37.494 0.112 1
1 1385 . 19 1 1 A 116 116 ILE N N 116 118.408 119.760 -1.352 1
1 1386 . 19 1 1 A 117 117 GLU H H 117 8.026 9.095 -1.069 1
1 1387 . 19 1 1 A 117 117 GLU HA H 117 3.880 4.001 -0.121 1
1 1392 . 19 1 1 A 117 117 GLU C C 117 178.476 178.812 -0.336 1
1 1393 . 19 1 1 A 117 117 GLU CA C 117 59.219 59.816 -0.597 1
1 1394 . 19 1 1 A 117 117 GLU CB C 117 29.381 29.563 -0.182 1
1 1396 . 19 1 1 A 117 117 GLU N N 117 117.096 120.360 -3.264 1
1 1397 . 19 1 1 A 118 118 ALA H H 118 7.555 8.190 -0.635 1
1 1398 . 19 1 1 A 118 118 ALA HA H 118 3.952 4.038 -0.086 1
1 1402 . 19 1 1 A 118 118 ALA C C 118 179.862 179.933 -0.071 1
1 1403 . 19 1 1 A 118 118 ALA CA C 118 54.772 55.025 -0.253 1
1 1404 . 19 1 1 A 118 118 ALA CB C 118 18.277 18.386 -0.109 1
1 1405 . 19 1 1 A 118 118 ALA N N 118 119.817 121.465 -1.648 1
1 1406 . 19 1 1 A 119 119 ILE H H 119 8.167 8.283 -0.116 1
1 1407 . 19 1 1 A 119 119 ILE HA H 119 3.558 3.710 -0.152 1
1 1417 . 19 1 1 A 119 119 ILE C C 119 178.564 178.050 0.514 1
1 1418 . 19 1 1 A 119 119 ILE CA C 119 65.766 65.418 0.348 1
1 1419 . 19 1 1 A 119 119 ILE CB C 119 38.840 37.887 0.953 1
1 1423 . 19 1 1 A 119 119 ILE N N 119 116.280 117.859 -1.579 1
1 1424 . 19 1 1 A 120 120 LYS H H 120 8.790 8.438 0.352 1
1 1425 . 19 1 1 A 120 120 LYS HA H 120 3.965 4.108 -0.143 1
1 1434 . 19 1 1 A 120 120 LYS C C 120 179.673 179.342 0.331 1
1 1435 . 19 1 1 A 120 120 LYS CA C 120 60.031 60.272 -0.241 1
1 1436 . 19 1 1 A 120 120 LYS CB C 120 32.547 32.183 0.364 1
1 1440 . 19 1 1 A 120 120 LYS N N 120 119.650 118.824 0.826 1
1 1441 . 19 1 1 A 121 121 LYS H H 121 7.594 8.253 -0.659 1
1 1442 . 19 1 1 A 121 121 LYS HA H 121 4.095 4.194 -0.099 1
1 1451 . 19 1 1 A 121 121 LYS C C 121 177.962 178.909 -0.947 1
1 1452 . 19 1 1 A 121 121 LYS CA C 121 58.848 59.175 -0.327 1
1 1453 . 19 1 1 A 121 121 LYS CB C 121 32.547 32.251 0.296 1
1 1457 . 19 1 1 A 121 121 LYS N N 121 117.197 119.751 -2.554 1
1 1458 . 19 1 1 A 122 122 LEU H H 122 7.586 7.750 -0.164 1
1 1459 . 19 1 1 A 122 122 LEU HA H 122 4.535 3.922 0.613 1
1 1469 . 19 1 1 A 122 122 LEU C C 122 177.902 179.203 -1.301 1
1 1470 . 19 1 1 A 122 122 LEU CA C 122 55.071 58.079 -3.008 1
1 1471 . 19 1 1 A 122 122 LEU CB C 122 42.888 41.932 0.956 1
1 1475 . 19 1 1 A 122 122 LEU N N 122 116.861 120.301 -3.440 1
1 1476 . 19 1 1 A 123 123 THR H H 123 7.636 8.172 -0.536 1
1 1477 . 19 1 1 A 123 123 THR HA H 123 4.445 4.057 0.388 1
1 1482 . 19 1 1 A 123 123 THR C C 123 175.714 174.981 0.733 1
1 1483 . 19 1 1 A 123 123 THR CA C 123 62.643 64.779 -2.136 1
1 1484 . 19 1 1 A 123 123 THR CB C 123 70.259 68.282 1.977 1
1 1486 . 19 1 1 A 123 123 THR N N 123 108.963 110.526 -1.563 1
1 1487 . 19 1 1 A 124 124 SER H H 124 7.912 8.287 -0.375 1
1 1488 . 19 1 1 A 124 124 SER HA H 124 4.626 4.641 -0.015 1
1 1491 . 19 1 1 A 124 124 SER C C 124 174.405 174.229 0.176 1
1 1492 . 19 1 1 A 124 124 SER CA C 124 58.390 57.921 0.469 1
1 1493 . 19 1 1 A 124 124 SER CB C 124 64.255 64.104 0.151 1
1 1494 . 19 1 1 A 124 124 SER N N 124 116.876 115.073 1.803 1
1 1495 . 19 1 1 A 125 125 GLY H H 125 8.307 8.280 0.027 1
1 1496 . 19 1 1 A 125 125 GLY HA2 H 125 4.166 4.032 0.134 1
1 1497 . 19 1 1 A 125 125 GLY HA3 H 125 4.166 4.032 0.134 1
1 1498 . 19 1 1 A 125 125 GLY C C 125 171.921 173.940 -2.019 1
1 1499 . 19 1 1 A 125 125 GLY CA C 125 44.748 45.022 -0.274 1
1 1500 . 19 1 1 A 125 125 GLY N N 125 110.006 112.216 -2.210 1
1 1501 . 19 1 1 A 126 126 PRO HA H 126 4.510 4.303 0.207 1
1 1508 . 19 1 1 A 126 126 PRO C C 126 177.471 176.749 0.722 1
1 1509 . 19 1 1 A 126 126 PRO CA C 126 63.419 62.722 0.697 1
1 1510 . 19 1 1 A 126 126 PRO CB C 126 32.106 32.669 -0.563 1
1 1513 . 19 1 1 A 127 127 SER H H 127 8.607 8.584 0.023 1
1 1514 . 19 1 1 A 127 127 SER C C 127 174.628 174.033 0.595 1
1 1515 . 19 1 1 A 127 127 SER CA C 127 58.513 58.915 -0.402 1
1 1516 . 19 1 1 A 127 127 SER CB C 127 63.679 61.755 1.924 1
1 1517 . 19 1 1 A 127 127 SER N N 127 116.390 112.939 3.451 1
1 1518 . 19 1 1 A 128 128 SER H H 128 8.272 8.426 -0.154 1
1 1519 . 19 1 1 A 128 128 SER HA H 128 4.496 4.660 -0.164 1
1 1520 . 19 1 1 A 128 128 SER C C 128 173.921 174.586 -0.665 1
1 1521 . 19 1 1 A 128 128 SER CA C 128 58.442 59.623 -1.181 1
1 1522 . 19 1 1 A 128 128 SER CB C 128 64.173 65.492 -1.319 1
1 1523 . 19 1 1 A 128 128 SER N N 128 117.506 122.439 -4.933 1
1 1 . 20 1 1 A 7 7 GLY HA2 H 7 3.978 4.197 -0.219 1
1 2 . 20 1 1 A 7 7 GLY HA3 H 7 3.978 4.199 -0.221 1
1 3 . 20 1 1 A 7 7 GLY C C 7 174.274 172.823 1.451 1
1 4 . 20 1 1 A 7 7 GLY CA C 7 45.383 45.590 -0.207 1
1 5 . 20 1 1 A 8 8 SER H H 8 8.211 8.741 -0.530 1
1 6 . 20 1 1 A 8 8 SER HA H 8 4.425 4.692 -0.267 1
1 9 . 20 1 1 A 8 8 SER C C 8 174.635 173.423 1.212 1
1 10 . 20 1 1 A 8 8 SER CA C 8 58.425 59.289 -0.864 1
1 11 . 20 1 1 A 8 8 SER CB C 8 63.885 65.060 -1.175 1
1 12 . 20 1 1 A 8 8 SER N N 8 115.732 118.749 -3.017 1
1 13 . 20 1 1 A 9 9 LEU H H 9 8.316 7.819 0.497 1
1 14 . 20 1 1 A 9 9 LEU HA H 9 4.334 4.567 -0.233 1
1 24 . 20 1 1 A 9 9 LEU C C 9 177.447 174.598 2.849 1
1 25 . 20 1 1 A 9 9 LEU CA C 9 55.407 54.767 0.640 1
1 26 . 20 1 1 A 9 9 LEU CB C 9 42.171 43.264 -1.093 1
1 30 . 20 1 1 A 9 9 LEU N N 9 123.943 120.455 3.488 1
1 31 . 20 1 1 A 10 10 SER H H 10 8.304 8.436 -0.132 1
1 32 . 20 1 1 A 10 10 SER HA H 10 4.424 4.817 -0.393 1
1 35 . 20 1 1 A 10 10 SER C C 10 175.025 172.446 2.579 1
1 36 . 20 1 1 A 10 10 SER CA C 10 58.425 57.163 1.262 1
1 37 . 20 1 1 A 10 10 SER CB C 10 63.638 63.262 0.376 1
1 38 . 20 1 1 A 10 10 SER N N 10 116.718 121.795 -5.077 1
1 39 . 20 1 1 A 11 11 THR H H 11 8.003 8.034 -0.031 1
1 40 . 20 1 1 A 11 11 THR HA H 11 4.196 4.761 -0.565 1
1 45 . 20 1 1 A 11 11 THR C C 11 176.296 173.826 2.470 1
1 46 . 20 1 1 A 11 11 THR CA C 11 62.483 60.173 2.310 1
1 47 . 20 1 1 A 11 11 THR CB C 11 69.266 72.162 -2.896 1
1 49 . 20 1 1 A 11 11 THR N N 11 114.902 115.985 -1.083 1
1 50 . 20 1 1 A 12 12 VAL H H 12 8.095 8.624 -0.529 1
1 51 . 20 1 1 A 12 12 VAL HA H 12 3.826 4.268 -0.442 1
1 59 . 20 1 1 A 12 12 VAL C C 12 178.501 177.166 1.335 1
1 60 . 20 1 1 A 12 12 VAL CA C 12 64.760 63.374 1.386 1
1 61 . 20 1 1 A 12 12 VAL CB C 12 32.013 34.042 -2.029 1
1 64 . 20 1 1 A 12 12 VAL N N 12 122.111 120.547 1.564 1
1 65 . 20 1 1 A 13 13 GLU H H 13 8.151 8.508 -0.357 1
1 66 . 20 1 1 A 13 13 GLU HA H 13 3.244 4.225 -0.981 1
1 71 . 20 1 1 A 13 13 GLU C C 13 175.702 178.280 -2.578 1
1 72 . 20 1 1 A 13 13 GLU CA C 13 58.354 59.327 -0.973 1
1 73 . 20 1 1 A 13 13 GLU CB C 13 28.843 28.772 0.071 1
1 75 . 20 1 1 A 13 13 GLU N N 13 120.316 122.252 -1.936 1
1 76 . 20 1 1 A 14 14 LEU H H 14 7.067 7.711 -0.644 1
1 77 . 20 1 1 A 14 14 LEU HA H 14 4.157 4.254 -0.097 1
1 87 . 20 1 1 A 14 14 LEU C C 14 176.863 177.488 -0.625 1
1 88 . 20 1 1 A 14 14 LEU CA C 14 53.324 54.748 -1.424 1
1 89 . 20 1 1 A 14 14 LEU CB C 14 41.636 41.268 0.368 1
1 93 . 20 1 1 A 14 14 LEU N N 14 117.035 119.319 -2.284 1
1 94 . 20 1 1 A 15 15 SER H H 15 7.645 8.131 -0.486 1
1 95 . 20 1 1 A 15 15 SER HA H 15 4.305 4.578 -0.273 1
1 98 . 20 1 1 A 15 15 SER C C 15 175.340 174.170 1.170 1
1 99 . 20 1 1 A 15 15 SER CA C 15 59.783 57.139 2.644 1
1 100 . 20 1 1 A 15 15 SER CB C 15 64.625 62.852 1.773 1
1 101 . 20 1 1 A 15 15 SER N N 15 114.216 112.440 1.776 1
1 102 . 20 1 1 A 16 16 GLY H H 16 8.506 8.157 0.349 1
1 103 . 20 1 1 A 16 16 GLY HA2 H 16 4.237 4.198 0.039 1
1 104 . 20 1 1 A 16 16 GLY HA3 H 16 3.927 4.223 -0.296 1
1 105 . 20 1 1 A 16 16 GLY C C 16 173.661 172.188 1.473 1
1 106 . 20 1 1 A 16 16 GLY CA C 16 44.995 43.610 1.385 1
1 107 . 20 1 1 A 16 16 GLY N N 16 111.838 110.511 1.327 1
1 108 . 20 1 1 A 17 17 THR H H 17 8.482 8.947 -0.465 1
1 109 . 20 1 1 A 17 17 THR HA H 17 4.319 4.426 -0.107 1
1 114 . 20 1 1 A 17 17 THR C C 17 174.758 174.403 0.355 1
1 115 . 20 1 1 A 17 17 THR CA C 17 62.272 63.602 -1.330 1
1 116 . 20 1 1 A 17 17 THR CB C 17 70.706 68.876 1.830 1
1 118 . 20 1 1 A 17 17 THR N N 17 116.679 115.163 1.516 1
1 119 . 20 1 1 A 18 18 VAL H H 18 8.948 8.805 0.143 1
1 120 . 20 1 1 A 18 18 VAL HA H 18 3.950 4.430 -0.480 1
1 128 . 20 1 1 A 18 18 VAL C C 18 176.669 176.920 -0.251 1
1 129 . 20 1 1 A 18 18 VAL CA C 18 64.813 63.698 1.115 1
1 130 . 20 1 1 A 18 18 VAL CB C 18 31.807 31.738 0.069 1
1 133 . 20 1 1 A 18 18 VAL N N 18 127.156 127.698 -0.542 1
1 134 . 20 1 1 A 19 19 VAL H H 19 9.359 9.494 -0.135 1
1 135 . 20 1 1 A 19 19 VAL HA H 19 4.234 4.399 -0.165 1
1 143 . 20 1 1 A 19 19 VAL C C 19 175.738 175.789 -0.051 1
1 144 . 20 1 1 A 19 19 VAL CA C 19 62.060 62.051 0.009 1
1 145 . 20 1 1 A 19 19 VAL CB C 19 33.822 33.443 0.379 1
1 148 . 20 1 1 A 19 19 VAL N N 19 125.162 121.818 3.344 1
1 149 . 20 1 1 A 20 20 LYS H H 20 7.584 7.319 0.265 1
1 150 . 20 1 1 A 20 20 LYS HA H 20 4.346 4.508 -0.162 1
1 159 . 20 1 1 A 20 20 LYS C C 20 172.818 173.983 -1.165 1
1 160 . 20 1 1 A 20 20 LYS CA C 20 56.801 55.509 1.292 1
1 161 . 20 1 1 A 20 20 LYS CB C 20 36.624 35.604 1.020 1
1 165 . 20 1 1 A 20 20 LYS N N 20 121.024 121.036 -0.012 1
1 166 . 20 1 1 A 21 21 GLN H H 21 8.625 8.511 0.114 1
1 167 . 20 1 1 A 21 21 GLN HA H 21 6.003 5.372 0.631 1
1 174 . 20 1 1 A 21 21 GLN C C 21 174.914 175.049 -0.135 1
1 175 . 20 1 1 A 21 21 GLN CA C 21 54.207 54.523 -0.316 1
1 176 . 20 1 1 A 21 21 GLN CB C 21 33.452 33.183 0.269 1
1 178 . 20 1 1 A 21 21 GLN N N 21 122.108 124.209 -2.101 1
1 180 . 20 1 1 A 22 22 GLY H H 22 8.964 8.380 0.584 1
1 181 . 20 1 1 A 22 22 GLY HA2 H 22 4.665 4.392 0.273 1
1 182 . 20 1 1 A 22 22 GLY HA3 H 22 4.295 4.598 -0.303 1
1 183 . 20 1 1 A 22 22 GLY C C 22 170.879 171.649 -0.770 1
1 184 . 20 1 1 A 22 22 GLY CA C 22 45.683 46.084 -0.401 1
1 185 . 20 1 1 A 22 22 GLY N N 22 108.508 109.032 -0.524 1
1 186 . 20 1 1 A 23 23 TYR H H 23 9.145 8.749 0.396 1
1 187 . 20 1 1 A 23 23 TYR HA H 23 5.595 5.746 -0.151 1
1 194 . 20 1 1 A 23 23 TYR C C 23 175.824 175.213 0.611 1
1 195 . 20 1 1 A 23 23 TYR CA C 23 58.019 56.667 1.352 1
1 196 . 20 1 1 A 23 23 TYR CB C 23 39.251 40.885 -1.634 1
1 201 . 20 1 1 A 23 23 TYR N N 23 120.809 120.133 0.676 1
1 202 . 20 1 1 A 24 24 LEU H H 24 8.935 9.595 -0.660 1
1 203 . 20 1 1 A 24 24 LEU HA H 24 4.716 4.986 -0.270 1
1 213 . 20 1 1 A 24 24 LEU C C 24 174.648 175.774 -1.126 1
1 214 . 20 1 1 A 24 24 LEU CA C 24 53.907 53.246 0.661 1
1 215 . 20 1 1 A 24 24 LEU CB C 24 46.078 44.777 1.301 1
1 219 . 20 1 1 A 24 24 LEU N N 24 122.887 124.740 -1.853 1
1 220 . 20 1 1 A 25 25 ALA H H 25 8.145 8.433 -0.288 1
1 221 . 20 1 1 A 25 25 ALA HA H 25 5.477 5.622 -0.145 1
1 225 . 20 1 1 A 25 25 ALA C C 25 175.751 175.510 0.241 1
1 226 . 20 1 1 A 25 25 ALA CA C 25 50.719 50.448 0.271 1
1 227 . 20 1 1 A 25 25 ALA CB C 25 21.074 20.836 0.238 1
1 228 . 20 1 1 A 25 25 ALA N N 25 122.280 123.466 -1.186 1
1 229 . 20 1 1 A 26 26 LYS H H 26 9.167 8.869 0.298 1
1 230 . 20 1 1 A 26 26 LYS HA H 26 5.221 4.779 0.442 1
1 239 . 20 1 1 A 26 26 LYS C C 26 175.421 175.678 -0.257 1
1 240 . 20 1 1 A 26 26 LYS CA C 26 54.383 54.904 -0.521 1
1 241 . 20 1 1 A 26 26 LYS CB C 26 36.125 33.882 2.243 1
1 245 . 20 1 1 A 26 26 LYS N N 26 120.638 125.155 -4.517 1
1 246 . 20 1 1 A 27 27 GLN H H 27 7.866 8.415 -0.549 1
1 247 . 20 1 1 A 27 27 GLN HA H 27 3.525 3.589 -0.064 1
1 254 . 20 1 1 A 27 27 GLN C C 27 177.022 176.768 0.254 1
1 255 . 20 1 1 A 27 27 GLN CA C 27 55.778 57.148 -1.370 1
1 256 . 20 1 1 A 27 27 GLN CB C 27 29.864 27.669 2.195 1
1 258 . 20 1 1 A 27 27 GLN N N 27 130.194 127.965 2.229 1
1 260 . 20 1 1 A 28 28 GLY H H 28 8.565 8.660 -0.095 1
1 261 . 20 1 1 A 28 28 GLY HA2 H 28 4.125 3.901 0.224 1
1 262 . 20 1 1 A 28 28 GLY HA3 H 28 4.034 3.922 0.112 1
1 263 . 20 1 1 A 28 28 GLY C C 28 174.030 173.545 0.485 1
1 264 . 20 1 1 A 28 28 GLY CA C 28 45.665 45.249 0.416 1
1 265 . 20 1 1 A 28 28 GLY N N 28 115.528 113.677 1.851 1
1 266 . 20 1 1 A 29 29 HIS HA H 29 4.355 4.761 -0.406 1
1 271 . 20 1 1 A 29 29 HIS CA C 29 58.795 56.648 2.147 1
1 272 . 20 1 1 A 29 29 HIS CB C 29 31.283 31.089 0.194 1
1 275 . 20 1 1 A 30 30 LYS HA H 30 4.096 4.303 -0.207 1
1 284 . 20 1 1 A 30 30 LYS CA C 30 57.290 57.308 -0.018 1
1 285 . 20 1 1 A 30 30 LYS CB C 30 31.951 34.626 -2.675 1
1 289 . 20 1 1 A 31 31 ARG HA H 31 3.975 4.255 -0.280 1
1 296 . 20 1 1 A 31 31 ARG CA C 31 55.973 56.429 -0.456 1
1 297 . 20 1 1 A 31 31 ARG CB C 31 29.902 31.484 -1.582 1
1 300 . 20 1 1 A 32 32 LYS HA H 32 4.160 3.976 0.184 1
1 309 . 20 1 1 A 32 32 LYS C C 32 175.678 176.898 -1.220 1
1 310 . 20 1 1 A 32 32 LYS CA C 32 56.254 59.276 -3.022 1
1 311 . 20 1 1 A 32 32 LYS CB C 32 31.602 33.110 -1.508 1
1 315 . 20 1 1 A 33 33 ASN H H 33 7.925 8.082 -0.157 1
1 316 . 20 1 1 A 33 33 ASN HA H 33 4.799 5.033 -0.234 1
1 321 . 20 1 1 A 33 33 ASN C C 33 174.005 175.159 -1.154 1
1 322 . 20 1 1 A 33 33 ASN CA C 33 52.407 52.584 -0.177 1
1 323 . 20 1 1 A 33 33 ASN CB C 33 39.879 39.856 0.023 1
1 324 . 20 1 1 A 33 33 ASN N N 33 116.990 116.546 0.444 1
1 326 . 20 1 1 A 34 34 TRP H H 34 8.798 8.828 -0.030 1
1 327 . 20 1 1 A 34 34 TRP HA H 34 4.755 4.891 -0.136 1
1 336 . 20 1 1 A 34 34 TRP C C 34 176.090 176.597 -0.507 1
1 337 . 20 1 1 A 34 34 TRP CA C 34 57.119 57.742 -0.623 1
1 338 . 20 1 1 A 34 34 TRP CB C 34 30.596 30.413 0.183 1
1 344 . 20 1 1 A 34 34 TRP N N 34 121.917 120.276 1.641 1
1 346 . 20 1 1 A 35 35 LYS H H 35 8.404 8.855 -0.451 1
1 347 . 20 1 1 A 35 35 LYS HA H 35 4.846 5.019 -0.173 1
1 354 . 20 1 1 A 35 35 LYS C C 35 176.088 175.692 0.396 1
1 355 . 20 1 1 A 35 35 LYS CA C 35 54.418 54.885 -0.467 1
1 356 . 20 1 1 A 35 35 LYS CB C 35 36.125 35.911 0.214 1
1 360 . 20 1 1 A 35 35 LYS N N 35 120.864 120.592 0.272 1
1 361 . 20 1 1 A 36 36 VAL H H 36 8.977 8.724 0.253 1
1 362 . 20 1 1 A 36 36 VAL HA H 36 4.274 4.648 -0.374 1
1 370 . 20 1 1 A 36 36 VAL C C 36 176.733 176.156 0.577 1
1 371 . 20 1 1 A 36 36 VAL CA C 36 64.319 62.998 1.321 1
1 372 . 20 1 1 A 36 36 VAL CB C 36 31.602 32.267 -0.665 1
1 375 . 20 1 1 A 36 36 VAL N N 36 124.314 124.880 -0.566 1
1 376 . 20 1 1 A 37 37 ARG H H 37 9.498 10.226 -0.728 1
1 377 . 20 1 1 A 37 37 ARG HA H 37 5.053 5.074 -0.021 1
1 384 . 20 1 1 A 37 37 ARG C C 37 174.442 174.645 -0.203 1
1 385 . 20 1 1 A 37 37 ARG CA C 37 53.272 54.345 -1.073 1
1 386 . 20 1 1 A 37 37 ARG CB C 37 34.563 34.538 0.025 1
1 389 . 20 1 1 A 37 37 ARG N N 37 128.121 126.381 1.740 1
1 390 . 20 1 1 A 38 38 ARG H H 38 8.755 8.474 0.281 1
1 391 . 20 1 1 A 38 38 ARG HA H 38 4.626 4.254 0.372 1
1 398 . 20 1 1 A 38 38 ARG C C 38 175.514 174.909 0.605 1
1 399 . 20 1 1 A 38 38 ARG CA C 38 55.601 55.607 -0.006 1
1 400 . 20 1 1 A 38 38 ARG CB C 38 32.219 30.749 1.470 1
1 403 . 20 1 1 A 38 38 ARG N N 38 121.442 123.297 -1.855 1
1 404 . 20 1 1 A 39 39 PHE H H 39 9.865 9.002 0.863 1
1 405 . 20 1 1 A 39 39 PHE HA H 39 5.424 5.034 0.390 1
1 413 . 20 1 1 A 39 39 PHE C C 39 175.423 174.776 0.647 1
1 414 . 20 1 1 A 39 39 PHE CA C 39 57.419 56.970 0.449 1
1 415 . 20 1 1 A 39 39 PHE CB C 39 42.623 40.446 2.177 1
1 421 . 20 1 1 A 39 39 PHE N N 39 130.027 126.478 3.549 1
1 422 . 20 1 1 A 40 40 VAL H H 40 9.300 9.860 -0.560 1
1 423 . 20 1 1 A 40 40 VAL HA H 40 4.846 5.317 -0.471 1
1 431 . 20 1 1 A 40 40 VAL C C 40 174.477 173.550 0.927 1
1 432 . 20 1 1 A 40 40 VAL CA C 40 62.343 59.764 2.579 1
1 433 . 20 1 1 A 40 40 VAL CB C 40 35.755 34.752 1.003 1
1 436 . 20 1 1 A 40 40 VAL N N 40 119.369 122.707 -3.338 1
1 437 . 20 1 1 A 41 41 LEU H H 41 9.557 9.787 -0.230 1
1 438 . 20 1 1 A 41 41 LEU HA H 41 5.292 5.373 -0.081 1
1 448 . 20 1 1 A 41 41 LEU C C 41 174.632 175.192 -0.560 1
1 449 . 20 1 1 A 41 41 LEU CA C 41 53.571 53.631 -0.060 1
1 450 . 20 1 1 A 41 41 LEU CB C 41 45.337 44.898 0.439 1
1 454 . 20 1 1 A 41 41 LEU N N 41 132.121 129.209 2.912 1
1 455 . 20 1 1 A 42 42 ARG H H 42 9.396 9.010 0.386 1
1 456 . 20 1 1 A 42 42 ARG HA H 42 5.366 5.619 -0.253 1
1 464 . 20 1 1 A 42 42 ARG C C 42 173.997 174.937 -0.940 1
1 465 . 20 1 1 A 42 42 ARG CA C 42 54.631 54.210 0.421 1
1 466 . 20 1 1 A 42 42 ARG CB C 42 35.550 34.185 1.365 1
1 469 . 20 1 1 A 42 42 ARG N N 42 128.120 125.296 2.824 1
1 471 . 20 1 1 A 43 43 LYS H H 43 8.597 8.919 -0.322 1
1 472 . 20 1 1 A 43 43 LYS HA H 43 4.558 4.887 -0.329 1
1 481 . 20 1 1 A 43 43 LYS C C 43 174.648 175.323 -0.675 1
1 482 . 20 1 1 A 43 43 LYS CA C 43 53.378 54.458 -1.080 1
1 483 . 20 1 1 A 43 43 LYS CB C 43 37.303 35.879 1.424 1
1 487 . 20 1 1 A 43 43 LYS N N 43 114.484 119.564 -5.080 1
1 488 . 20 1 1 A 44 44 ASP H H 44 8.388 8.916 -0.528 1
1 489 . 20 1 1 A 44 44 ASP HA H 44 4.349 4.218 0.131 1
1 492 . 20 1 1 A 44 44 ASP C C 44 173.376 174.231 -0.855 1
1 493 . 20 1 1 A 44 44 ASP CA C 44 54.842 54.918 -0.076 1
1 494 . 20 1 1 A 44 44 ASP CB C 44 39.991 39.584 0.407 1
1 495 . 20 1 1 A 44 44 ASP N N 44 115.453 119.300 -3.847 1
1 496 . 20 1 1 A 45 45 PRO HA H 45 4.652 4.472 0.180 1
1 503 . 20 1 1 A 45 45 PRO C C 45 176.914 175.360 1.554 1
1 504 . 20 1 1 A 45 45 PRO CA C 45 63.490 62.517 0.973 1
1 505 . 20 1 1 A 45 45 PRO CB C 45 34.892 32.557 2.335 1
1 508 . 20 1 1 A 46 46 ALA H H 46 8.112 8.068 0.044 1
1 509 . 20 1 1 A 46 46 ALA HA H 46 5.455 4.613 0.842 1
1 513 . 20 1 1 A 46 46 ALA C C 46 177.234 176.290 0.944 1
1 514 . 20 1 1 A 46 46 ALA CA C 46 51.560 50.899 0.661 1
1 515 . 20 1 1 A 46 46 ALA CB C 46 20.122 19.405 0.717 1
1 516 . 20 1 1 A 46 46 ALA N N 46 120.155 123.531 -3.376 1
1 517 . 20 1 1 A 47 47 PHE H H 47 8.717 8.689 0.028 1
1 518 . 20 1 1 A 47 47 PHE HA H 47 4.795 5.110 -0.315 1
1 526 . 20 1 1 A 47 47 PHE C C 47 172.588 174.316 -1.728 1
1 527 . 20 1 1 A 47 47 PHE CA C 47 57.348 56.151 1.197 1
1 528 . 20 1 1 A 47 47 PHE CB C 47 47.123 44.032 3.091 1
1 534 . 20 1 1 A 47 47 PHE N N 47 129.946 120.799 9.147 1
1 535 . 20 1 1 A 48 48 LEU H H 48 7.883 8.193 -0.310 1
1 536 . 20 1 1 A 48 48 LEU HA H 48 5.198 5.161 0.037 1
1 546 . 20 1 1 A 48 48 LEU C C 48 173.569 174.555 -0.986 1
1 547 . 20 1 1 A 48 48 LEU CA C 48 53.290 53.820 -0.530 1
1 548 . 20 1 1 A 48 48 LEU CB C 48 45.502 45.382 0.120 1
1 552 . 20 1 1 A 48 48 LEU N N 48 121.108 122.758 -1.650 1
1 553 . 20 1 1 A 49 49 HIS H H 49 8.606 8.818 -0.212 1
1 554 . 20 1 1 A 49 49 HIS HA H 49 5.035 4.961 0.074 1
1 559 . 20 1 1 A 49 49 HIS C C 49 173.993 173.603 0.390 1
1 560 . 20 1 1 A 49 49 HIS CA C 49 56.483 54.113 2.370 1
1 561 . 20 1 1 A 49 49 HIS CB C 49 35.919 33.032 2.887 1
1 564 . 20 1 1 A 49 49 HIS N N 49 121.199 125.840 -4.641 1
1 565 . 20 1 1 A 50 50 TYR H H 50 7.777 8.341 -0.564 1
1 566 . 20 1 1 A 50 50 TYR HA H 50 5.695 5.583 0.112 1
1 573 . 20 1 1 A 50 50 TYR C C 50 174.284 172.244 2.040 1
1 574 . 20 1 1 A 50 50 TYR CA C 50 53.430 55.154 -1.724 1
1 575 . 20 1 1 A 50 50 TYR CB C 50 38.552 41.140 -2.588 1
1 580 . 20 1 1 A 50 50 TYR N N 50 114.156 117.894 -3.738 1
1 581 . 20 1 1 A 51 51 TYR H H 51 9.323 9.510 -0.187 1
1 582 . 20 1 1 A 51 51 TYR HA H 51 4.600 5.075 -0.475 1
1 589 . 20 1 1 A 51 51 TYR C C 51 175.352 174.613 0.739 1
1 590 . 20 1 1 A 51 51 TYR CA C 51 57.330 56.706 0.624 1
1 591 . 20 1 1 A 51 51 TYR CB C 51 41.683 42.258 -0.575 1
1 596 . 20 1 1 A 51 51 TYR N N 51 119.100 120.189 -1.089 1
1 597 . 20 1 1 A 52 52 ASP H H 52 9.375 8.812 0.563 1
1 598 . 20 1 1 A 52 52 ASP HA H 52 5.064 5.054 0.010 1
1 601 . 20 1 1 A 52 52 ASP C C 52 175.484 176.307 -0.823 1
1 602 . 20 1 1 A 52 52 ASP CA C 52 51.313 51.914 -0.601 1
1 603 . 20 1 1 A 52 52 ASP CB C 52 41.883 41.026 0.857 1
1 604 . 20 1 1 A 52 52 ASP N N 52 124.636 121.294 3.342 1
1 605 . 20 1 1 A 53 53 PRO HA H 53 4.678 4.474 0.204 1
1 612 . 20 1 1 A 53 53 PRO C C 53 176.781 178.236 -1.455 1
1 613 . 20 1 1 A 53 53 PRO CA C 53 64.054 65.050 -0.996 1
1 614 . 20 1 1 A 53 53 PRO CB C 53 32.589 32.197 0.392 1
1 617 . 20 1 1 A 54 54 SER H H 54 8.685 8.172 0.513 1
1 618 . 20 1 1 A 54 54 SER HA H 54 4.483 4.229 0.254 1
1 621 . 20 1 1 A 54 54 SER C C 54 174.006 174.898 -0.892 1
1 622 . 20 1 1 A 54 54 SER CA C 54 59.378 60.912 -1.534 1
1 623 . 20 1 1 A 54 54 SER CB C 54 64.132 63.261 0.871 1
1 624 . 20 1 1 A 54 54 SER N N 54 113.769 111.963 1.806 1
1 625 . 20 1 1 A 55 55 LYS H H 55 7.706 7.801 -0.095 1
1 626 . 20 1 1 A 55 55 LYS HA H 55 4.580 4.791 -0.211 1
1 635 . 20 1 1 A 55 55 LYS C C 55 175.969 175.640 0.329 1
1 636 . 20 1 1 A 55 55 LYS CA C 55 55.160 54.798 0.362 1
1 637 . 20 1 1 A 55 55 LYS CB C 55 34.069 34.291 -0.222 1
1 641 . 20 1 1 A 55 55 LYS N N 55 122.222 120.283 1.939 1
1 642 . 20 1 1 A 56 56 GLU H H 56 8.666 8.723 -0.057 1
1 643 . 20 1 1 A 56 56 GLU HA H 56 4.174 5.017 -0.843 1
1 648 . 20 1 1 A 56 56 GLU C C 56 177.084 174.614 2.470 1
1 649 . 20 1 1 A 56 56 GLU CA C 56 57.099 55.493 1.606 1
1 650 . 20 1 1 A 56 56 GLU CB C 56 29.694 31.989 -2.295 1
1 652 . 20 1 1 A 56 56 GLU N N 56 122.015 119.542 2.473 1
1 653 . 20 1 1 A 57 57 GLU H H 57 8.303 8.779 -0.476 1
1 654 . 20 1 1 A 57 57 GLU HA H 57 4.214 4.651 -0.437 1
1 659 . 20 1 1 A 57 57 GLU CA C 57 56.960 55.653 1.307 1
1 660 . 20 1 1 A 57 57 GLU CB C 57 30.264 34.062 -3.798 1
1 662 . 20 1 1 A 57 57 GLU N N 57 119.884 124.356 -4.472 1
1 663 . 20 1 1 A 58 58 ASN HA H 58 4.768 4.817 -0.049 1
1 668 . 20 1 1 A 58 58 ASN C C 58 174.902 174.055 0.847 1
1 669 . 20 1 1 A 58 58 ASN CA C 58 52.740 52.994 -0.254 1
1 670 . 20 1 1 A 58 58 ASN CB C 58 38.116 36.452 1.664 1
1 672 . 20 1 1 A 59 59 ARG H H 59 7.805 8.579 -0.774 1
1 673 . 20 1 1 A 59 59 ARG HA H 59 4.762 4.736 0.026 1
1 680 . 20 1 1 A 59 59 ARG CA C 59 53.151 54.324 -1.173 1
1 681 . 20 1 1 A 59 59 ARG CB C 59 31.519 33.614 -2.095 1
1 684 . 20 1 1 A 59 59 ARG N N 59 121.060 121.933 -0.873 1
1 685 . 20 1 1 A 60 60 PRO HA H 60 3.357 4.108 -0.751 1
1 692 . 20 1 1 A 60 60 PRO C C 60 176.817 176.302 0.515 1
1 693 . 20 1 1 A 60 60 PRO CA C 60 63.031 61.910 1.121 1
1 694 . 20 1 1 A 60 60 PRO CB C 60 31.273 32.058 -0.785 1
1 697 . 20 1 1 A 61 61 VAL H H 61 8.627 8.624 0.003 1
1 698 . 20 1 1 A 61 61 VAL HA H 61 3.966 4.032 -0.066 1
1 706 . 20 1 1 A 61 61 VAL C C 61 176.503 175.596 0.907 1
1 707 . 20 1 1 A 61 61 VAL CA C 61 63.154 63.123 0.031 1
1 708 . 20 1 1 A 61 61 VAL CB C 61 32.048 32.422 -0.374 1
1 711 . 20 1 1 A 61 61 VAL N N 61 119.185 119.582 -0.397 1
1 712 . 20 1 1 A 62 62 GLY H H 62 6.715 6.237 0.478 1
1 713 . 20 1 1 A 62 62 GLY HA2 H 62 3.940 3.836 0.104 1
1 714 . 20 1 1 A 62 62 GLY HA3 H 62 3.538 3.884 -0.346 1
1 715 . 20 1 1 A 62 62 GLY C C 62 169.983 171.197 -1.214 1
1 716 . 20 1 1 A 62 62 GLY CA C 62 44.465 45.441 -0.976 1
1 717 . 20 1 1 A 62 62 GLY N N 62 105.813 106.784 -0.971 1
1 718 . 20 1 1 A 63 63 GLY H H 63 8.004 8.360 -0.356 1
1 719 . 20 1 1 A 63 63 GLY HA2 H 63 4.095 3.359 0.736 1
1 720 . 20 1 1 A 63 63 GLY HA3 H 63 3.813 3.718 0.095 1
1 721 . 20 1 1 A 63 63 GLY C C 63 171.870 172.202 -0.332 1
1 722 . 20 1 1 A 63 63 GLY CA C 63 47.148 44.707 2.441 1
1 723 . 20 1 1 A 63 63 GLY N N 63 105.089 107.475 -2.386 1
1 724 . 20 1 1 A 64 64 PHE H H 64 7.967 7.385 0.582 1
1 725 . 20 1 1 A 64 64 PHE HA H 64 4.934 5.568 -0.634 1
1 733 . 20 1 1 A 64 64 PHE C C 64 173.140 174.694 -1.554 1
1 734 . 20 1 1 A 64 64 PHE CA C 64 55.248 55.099 0.149 1
1 735 . 20 1 1 A 64 64 PHE CB C 64 40.238 42.136 -1.898 1
1 741 . 20 1 1 A 64 64 PHE N N 64 113.387 121.528 -8.141 1
1 742 . 20 1 1 A 65 65 SER H H 65 8.518 9.163 -0.645 1
1 743 . 20 1 1 A 65 65 SER HA H 65 3.264 5.207 -1.943 1
1 746 . 20 1 1 A 65 65 SER C C 65 176.417 174.393 2.024 1
1 747 . 20 1 1 A 65 65 SER CA C 65 56.819 57.965 -1.146 1
1 748 . 20 1 1 A 65 65 SER CB C 65 63.391 65.319 -1.928 1
1 749 . 20 1 1 A 65 65 SER N N 65 114.674 115.888 -1.214 1
1 750 . 20 1 1 A 66 66 LEU H H 66 7.404 8.456 -1.052 1
1 751 . 20 1 1 A 66 66 LEU HA H 66 4.470 4.513 -0.043 1
1 761 . 20 1 1 A 66 66 LEU C C 66 177.993 177.520 0.473 1
1 762 . 20 1 1 A 66 66 LEU CA C 66 54.242 55.613 -1.371 1
1 763 . 20 1 1 A 66 66 LEU CB C 66 42.787 43.174 -0.387 1
1 767 . 20 1 1 A 66 66 LEU N N 66 123.988 121.647 2.341 1
1 768 . 20 1 1 A 67 67 ARG H H 67 7.865 7.593 0.272 1
1 769 . 20 1 1 A 67 67 ARG HA H 67 4.175 3.979 0.196 1
1 776 . 20 1 1 A 67 67 ARG C C 67 178.562 177.174 1.388 1
1 777 . 20 1 1 A 67 67 ARG CA C 67 58.143 58.500 -0.357 1
1 778 . 20 1 1 A 67 67 ARG CB C 67 29.052 29.789 -0.737 1
1 781 . 20 1 1 A 67 67 ARG N N 67 122.494 120.033 2.461 1
1 782 . 20 1 1 A 68 68 GLY H H 68 9.398 8.818 0.580 1
1 783 . 20 1 1 A 68 68 GLY HA2 H 68 4.066 3.987 0.079 1
1 784 . 20 1 1 A 68 68 GLY HA3 H 68 3.908 3.994 -0.086 1
1 785 . 20 1 1 A 68 68 GLY C C 68 173.982 173.965 0.017 1
1 786 . 20 1 1 A 68 68 GLY CA C 68 46.230 45.990 0.240 1
1 787 . 20 1 1 A 68 68 GLY N N 68 117.548 114.825 2.723 1
1 788 . 20 1 1 A 69 69 SER H H 69 7.829 8.001 -0.172 1
1 789 . 20 1 1 A 69 69 SER HA H 69 4.807 5.039 -0.232 1
1 792 . 20 1 1 A 69 69 SER C C 69 172.854 173.160 -0.306 1
1 793 . 20 1 1 A 69 69 SER CA C 69 59.290 57.289 2.001 1
1 794 . 20 1 1 A 69 69 SER CB C 69 65.366 67.004 -1.638 1
1 795 . 20 1 1 A 69 69 SER N N 69 115.188 115.349 -0.161 1
1 796 . 20 1 1 A 70 70 LEU H H 70 8.805 8.888 -0.083 1
1 797 . 20 1 1 A 70 70 LEU HA H 70 4.846 4.956 -0.110 1
1 807 . 20 1 1 A 70 70 LEU C C 70 175.775 174.040 1.735 1
1 808 . 20 1 1 A 70 70 LEU CA C 70 53.907 53.870 0.037 1
1 809 . 20 1 1 A 70 70 LEU CB C 70 45.337 46.032 -0.695 1
1 813 . 20 1 1 A 70 70 LEU N N 70 121.265 123.142 -1.877 1
1 814 . 20 1 1 A 71 71 VAL H H 71 8.644 8.783 -0.139 1
1 815 . 20 1 1 A 71 71 VAL HA H 71 5.555 5.202 0.353 1
1 823 . 20 1 1 A 71 71 VAL C C 71 173.636 173.100 0.536 1
1 824 . 20 1 1 A 71 71 VAL CA C 71 58.760 59.576 -0.816 1
1 825 . 20 1 1 A 71 71 VAL CB C 71 34.891 35.886 -0.995 1
1 828 . 20 1 1 A 71 71 VAL N N 71 122.315 122.440 -0.125 1
1 829 . 20 1 1 A 72 72 SER H H 72 8.750 8.967 -0.217 1
1 830 . 20 1 1 A 72 72 SER HA H 72 4.742 4.998 -0.256 1
1 833 . 20 1 1 A 72 72 SER C C 72 173.058 172.731 0.327 1
1 834 . 20 1 1 A 72 72 SER CA C 72 57.190 57.721 -0.531 1
1 835 . 20 1 1 A 72 72 SER CB C 72 65.612 67.249 -1.637 1
1 836 . 20 1 1 A 72 72 SER N N 72 118.611 123.043 -4.432 1
1 837 . 20 1 1 A 73 73 ALA H H 73 9.009 8.691 0.318 1
1 838 . 20 1 1 A 73 73 ALA HA H 73 4.406 5.095 -0.689 1
1 842 . 20 1 1 A 73 73 ALA C C 73 176.708 176.576 0.132 1
1 843 . 20 1 1 A 73 73 ALA CA C 73 52.672 50.645 2.027 1
1 844 . 20 1 1 A 73 73 ALA CB C 73 18.812 21.365 -2.553 1
1 845 . 20 1 1 A 73 73 ALA N N 73 125.694 125.713 -0.019 1
1 846 . 20 1 1 A 74 74 LEU H H 74 7.800 8.119 -0.319 1
1 847 . 20 1 1 A 74 74 LEU HA H 74 4.716 4.772 -0.056 1
1 857 . 20 1 1 A 74 74 LEU C C 74 176.551 176.799 -0.248 1
1 858 . 20 1 1 A 74 74 LEU CA C 74 53.784 53.453 0.331 1
1 859 . 20 1 1 A 74 74 LEU CB C 74 43.446 43.403 0.043 1
1 863 . 20 1 1 A 74 74 LEU N N 74 122.271 120.655 1.616 1
1 864 . 20 1 1 A 75 75 GLU H H 75 8.855 8.459 0.396 1
1 865 . 20 1 1 A 75 75 GLU HA H 75 4.336 4.342 -0.006 1
1 870 . 20 1 1 A 75 75 GLU C C 75 176.465 175.866 0.599 1
1 871 . 20 1 1 A 75 75 GLU CA C 75 56.507 56.981 -0.474 1
1 872 . 20 1 1 A 75 75 GLU CB C 75 30.245 30.663 -0.418 1
1 874 . 20 1 1 A 75 75 GLU N N 75 122.678 123.363 -0.685 1
1 875 . 20 1 1 A 76 76 ASP H H 76 8.542 8.604 -0.062 1
1 876 . 20 1 1 A 76 76 ASP HA H 76 4.665 4.979 -0.314 1
1 879 . 20 1 1 A 76 76 ASP C C 76 176.087 176.532 -0.445 1
1 880 . 20 1 1 A 76 76 ASP CA C 76 55.107 52.943 2.164 1
1 881 . 20 1 1 A 76 76 ASP CB C 76 41.431 43.080 -1.649 1
1 882 . 20 1 1 A 76 76 ASP N N 76 121.488 120.852 0.636 1
1 883 . 20 1 1 A 77 77 ASN H H 77 8.322 9.291 -0.969 1
1 884 . 20 1 1 A 77 77 ASN HA H 77 4.729 4.322 0.407 1
1 889 . 20 1 1 A 77 77 ASN C C 77 175.566 174.325 1.241 1
1 890 . 20 1 1 A 77 77 ASN CA C 77 53.131 54.004 -0.873 1
1 891 . 20 1 1 A 77 77 ASN CB C 77 38.617 37.541 1.076 1
1 892 . 20 1 1 A 77 77 ASN N N 77 118.676 121.320 -2.644 1
1 894 . 20 1 1 A 78 78 GLY H H 78 8.311 8.047 0.264 1
1 895 . 20 1 1 A 78 78 GLY HA2 H 78 3.897 4.085 -0.188 1
1 896 . 20 1 1 A 78 78 GLY HA3 H 78 3.897 4.088 -0.191 1
1 897 . 20 1 1 A 78 78 GLY C C 78 173.376 171.479 1.897 1
1 898 . 20 1 1 A 78 78 GLY CA C 78 45.224 44.250 0.974 1
1 899 . 20 1 1 A 78 78 GLY N N 78 108.939 111.106 -2.167 1
1 900 . 20 1 1 A 79 79 VAL H H 79 7.882 8.364 -0.482 1
1 901 . 20 1 1 A 79 79 VAL HA H 79 4.345 4.949 -0.604 1
1 909 . 20 1 1 A 79 79 VAL CA C 79 59.995 58.132 1.863 1
1 910 . 20 1 1 A 79 79 VAL CB C 79 32.589 35.639 -3.050 1
1 913 . 20 1 1 A 79 79 VAL N N 79 121.135 119.674 1.461 1
1 914 . 20 1 1 A 80 80 PRO HA H 80 4.461 4.753 -0.292 1
1 921 . 20 1 1 A 80 80 PRO C C 80 176.979 176.582 0.397 1
1 922 . 20 1 1 A 80 80 PRO CA C 80 63.101 62.345 0.756 1
1 923 . 20 1 1 A 80 80 PRO CB C 80 32.177 33.074 -0.897 1
1 926 . 20 1 1 A 81 81 THR H H 81 8.281 8.446 -0.165 1
1 927 . 20 1 1 A 81 81 THR HA H 81 4.095 3.830 0.265 1
1 932 . 20 1 1 A 81 81 THR C C 81 175.270 175.863 -0.593 1
1 933 . 20 1 1 A 81 81 THR CA C 81 62.872 64.661 -1.789 1
1 934 . 20 1 1 A 81 81 THR CB C 81 69.642 68.520 1.122 1
1 936 . 20 1 1 A 81 81 THR N N 81 114.684 117.079 -2.395 1
1 937 . 20 1 1 A 82 82 GLY H H 82 8.338 8.855 -0.517 1
1 938 . 20 1 1 A 82 82 GLY HA2 H 82 4.095 3.803 0.292 1
1 939 . 20 1 1 A 82 82 GLY HA3 H 82 3.668 3.831 -0.163 1
1 940 . 20 1 1 A 82 82 GLY C C 82 174.139 174.500 -0.361 1
1 941 . 20 1 1 A 82 82 GLY CA C 82 45.083 47.071 -1.988 1
1 942 . 20 1 1 A 82 82 GLY N N 82 111.289 115.545 -4.256 1
1 943 . 20 1 1 A 83 83 VAL H H 83 7.668 8.002 -0.334 1
1 944 . 20 1 1 A 83 83 VAL HA H 83 3.985 3.605 0.380 1
1 952 . 20 1 1 A 83 83 VAL C C 83 176.054 175.182 0.872 1
1 953 . 20 1 1 A 83 83 VAL CA C 83 62.431 62.474 -0.043 1
1 954 . 20 1 1 A 83 83 VAL CB C 83 32.260 30.612 1.648 1
1 957 . 20 1 1 A 83 83 VAL N N 83 120.003 121.380 -1.377 1
1 958 . 20 1 1 A 84 84 LYS H H 84 8.645 8.098 0.547 1
1 959 . 20 1 1 A 84 84 LYS HA H 84 4.276 3.882 0.394 1
1 968 . 20 1 1 A 84 84 LYS C C 84 176.832 177.125 -0.293 1
1 969 . 20 1 1 A 84 84 LYS CA C 84 56.272 58.767 -2.495 1
1 970 . 20 1 1 A 84 84 LYS CB C 84 32.876 32.410 0.466 1
1 974 . 20 1 1 A 84 84 LYS N N 84 126.447 124.504 1.943 1
1 975 . 20 1 1 A 85 85 GLY H H 85 8.410 8.702 -0.292 1
1 976 . 20 1 1 A 85 85 GLY HA2 H 85 4.066 4.049 0.017 1
1 977 . 20 1 1 A 85 85 GLY HA3 H 85 3.781 4.092 -0.311 1
1 978 . 20 1 1 A 85 85 GLY C C 85 173.969 173.044 0.925 1
1 979 . 20 1 1 A 85 85 GLY CA C 85 45.146 44.911 0.235 1
1 980 . 20 1 1 A 85 85 GLY N N 85 109.957 110.148 -0.191 1
1 981 . 20 1 1 A 86 86 ASN H H 86 8.298 8.408 -0.110 1
1 982 . 20 1 1 A 86 86 ASN HA H 86 4.665 5.376 -0.711 1
1 987 . 20 1 1 A 86 86 ASN C C 86 174.987 174.934 0.053 1
1 988 . 20 1 1 A 86 86 ASN CA C 86 52.989 52.276 0.713 1
1 989 . 20 1 1 A 86 86 ASN CB C 86 38.376 38.401 -0.025 1
1 990 . 20 1 1 A 86 86 ASN N N 86 118.457 116.557 1.900 1
1 992 . 20 1 1 A 87 87 VAL H H 87 7.660 8.634 -0.974 1
1 993 . 20 1 1 A 87 87 VAL HA H 87 3.946 4.029 -0.083 1
1 1001 . 20 1 1 A 87 87 VAL C C 87 174.902 175.516 -0.614 1
1 1002 . 20 1 1 A 87 87 VAL CA C 87 62.307 61.111 1.196 1
1 1003 . 20 1 1 A 87 87 VAL CB C 87 32.548 32.892 -0.344 1
1 1006 . 20 1 1 A 87 87 VAL N N 87 120.557 118.790 1.767 1
1 1007 . 20 1 1 A 88 88 GLN H H 88 8.115 8.649 -0.534 1
1 1008 . 20 1 1 A 88 88 GLN HA H 88 4.302 4.585 -0.283 1
1 1015 . 20 1 1 A 88 88 GLN C C 88 175.637 175.547 0.090 1
1 1016 . 20 1 1 A 88 88 GLN CA C 88 55.336 55.002 0.334 1
1 1017 . 20 1 1 A 88 88 GLN CB C 88 30.574 28.975 1.599 1
1 1019 . 20 1 1 A 88 88 GLN N N 88 122.280 119.673 2.607 1
1 1021 . 20 1 1 A 89 89 GLY H H 89 8.544 8.167 0.377 1
1 1022 . 20 1 1 A 89 89 GLY HA2 H 89 3.885 4.015 -0.130 1
1 1023 . 20 1 1 A 89 89 GLY HA3 H 89 3.885 4.049 -0.164 1
1 1024 . 20 1 1 A 89 89 GLY C C 89 172.861 174.271 -1.410 1
1 1025 . 20 1 1 A 89 89 GLY CA C 89 44.889 46.380 -1.491 1
1 1026 . 20 1 1 A 89 89 GLY N N 89 110.135 109.654 0.481 1
1 1027 . 20 1 1 A 90 90 ASN H H 90 8.451 8.240 0.211 1
1 1028 . 20 1 1 A 90 90 ASN HA H 90 4.222 4.438 -0.216 1
1 1033 . 20 1 1 A 90 90 ASN C C 90 174.926 174.338 0.588 1
1 1034 . 20 1 1 A 90 90 ASN CA C 90 54.613 53.855 0.758 1
1 1035 . 20 1 1 A 90 90 ASN CB C 90 37.852 36.188 1.664 1
1 1036 . 20 1 1 A 90 90 ASN N N 90 114.322 117.834 -3.512 1
1 1038 . 20 1 1 A 91 91 LEU H H 91 8.933 7.836 1.097 1
1 1039 . 20 1 1 A 91 91 LEU HA H 91 5.367 4.817 0.550 1
1 1049 . 20 1 1 A 91 91 LEU C C 91 178.732 175.879 2.853 1
1 1050 . 20 1 1 A 91 91 LEU CA C 91 55.160 53.597 1.563 1
1 1051 . 20 1 1 A 91 91 LEU CB C 91 45.461 43.603 1.858 1
1 1055 . 20 1 1 A 91 91 LEU N N 91 120.057 120.238 -0.181 1
1 1056 . 20 1 1 A 92 92 PHE H H 92 9.901 8.285 1.616 1
1 1057 . 20 1 1 A 92 92 PHE HA H 92 5.105 5.044 0.061 1
1 1065 . 20 1 1 A 92 92 PHE C C 92 170.140 172.643 -2.503 1
1 1066 . 20 1 1 A 92 92 PHE CA C 92 56.236 56.547 -0.311 1
1 1067 . 20 1 1 A 92 92 PHE CB C 92 42.664 40.326 2.338 1
1 1073 . 20 1 1 A 92 92 PHE N N 92 119.740 116.885 2.855 1
1 1074 . 20 1 1 A 93 93 LYS H H 93 9.154 9.145 0.009 1
1 1075 . 20 1 1 A 93 93 LYS HA H 93 5.584 5.372 0.212 1
1 1083 . 20 1 1 A 93 93 LYS C C 93 174.830 175.142 -0.312 1
1 1084 . 20 1 1 A 93 93 LYS CA C 93 53.148 53.912 -0.764 1
1 1085 . 20 1 1 A 93 93 LYS CB C 93 36.660 36.175 0.485 1
1 1089 . 20 1 1 A 93 93 LYS N N 93 117.710 118.548 -0.838 1
1 1090 . 20 1 1 A 94 94 VAL H H 94 8.507 8.713 -0.206 1
1 1091 . 20 1 1 A 94 94 VAL HA H 94 4.872 4.955 -0.083 1
1 1099 . 20 1 1 A 94 94 VAL C C 94 174.408 174.902 -0.494 1
1 1100 . 20 1 1 A 94 94 VAL CA C 94 60.525 61.650 -1.125 1
1 1101 . 20 1 1 A 94 94 VAL CB C 94 34.862 34.176 0.686 1
1 1104 . 20 1 1 A 94 94 VAL N N 94 121.741 120.534 1.207 1
1 1105 . 20 1 1 A 95 95 ILE H H 95 8.959 9.159 -0.200 1
1 1106 . 20 1 1 A 95 95 ILE HA H 95 4.794 4.805 -0.011 1
1 1116 . 20 1 1 A 95 95 ILE C C 95 177.642 176.320 1.322 1
1 1117 . 20 1 1 A 95 95 ILE CA C 95 59.713 60.844 -1.131 1
1 1118 . 20 1 1 A 95 95 ILE CB C 95 40.032 37.916 2.116 1
1 1122 . 20 1 1 A 95 95 ILE N N 95 126.794 128.562 -1.768 1
1 1123 . 20 1 1 A 96 96 THR H H 96 8.765 8.994 -0.229 1
1 1124 . 20 1 1 A 96 96 THR HA H 96 4.584 4.850 -0.266 1
1 1129 . 20 1 1 A 96 96 THR C C 96 177.023 176.507 0.516 1
1 1130 . 20 1 1 A 96 96 THR CA C 96 61.372 60.788 0.584 1
1 1131 . 20 1 1 A 96 96 THR CB C 96 70.794 71.757 -0.963 1
1 1133 . 20 1 1 A 96 96 THR N N 96 117.225 120.962 -3.737 1
1 1134 . 20 1 1 A 97 97 LYS H H 97 8.736 9.005 -0.269 1
1 1135 . 20 1 1 A 97 97 LYS HA H 97 4.101 4.115 -0.014 1
1 1144 . 20 1 1 A 97 97 LYS C C 97 176.490 176.791 -0.301 1
1 1145 . 20 1 1 A 97 97 LYS CA C 97 58.583 58.456 0.127 1
1 1146 . 20 1 1 A 97 97 LYS CB C 97 31.848 31.921 -0.073 1
1 1150 . 20 1 1 A 97 97 LYS N N 97 120.457 119.654 0.803 1
1 1151 . 20 1 1 A 98 98 ASP H H 98 7.762 7.773 -0.011 1
1 1152 . 20 1 1 A 98 98 ASP HA H 98 4.633 4.778 -0.145 1
1 1155 . 20 1 1 A 98 98 ASP C C 98 175.270 175.002 0.268 1
1 1156 . 20 1 1 A 98 98 ASP CA C 98 53.272 53.770 -0.498 1
1 1157 . 20 1 1 A 98 98 ASP CB C 98 39.909 41.132 -1.223 1
1 1158 . 20 1 1 A 98 98 ASP N N 98 116.281 118.353 -2.072 1
1 1159 . 20 1 1 A 99 99 ASP H H 99 8.340 8.394 -0.054 1
1 1160 . 20 1 1 A 99 99 ASP HA H 99 4.245 4.567 -0.322 1
1 1163 . 20 1 1 A 99 99 ASP C C 99 175.315 175.921 -0.606 1
1 1164 . 20 1 1 A 99 99 ASP CA C 99 55.989 55.109 0.880 1
1 1165 . 20 1 1 A 99 99 ASP CB C 99 39.827 39.639 0.188 1
1 1166 . 20 1 1 A 99 99 ASP N N 99 116.687 117.960 -1.273 1
1 1167 . 20 1 1 A 100 100 THR H H 100 7.511 7.795 -0.284 1
1 1168 . 20 1 1 A 100 100 THR HA H 100 4.185 3.839 0.346 1
1 1173 . 20 1 1 A 100 100 THR C C 100 173.376 174.456 -1.080 1
1 1174 . 20 1 1 A 100 100 THR CA C 100 63.489 65.698 -2.209 1
1 1175 . 20 1 1 A 100 100 THR CB C 100 67.909 69.292 -1.383 1
1 1177 . 20 1 1 A 100 100 THR N N 100 116.525 111.268 5.257 1
1 1178 . 20 1 1 A 101 101 HIS H H 101 8.753 8.223 0.530 1
1 1179 . 20 1 1 A 101 101 HIS HA H 101 4.898 4.205 0.693 1
1 1184 . 20 1 1 A 101 101 HIS C C 101 174.345 173.749 0.596 1
1 1185 . 20 1 1 A 101 101 HIS CA C 101 55.072 56.214 -1.142 1
1 1186 . 20 1 1 A 101 101 HIS CB C 101 32.835 27.871 4.964 1
1 1189 . 20 1 1 A 101 101 HIS N N 101 125.953 116.622 9.331 1
1 1190 . 20 1 1 A 102 102 TYR H H 102 9.023 8.739 0.284 1
1 1191 . 20 1 1 A 102 102 TYR HA H 102 4.545 5.022 -0.477 1
1 1198 . 20 1 1 A 102 102 TYR C C 102 174.126 175.112 -0.986 1
1 1199 . 20 1 1 A 102 102 TYR CA C 102 57.260 56.443 0.817 1
1 1200 . 20 1 1 A 102 102 TYR CB C 102 40.381 39.336 1.045 1
1 1205 . 20 1 1 A 102 102 TYR N N 102 121.975 121.508 0.467 1
1 1206 . 20 1 1 A 103 103 TYR H H 103 8.899 9.026 -0.127 1
1 1207 . 20 1 1 A 103 103 TYR HA H 103 4.729 4.869 -0.140 1
1 1214 . 20 1 1 A 103 103 TYR C C 103 174.139 175.956 -1.817 1
1 1215 . 20 1 1 A 103 103 TYR CA C 103 58.036 58.025 0.011 1
1 1216 . 20 1 1 A 103 103 TYR CB C 103 40.485 39.744 0.741 1
1 1221 . 20 1 1 A 103 103 TYR N N 103 122.012 123.498 -1.486 1
1 1222 . 20 1 1 A 104 104 ILE H H 104 8.605 8.687 -0.082 1
1 1223 . 20 1 1 A 104 104 ILE HA H 104 4.859 5.048 -0.189 1
1 1233 . 20 1 1 A 104 104 ILE C C 104 172.769 174.049 -1.280 1
1 1234 . 20 1 1 A 104 104 ILE CA C 104 59.554 59.609 -0.055 1
1 1235 . 20 1 1 A 104 104 ILE CB C 104 40.631 41.920 -1.289 1
1 1239 . 20 1 1 A 104 104 ILE N N 104 123.443 122.954 0.489 1
1 1240 . 20 1 1 A 105 105 GLN H H 105 9.369 8.293 1.076 1
1 1241 . 20 1 1 A 105 105 GLN HA H 105 4.895 4.909 -0.014 1
1 1248 . 20 1 1 A 105 105 GLN C C 105 175.642 174.578 1.064 1
1 1249 . 20 1 1 A 105 105 GLN CA C 105 54.965 53.780 1.185 1
1 1250 . 20 1 1 A 105 105 GLN CB C 105 32.856 32.176 0.680 1
1 1252 . 20 1 1 A 105 105 GLN N N 105 125.079 124.585 0.494 1
1 1254 . 20 1 1 A 106 106 ALA H H 106 8.513 8.464 0.049 1
1 1255 . 20 1 1 A 106 106 ALA HA H 106 4.962 4.762 0.200 1
1 1259 . 20 1 1 A 106 106 ALA C C 106 175.854 177.700 -1.846 1
1 1260 . 20 1 1 A 106 106 ALA CA C 106 50.272 50.364 -0.092 1
1 1261 . 20 1 1 A 106 106 ALA CB C 106 21.197 21.539 -0.342 1
1 1262 . 20 1 1 A 106 106 ALA N N 106 129.303 128.220 1.083 1
1 1263 . 20 1 1 A 107 107 SER H H 107 9.468 8.740 0.728 1
1 1264 . 20 1 1 A 107 107 SER HA H 107 4.447 4.404 0.043 1
1 1267 . 20 1 1 A 107 107 SER C C 107 173.785 174.775 -0.990 1
1 1268 . 20 1 1 A 107 107 SER CA C 107 60.048 62.032 -1.984 1
1 1269 . 20 1 1 A 107 107 SER CB C 107 64.643 63.788 0.855 1
1 1270 . 20 1 1 A 107 107 SER N N 107 112.962 116.347 -3.385 1
1 1271 . 20 1 1 A 108 108 SER H H 108 7.555 7.965 -0.410 1
1 1272 . 20 1 1 A 108 108 SER HA H 108 4.665 4.973 -0.308 1
1 1275 . 20 1 1 A 108 108 SER C C 108 174.381 174.773 -0.392 1
1 1276 . 20 1 1 A 108 108 SER CA C 108 56.907 57.332 -0.425 1
1 1277 . 20 1 1 A 108 108 SER CB C 108 66.370 66.423 -0.053 1
1 1278 . 20 1 1 A 108 108 SER N N 108 112.243 115.405 -3.162 1
1 1279 . 20 1 1 A 109 109 LYS H H 109 8.978 8.805 0.173 1
1 1280 . 20 1 1 A 109 109 LYS HA H 109 4.777 3.903 0.874 1
1 1287 . 20 1 1 A 109 109 LYS C C 109 179.992 178.213 1.779 1
1 1288 . 20 1 1 A 109 109 LYS CA C 109 59.766 60.519 -0.753 1
1 1289 . 20 1 1 A 109 109 LYS CB C 109 32.342 32.429 -0.087 1
1 1293 . 20 1 1 A 109 109 LYS N N 109 123.170 124.994 -1.824 1
1 1294 . 20 1 1 A 110 110 ALA H H 110 8.608 8.070 0.538 1
1 1295 . 20 1 1 A 110 110 ALA HA H 110 4.178 4.127 0.051 1
1 1299 . 20 1 1 A 110 110 ALA C C 110 179.895 179.149 0.746 1
1 1300 . 20 1 1 A 110 110 ALA CA C 110 54.871 55.347 -0.476 1
1 1301 . 20 1 1 A 110 110 ALA CB C 110 18.065 18.201 -0.136 1
1 1302 . 20 1 1 A 110 110 ALA N N 110 123.750 121.047 2.703 1
1 1303 . 20 1 1 A 111 111 GLU H H 111 8.185 8.497 -0.312 1
1 1304 . 20 1 1 A 111 111 GLU HA H 111 4.180 4.012 0.168 1
1 1309 . 20 1 1 A 111 111 GLU C C 111 178.587 178.956 -0.369 1
1 1310 . 20 1 1 A 111 111 GLU CA C 111 59.466 59.955 -0.489 1
1 1311 . 20 1 1 A 111 111 GLU CB C 111 31.067 29.635 1.432 1
1 1313 . 20 1 1 A 111 111 GLU N N 111 119.757 118.460 1.297 1
1 1314 . 20 1 1 A 112 112 ARG H H 112 8.008 7.932 0.076 1
1 1315 . 20 1 1 A 112 112 ARG HA H 112 3.642 4.114 -0.472 1
1 1322 . 20 1 1 A 112 112 ARG C C 112 176.481 178.277 -1.796 1
1 1323 . 20 1 1 A 112 112 ARG CA C 112 60.419 59.610 0.809 1
1 1324 . 20 1 1 A 112 112 ARG CB C 112 29.957 30.244 -0.287 1
1 1327 . 20 1 1 A 112 112 ARG N N 112 118.430 119.735 -1.305 1
1 1328 . 20 1 1 A 113 113 ALA H H 113 7.985 7.599 0.386 1
1 1329 . 20 1 1 A 113 113 ALA HA H 113 3.925 4.070 -0.145 1
1 1333 . 20 1 1 A 113 113 ALA C C 113 180.117 179.731 0.386 1
1 1334 . 20 1 1 A 113 113 ALA CA C 113 55.372 55.126 0.246 1
1 1335 . 20 1 1 A 113 113 ALA CB C 113 17.825 18.562 -0.737 1
1 1336 . 20 1 1 A 113 113 ALA N N 113 119.980 120.519 -0.539 1
1 1337 . 20 1 1 A 114 114 GLU H H 114 8.093 8.500 -0.407 1
1 1338 . 20 1 1 A 114 114 GLU HA H 114 3.936 3.922 0.014 1
1 1343 . 20 1 1 A 114 114 GLU C C 114 180.586 179.429 1.157 1
1 1344 . 20 1 1 A 114 114 GLU CA C 114 59.148 59.464 -0.316 1
1 1345 . 20 1 1 A 114 114 GLU CB C 114 30.080 29.200 0.880 1
1 1347 . 20 1 1 A 114 114 GLU N N 114 117.168 117.880 -0.712 1
1 1348 . 20 1 1 A 115 115 TRP H H 115 7.980 8.653 -0.673 1
1 1349 . 20 1 1 A 115 115 TRP HA H 115 3.775 4.387 -0.612 1
1 1358 . 20 1 1 A 115 115 TRP C C 115 177.714 178.596 -0.882 1
1 1359 . 20 1 1 A 115 115 TRP CA C 115 62.696 59.452 3.244 1
1 1360 . 20 1 1 A 115 115 TRP CB C 115 29.052 29.303 -0.251 1
1 1366 . 20 1 1 A 115 115 TRP N N 115 120.974 120.768 0.206 1
1 1368 . 20 1 1 A 116 116 ILE H H 116 8.297 9.227 -0.930 1
1 1369 . 20 1 1 A 116 116 ILE HA H 116 3.270 3.385 -0.115 1
1 1379 . 20 1 1 A 116 116 ILE C C 116 177.568 177.640 -0.072 1
1 1380 . 20 1 1 A 116 116 ILE CA C 116 66.643 64.848 1.795 1
1 1381 . 20 1 1 A 116 116 ILE CB C 116 37.606 37.420 0.186 1
1 1385 . 20 1 1 A 116 116 ILE N N 116 118.408 119.862 -1.454 1
1 1386 . 20 1 1 A 117 117 GLU H H 117 8.026 8.930 -0.904 1
1 1387 . 20 1 1 A 117 117 GLU HA H 117 3.880 3.949 -0.069 1
1 1392 . 20 1 1 A 117 117 GLU C C 117 178.476 179.083 -0.607 1
1 1393 . 20 1 1 A 117 117 GLU CA C 117 59.219 59.720 -0.501 1
1 1394 . 20 1 1 A 117 117 GLU CB C 117 29.381 29.294 0.087 1
1 1396 . 20 1 1 A 117 117 GLU N N 117 117.096 120.174 -3.078 1
1 1397 . 20 1 1 A 118 118 ALA H H 118 7.555 7.710 -0.155 1
1 1398 . 20 1 1 A 118 118 ALA HA H 118 3.952 4.012 -0.060 1
1 1402 . 20 1 1 A 118 118 ALA C C 118 179.862 179.902 -0.040 1
1 1403 . 20 1 1 A 118 118 ALA CA C 118 54.772 55.058 -0.286 1
1 1404 . 20 1 1 A 118 118 ALA CB C 118 18.277 18.635 -0.358 1
1 1405 . 20 1 1 A 118 118 ALA N N 118 119.817 122.081 -2.264 1
1 1406 . 20 1 1 A 119 119 ILE H H 119 8.167 8.364 -0.197 1
1 1407 . 20 1 1 A 119 119 ILE HA H 119 3.558 3.772 -0.214 1
1 1417 . 20 1 1 A 119 119 ILE C C 119 178.564 178.018 0.546 1
1 1418 . 20 1 1 A 119 119 ILE CA C 119 65.766 65.249 0.517 1
1 1419 . 20 1 1 A 119 119 ILE CB C 119 38.840 37.766 1.074 1
1 1423 . 20 1 1 A 119 119 ILE N N 119 116.280 118.007 -1.727 1
1 1424 . 20 1 1 A 120 120 LYS H H 120 8.790 8.044 0.746 1
1 1425 . 20 1 1 A 120 120 LYS HA H 120 3.965 4.133 -0.168 1
1 1434 . 20 1 1 A 120 120 LYS C C 120 179.673 179.209 0.464 1
1 1435 . 20 1 1 A 120 120 LYS CA C 120 60.031 60.096 -0.065 1
1 1436 . 20 1 1 A 120 120 LYS CB C 120 32.547 32.360 0.187 1
1 1440 . 20 1 1 A 120 120 LYS N N 120 119.650 119.010 0.640 1
1 1441 . 20 1 1 A 121 121 LYS H H 121 7.594 8.160 -0.566 1
1 1442 . 20 1 1 A 121 121 LYS HA H 121 4.095 3.991 0.104 1
1 1451 . 20 1 1 A 121 121 LYS C C 121 177.962 179.248 -1.286 1
1 1452 . 20 1 1 A 121 121 LYS CA C 121 58.848 59.119 -0.271 1
1 1453 . 20 1 1 A 121 121 LYS CB C 121 32.547 32.300 0.247 1
1 1457 . 20 1 1 A 121 121 LYS N N 121 117.197 119.853 -2.656 1
1 1458 . 20 1 1 A 122 122 LEU H H 122 7.586 7.953 -0.367 1
1 1459 . 20 1 1 A 122 122 LEU HA H 122 4.535 3.894 0.641 1
1 1469 . 20 1 1 A 122 122 LEU C C 122 177.902 179.115 -1.213 1
1 1470 . 20 1 1 A 122 122 LEU CA C 122 55.071 58.110 -3.039 1
1 1471 . 20 1 1 A 122 122 LEU CB C 122 42.888 41.854 1.034 1
1 1475 . 20 1 1 A 122 122 LEU N N 122 116.861 120.324 -3.463 1
1 1476 . 20 1 1 A 123 123 THR H H 123 7.636 8.177 -0.541 1
1 1477 . 20 1 1 A 123 123 THR HA H 123 4.445 4.039 0.406 1
1 1482 . 20 1 1 A 123 123 THR C C 123 175.714 174.703 1.011 1
1 1483 . 20 1 1 A 123 123 THR CA C 123 62.643 65.522 -2.879 1
1 1484 . 20 1 1 A 123 123 THR CB C 123 70.259 68.023 2.236 1
1 1486 . 20 1 1 A 123 123 THR N N 123 108.963 110.006 -1.043 1
1 1487 . 20 1 1 A 124 124 SER H H 124 7.912 8.495 -0.583 1
1 1488 . 20 1 1 A 124 124 SER HA H 124 4.626 4.638 -0.012 1
1 1491 . 20 1 1 A 124 124 SER C C 124 174.405 174.922 -0.517 1
1 1492 . 20 1 1 A 124 124 SER CA C 124 58.390 59.553 -1.163 1
1 1493 . 20 1 1 A 124 124 SER CB C 124 64.255 64.753 -0.498 1
1 1494 . 20 1 1 A 124 124 SER N N 124 116.876 114.714 2.162 1
1 1495 . 20 1 1 A 125 125 GLY H H 125 8.307 7.984 0.323 1
1 1496 . 20 1 1 A 125 125 GLY HA2 H 125 4.166 4.030 0.136 1
1 1497 . 20 1 1 A 125 125 GLY HA3 H 125 4.166 4.033 0.133 1
1 1498 . 20 1 1 A 125 125 GLY C C 125 171.921 174.075 -2.154 1
1 1499 . 20 1 1 A 125 125 GLY CA C 125 44.748 45.132 -0.384 1
1 1500 . 20 1 1 A 125 125 GLY N N 125 110.006 108.448 1.558 1
1 1501 . 20 1 1 A 126 126 PRO HA H 126 4.510 4.580 -0.070 1
1 1508 . 20 1 1 A 126 126 PRO C C 126 177.471 174.957 2.514 1
1 1509 . 20 1 1 A 126 126 PRO CA C 126 63.419 62.554 0.865 1
1 1510 . 20 1 1 A 126 126 PRO CB C 126 32.106 29.372 2.734 1
1 1513 . 20 1 1 A 127 127 SER H H 127 8.607 8.643 -0.036 1
1 1514 . 20 1 1 A 127 127 SER C C 127 174.628 173.267 1.361 1
1 1515 . 20 1 1 A 127 127 SER CA C 127 58.513 57.579 0.934 1
1 1516 . 20 1 1 A 127 127 SER CB C 127 63.679 65.691 -2.012 1
1 1517 . 20 1 1 A 127 127 SER N N 127 116.390 118.233 -1.843 1
1 1518 . 20 1 1 A 128 128 SER H H 128 8.272 9.269 -0.997 1
1 1519 . 20 1 1 A 128 128 SER HA H 128 4.496 4.023 0.473 1
1 1520 . 20 1 1 A 128 128 SER C C 128 173.921 173.472 0.449 1
1 1521 . 20 1 1 A 128 128 SER CA C 128 58.442 59.210 -0.768 1
1 1522 . 20 1 1 A 128 128 SER CB C 128 64.173 62.035 2.138 1
1 1523 . 20 1 1 A 128 128 SER N N 128 117.506 122.656 -5.150 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 116 1.122 1
2 1 1 1 "RMS(OBS, PRED)" CA 122 1.477 1
3 1 1 1 "RMS(OBS, PRED)" CB 110 1.331 1
4 1 1 1 "RMS(OBS, PRED)" H 111 0.532 1
5 1 1 1 "RMS(OBS, PRED)" HA 133 0.370 1
6 1 1 1 "RMS(OBS, PRED)" N 111 2.986 1
7 1 2 1 "RMS(OBS, PRED)" C 116 1.168 1
8 1 2 1 "RMS(OBS, PRED)" CA 122 1.440 1
9 1 2 1 "RMS(OBS, PRED)" CB 110 1.559 1
10 1 2 1 "RMS(OBS, PRED)" H 111 0.591 1
11 1 2 1 "RMS(OBS, PRED)" HA 133 0.414 1
12 1 2 1 "RMS(OBS, PRED)" N 111 3.324 1
13 1 3 1 "RMS(OBS, PRED)" C 116 1.190 1
14 1 3 1 "RMS(OBS, PRED)" CA 122 1.266 1
15 1 3 1 "RMS(OBS, PRED)" CB 110 1.504 1
16 1 3 1 "RMS(OBS, PRED)" H 111 0.492 1
17 1 3 1 "RMS(OBS, PRED)" HA 133 0.363 1
18 1 3 1 "RMS(OBS, PRED)" N 111 3.018 1
19 1 4 1 "RMS(OBS, PRED)" C 116 1.139 1
20 1 4 1 "RMS(OBS, PRED)" CA 122 1.278 1
21 1 4 1 "RMS(OBS, PRED)" CB 110 1.419 1
22 1 4 1 "RMS(OBS, PRED)" H 111 0.519 1
23 1 4 1 "RMS(OBS, PRED)" HA 133 0.331 1
24 1 4 1 "RMS(OBS, PRED)" N 111 2.925 1
25 1 5 1 "RMS(OBS, PRED)" C 116 1.143 1
26 1 5 1 "RMS(OBS, PRED)" CA 122 1.326 1
27 1 5 1 "RMS(OBS, PRED)" CB 110 1.561 1
28 1 5 1 "RMS(OBS, PRED)" H 111 0.487 1
29 1 5 1 "RMS(OBS, PRED)" HA 133 0.361 1
30 1 5 1 "RMS(OBS, PRED)" N 111 3.218 1
31 1 6 1 "RMS(OBS, PRED)" C 116 1.175 1
32 1 6 1 "RMS(OBS, PRED)" CA 122 1.364 1
33 1 6 1 "RMS(OBS, PRED)" CB 110 1.523 1
34 1 6 1 "RMS(OBS, PRED)" H 111 0.525 1
35 1 6 1 "RMS(OBS, PRED)" HA 133 0.348 1
36 1 6 1 "RMS(OBS, PRED)" N 111 3.250 1
37 1 7 1 "RMS(OBS, PRED)" C 116 1.208 1
38 1 7 1 "RMS(OBS, PRED)" CA 122 1.333 1
39 1 7 1 "RMS(OBS, PRED)" CB 110 1.441 1
40 1 7 1 "RMS(OBS, PRED)" H 111 0.513 1
41 1 7 1 "RMS(OBS, PRED)" HA 133 0.358 1
42 1 7 1 "RMS(OBS, PRED)" N 111 3.154 1
43 1 8 1 "RMS(OBS, PRED)" C 116 1.123 1
44 1 8 1 "RMS(OBS, PRED)" CA 122 1.350 1
45 1 8 1 "RMS(OBS, PRED)" CB 110 1.481 1
46 1 8 1 "RMS(OBS, PRED)" H 111 0.542 1
47 1 8 1 "RMS(OBS, PRED)" HA 133 0.392 1
48 1 8 1 "RMS(OBS, PRED)" N 111 2.977 1
49 1 9 1 "RMS(OBS, PRED)" C 116 1.227 1
50 1 9 1 "RMS(OBS, PRED)" CA 122 1.503 1
51 1 9 1 "RMS(OBS, PRED)" CB 110 1.505 1
52 1 9 1 "RMS(OBS, PRED)" H 111 0.553 1
53 1 9 1 "RMS(OBS, PRED)" HA 133 0.384 1
54 1 9 1 "RMS(OBS, PRED)" N 111 3.105 1
55 1 10 1 "RMS(OBS, PRED)" C 116 1.116 1
56 1 10 1 "RMS(OBS, PRED)" CA 122 1.293 1
57 1 10 1 "RMS(OBS, PRED)" CB 110 1.499 1
58 1 10 1 "RMS(OBS, PRED)" H 111 0.514 1
59 1 10 1 "RMS(OBS, PRED)" HA 133 0.378 1
60 1 10 1 "RMS(OBS, PRED)" N 111 3.005 1
61 1 11 1 "RMS(OBS, PRED)" C 116 1.106 1
62 1 11 1 "RMS(OBS, PRED)" CA 122 1.281 1
63 1 11 1 "RMS(OBS, PRED)" CB 110 1.438 1
64 1 11 1 "RMS(OBS, PRED)" H 111 0.514 1
65 1 11 1 "RMS(OBS, PRED)" HA 133 0.324 1
66 1 11 1 "RMS(OBS, PRED)" N 111 3.074 1
67 1 12 1 "RMS(OBS, PRED)" C 116 1.162 1
68 1 12 1 "RMS(OBS, PRED)" CA 122 1.412 1
69 1 12 1 "RMS(OBS, PRED)" CB 110 1.573 1
70 1 12 1 "RMS(OBS, PRED)" H 111 0.534 1
71 1 12 1 "RMS(OBS, PRED)" HA 133 0.360 1
72 1 12 1 "RMS(OBS, PRED)" N 111 2.948 1
73 1 13 1 "RMS(OBS, PRED)" C 116 1.119 1
74 1 13 1 "RMS(OBS, PRED)" CA 122 1.425 1
75 1 13 1 "RMS(OBS, PRED)" CB 110 1.483 1
76 1 13 1 "RMS(OBS, PRED)" H 111 0.522 1
77 1 13 1 "RMS(OBS, PRED)" HA 133 0.336 1
78 1 13 1 "RMS(OBS, PRED)" N 111 3.012 1
79 1 14 1 "RMS(OBS, PRED)" C 116 1.119 1
80 1 14 1 "RMS(OBS, PRED)" CA 122 1.269 1
81 1 14 1 "RMS(OBS, PRED)" CB 110 1.382 1
82 1 14 1 "RMS(OBS, PRED)" H 111 0.509 1
83 1 14 1 "RMS(OBS, PRED)" HA 133 0.346 1
84 1 14 1 "RMS(OBS, PRED)" N 111 2.992 1
85 1 15 1 "RMS(OBS, PRED)" C 116 1.191 1
86 1 15 1 "RMS(OBS, PRED)" CA 122 1.191 1
87 1 15 1 "RMS(OBS, PRED)" CB 110 1.431 1
88 1 15 1 "RMS(OBS, PRED)" H 111 0.484 1
89 1 15 1 "RMS(OBS, PRED)" HA 133 0.327 1
90 1 15 1 "RMS(OBS, PRED)" N 111 2.803 1
91 1 16 1 "RMS(OBS, PRED)" C 116 1.226 1
92 1 16 1 "RMS(OBS, PRED)" CA 122 1.346 1
93 1 16 1 "RMS(OBS, PRED)" CB 110 1.489 1
94 1 16 1 "RMS(OBS, PRED)" H 111 0.518 1
95 1 16 1 "RMS(OBS, PRED)" HA 133 0.354 1
96 1 16 1 "RMS(OBS, PRED)" N 111 3.045 1
97 1 17 1 "RMS(OBS, PRED)" C 116 1.221 1
98 1 17 1 "RMS(OBS, PRED)" CA 122 1.317 1
99 1 17 1 "RMS(OBS, PRED)" CB 110 1.544 1
100 1 17 1 "RMS(OBS, PRED)" H 111 0.570 1
101 1 17 1 "RMS(OBS, PRED)" HA 133 0.379 1
102 1 17 1 "RMS(OBS, PRED)" N 111 3.298 1
103 1 18 1 "RMS(OBS, PRED)" C 116 1.197 1
104 1 18 1 "RMS(OBS, PRED)" CA 122 1.395 1
105 1 18 1 "RMS(OBS, PRED)" CB 110 1.379 1
106 1 18 1 "RMS(OBS, PRED)" H 111 0.567 1
107 1 18 1 "RMS(OBS, PRED)" HA 133 0.377 1
108 1 18 1 "RMS(OBS, PRED)" N 111 2.955 1
109 1 19 1 "RMS(OBS, PRED)" C 116 1.173 1
110 1 19 1 "RMS(OBS, PRED)" CA 122 1.308 1
111 1 19 1 "RMS(OBS, PRED)" CB 110 1.434 1
112 1 19 1 "RMS(OBS, PRED)" H 111 0.485 1
113 1 19 1 "RMS(OBS, PRED)" HA 133 0.334 1
114 1 19 1 "RMS(OBS, PRED)" N 111 2.778 1
115 1 20 1 "RMS(OBS, PRED)" C 116 1.161 1
116 1 20 1 "RMS(OBS, PRED)" CA 122 1.238 1
117 1 20 1 "RMS(OBS, PRED)" CB 110 1.492 1
118 1 20 1 "RMS(OBS, PRED)" H 111 0.491 1
119 1 20 1 "RMS(OBS, PRED)" HA 133 0.373 1
120 1 20 1 "RMS(OBS, PRED)" N 111 2.769 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 A 7 7 GLY HA2 H 7 3.978 4.111 -0.133 2
1 2 . 1 1 A 7 7 GLY HA3 H 7 3.978 4.113 -0.135 2
1 3 . 1 1 A 7 7 GLY C C 7 174.274 173.545 0.729 2
1 4 . 1 1 A 7 7 GLY CA C 7 45.383 45.311 0.072 2
1 5 . 1 1 A 8 8 SER H H 8 8.211 8.508 -0.297 2
1 6 . 1 1 A 8 8 SER HA H 8 4.425 4.663 -0.238 2
1 9 . 1 1 A 8 8 SER C C 8 174.635 173.746 0.889 2
1 10 . 1 1 A 8 8 SER CA C 8 58.425 58.821 -0.396 2
1 11 . 1 1 A 8 8 SER CB C 8 63.885 64.159 -0.274 2
1 12 . 1 1 A 8 8 SER N N 8 115.732 116.510 -0.778 2
1 13 . 1 1 A 9 9 LEU H H 9 8.316 8.244 0.072 2
1 14 . 1 1 A 9 9 LEU HA H 9 4.334 4.510 -0.176 2
1 24 . 1 1 A 9 9 LEU C C 9 177.447 175.691 1.756 2
1 25 . 1 1 A 9 9 LEU CA C 9 55.407 54.693 0.714 2
1 26 . 1 1 A 9 9 LEU CB C 9 42.171 43.243 -1.072 2
1 30 . 1 1 A 9 9 LEU N N 9 123.943 123.796 0.147 2
1 31 . 1 1 A 10 10 SER H H 10 8.304 8.438 -0.134 2
1 32 . 1 1 A 10 10 SER HA H 10 4.424 4.727 -0.303 2
1 35 . 1 1 A 10 10 SER C C 10 175.025 173.545 1.480 2
1 36 . 1 1 A 10 10 SER CA C 10 58.425 58.234 0.191 2
1 37 . 1 1 A 10 10 SER CB C 10 63.638 64.438 -0.800 2
1 38 . 1 1 A 10 10 SER N N 10 116.718 117.575 -0.857 2
1 39 . 1 1 A 11 11 THR H H 11 8.003 8.560 -0.557 2
1 40 . 1 1 A 11 11 THR HA H 11 4.196 4.616 -0.420 2
1 45 . 1 1 A 11 11 THR C C 11 176.296 173.944 2.352 2
1 46 . 1 1 A 11 11 THR CA C 11 62.483 62.379 0.104 2
1 47 . 1 1 A 11 11 THR CB C 11 69.266 70.197 -0.931 2
1 49 . 1 1 A 11 11 THR N N 11 114.902 117.788 -2.886 2
1 50 . 1 1 A 12 12 VAL H H 12 8.095 8.478 -0.383 2
1 51 . 1 1 A 12 12 VAL HA H 12 3.826 4.220 -0.394 2
1 59 . 1 1 A 12 12 VAL C C 12 178.501 176.929 1.572 2
1 60 . 1 1 A 12 12 VAL CA C 12 64.760 63.549 1.211 2
1 61 . 1 1 A 12 12 VAL CB C 12 32.013 33.258 -1.245 2
1 64 . 1 1 A 12 12 VAL N N 12 122.111 122.192 -0.081 2
1 65 . 1 1 A 13 13 GLU H H 13 8.151 8.780 -0.629 2
1 66 . 1 1 A 13 13 GLU HA H 13 3.244 3.742 -0.498 2
1 71 . 1 1 A 13 13 GLU C C 13 175.702 178.421 -2.719 2
1 72 . 1 1 A 13 13 GLU CA C 13 58.354 59.169 -0.815 2
1 73 . 1 1 A 13 13 GLU CB C 13 28.843 28.661 0.182 2
1 75 . 1 1 A 13 13 GLU N N 13 120.316 122.481 -2.165 2
1 76 . 1 1 A 14 14 LEU H H 14 7.067 7.627 -0.560 2
1 77 . 1 1 A 14 14 LEU HA H 14 4.157 4.190 -0.033 2
1 87 . 1 1 A 14 14 LEU C C 14 176.863 177.193 -0.330 2
1 88 . 1 1 A 14 14 LEU CA C 14 53.324 54.996 -1.672 2
1 89 . 1 1 A 14 14 LEU CB C 14 41.636 41.401 0.235 2
1 93 . 1 1 A 14 14 LEU N N 14 117.035 119.433 -2.398 2
1 94 . 1 1 A 15 15 SER H H 15 7.645 7.959 -0.314 2
1 95 . 1 1 A 15 15 SER HA H 15 4.305 4.581 -0.276 2
1 98 . 1 1 A 15 15 SER C C 15 175.340 173.395 1.945 2
1 99 . 1 1 A 15 15 SER CA C 15 59.783 57.539 2.244 2
1 100 . 1 1 A 15 15 SER CB C 15 64.625 62.104 2.521 2
1 101 . 1 1 A 15 15 SER N N 15 114.216 114.689 -0.473 2
1 102 . 1 1 A 16 16 GLY H H 16 8.506 8.155 0.351 2
1 103 . 1 1 A 16 16 GLY HA2 H 16 4.237 4.285 -0.048 2
1 104 . 1 1 A 16 16 GLY HA3 H 16 3.927 4.307 -0.380 2
1 105 . 1 1 A 16 16 GLY C C 16 173.661 172.237 1.424 2
1 106 . 1 1 A 16 16 GLY CA C 16 44.995 44.096 0.898 2
1 107 . 1 1 A 16 16 GLY N N 16 111.838 111.297 0.541 2
1 108 . 1 1 A 17 17 THR H H 17 8.482 9.023 -0.541 2
1 109 . 1 1 A 17 17 THR HA H 17 4.319 4.417 -0.098 2
1 114 . 1 1 A 17 17 THR C C 17 174.758 174.465 0.293 2
1 115 . 1 1 A 17 17 THR CA C 17 62.272 63.470 -1.198 2
1 116 . 1 1 A 17 17 THR CB C 17 70.706 69.054 1.652 2
1 118 . 1 1 A 17 17 THR N N 17 116.679 115.317 1.362 2
1 119 . 1 1 A 18 18 VAL H H 18 8.948 8.768 0.180 2
1 120 . 1 1 A 18 18 VAL HA H 18 3.950 4.326 -0.376 2
1 128 . 1 1 A 18 18 VAL C C 18 176.669 176.931 -0.262 2
1 129 . 1 1 A 18 18 VAL CA C 18 64.813 63.580 1.233 2
1 130 . 1 1 A 18 18 VAL CB C 18 31.807 31.695 0.112 2
1 133 . 1 1 A 18 18 VAL N N 18 127.156 127.346 -0.190 2
1 134 . 1 1 A 19 19 VAL H H 19 9.359 9.257 0.102 2
1 135 . 1 1 A 19 19 VAL HA H 19 4.234 4.381 -0.147 2
1 143 . 1 1 A 19 19 VAL C C 19 175.738 175.779 -0.041 2
1 144 . 1 1 A 19 19 VAL CA C 19 62.060 62.128 -0.068 2
1 145 . 1 1 A 19 19 VAL CB C 19 33.822 33.396 0.426 2
1 148 . 1 1 A 19 19 VAL N N 19 125.162 121.756 3.406 2
1 149 . 1 1 A 20 20 LYS H H 20 7.584 7.304 0.280 2
1 150 . 1 1 A 20 20 LYS HA H 20 4.346 4.560 -0.214 2
1 159 . 1 1 A 20 20 LYS C C 20 172.818 174.016 -1.198 2
1 160 . 1 1 A 20 20 LYS CA C 20 56.801 55.533 1.268 2
1 161 . 1 1 A 20 20 LYS CB C 20 36.624 35.515 1.109 2
1 165 . 1 1 A 20 20 LYS N N 20 121.024 120.974 0.050 2
1 166 . 1 1 A 21 21 GLN H H 21 8.625 8.516 0.109 2
1 167 . 1 1 A 21 21 GLN HA H 21 6.003 5.392 0.611 2
1 174 . 1 1 A 21 21 GLN C C 21 174.914 174.896 0.018 2
1 175 . 1 1 A 21 21 GLN CA C 21 54.207 54.627 -0.420 2
1 176 . 1 1 A 21 21 GLN CB C 21 33.452 33.234 0.218 2
1 178 . 1 1 A 21 21 GLN N N 21 122.108 123.992 -1.884 2
1 180 . 1 1 A 22 22 GLY H H 22 8.964 8.378 0.586 2
1 181 . 1 1 A 22 22 GLY HA2 H 22 4.665 4.404 0.261 2
1 182 . 1 1 A 22 22 GLY HA3 H 22 4.295 4.594 -0.299 2
1 183 . 1 1 A 22 22 GLY C C 22 170.879 171.630 -0.751 2
1 184 . 1 1 A 22 22 GLY CA C 22 45.683 45.906 -0.223 2
1 185 . 1 1 A 22 22 GLY N N 22 108.508 108.900 -0.392 2
1 186 . 1 1 A 23 23 TYR H H 23 9.145 8.734 0.411 2
1 187 . 1 1 A 23 23 TYR HA H 23 5.595 5.592 0.003 2
1 194 . 1 1 A 23 23 TYR C C 23 175.824 175.303 0.521 2
1 195 . 1 1 A 23 23 TYR CA C 23 58.019 56.696 1.323 2
1 196 . 1 1 A 23 23 TYR CB C 23 39.251 40.766 -1.515 2
1 201 . 1 1 A 23 23 TYR N N 23 120.809 119.967 0.842 2
1 202 . 1 1 A 24 24 LEU H H 24 8.935 9.646 -0.710 2
1 203 . 1 1 A 24 24 LEU HA H 24 4.716 5.064 -0.348 2
1 213 . 1 1 A 24 24 LEU C C 24 174.648 175.938 -1.290 2
1 214 . 1 1 A 24 24 LEU CA C 24 53.907 53.265 0.642 2
1 215 . 1 1 A 24 24 LEU CB C 24 46.078 45.035 1.043 2
1 219 . 1 1 A 24 24 LEU N N 24 122.887 124.600 -1.713 2
1 220 . 1 1 A 25 25 ALA H H 25 8.145 8.642 -0.497 2
1 221 . 1 1 A 25 25 ALA HA H 25 5.477 5.585 -0.108 2
1 225 . 1 1 A 25 25 ALA C C 25 175.751 175.709 0.042 2
1 226 . 1 1 A 25 25 ALA CA C 25 50.719 50.448 0.271 2
1 227 . 1 1 A 25 25 ALA CB C 25 21.074 21.009 0.065 2
1 228 . 1 1 A 25 25 ALA N N 25 122.280 123.257 -0.977 2
1 229 . 1 1 A 26 26 LYS H H 26 9.167 8.640 0.527 2
1 230 . 1 1 A 26 26 LYS HA H 26 5.221 4.591 0.630 2
1 239 . 1 1 A 26 26 LYS C C 26 175.421 175.663 -0.242 2
1 240 . 1 1 A 26 26 LYS CA C 26 54.383 55.192 -0.809 2
1 241 . 1 1 A 26 26 LYS CB C 26 36.125 33.888 2.237 2
1 245 . 1 1 A 26 26 LYS N N 26 120.638 124.687 -4.049 2
1 246 . 1 1 A 27 27 GLN H H 27 7.866 7.933 -0.067 2
1 247 . 1 1 A 27 27 GLN HA H 27 3.525 3.839 -0.314 2
1 254 . 1 1 A 27 27 GLN C C 27 177.022 175.327 1.694 2
1 255 . 1 1 A 27 27 GLN CA C 27 55.778 55.269 0.509 2
1 256 . 1 1 A 27 27 GLN CB C 27 29.864 28.705 1.159 2
1 258 . 1 1 A 27 27 GLN N N 27 130.194 125.954 4.240 2
1 260 . 1 1 A 28 28 GLY H H 28 8.565 8.189 0.376 2
1 261 . 1 1 A 28 28 GLY HA2 H 28 4.125 3.957 0.168 2
1 262 . 1 1 A 28 28 GLY HA3 H 28 4.034 4.022 0.012 2
1 263 . 1 1 A 28 28 GLY C C 28 174.030 173.156 0.874 2
1 264 . 1 1 A 28 28 GLY CA C 28 45.665 45.393 0.272 2
1 265 . 1 1 A 28 28 GLY N N 28 115.528 111.936 3.592 2
1 266 . 1 1 A 29 29 HIS HA H 29 4.355 4.754 -0.399 2
1 271 . 1 1 A 29 29 HIS CA C 29 58.795 55.887 2.908 2
1 272 . 1 1 A 29 29 HIS CB C 29 31.283 31.346 -0.063 2
1 275 . 1 1 A 30 30 LYS HA H 30 4.096 4.333 -0.237 2
1 284 . 1 1 A 30 30 LYS CA C 30 57.290 56.722 0.568 2
1 285 . 1 1 A 30 30 LYS CB C 30 31.951 33.621 -1.670 2
1 289 . 1 1 A 31 31 ARG HA H 31 3.975 4.210 -0.235 2
1 296 . 1 1 A 31 31 ARG CA C 31 55.973 57.419 -1.446 2
1 297 . 1 1 A 31 31 ARG CB C 31 29.902 30.619 -0.717 2
1 300 . 1 1 A 32 32 LYS HA H 32 4.160 4.342 -0.182 2
1 309 . 1 1 A 32 32 LYS C C 32 175.678 176.509 -0.831 2
1 310 . 1 1 A 32 32 LYS CA C 32 56.254 57.102 -0.848 2
1 311 . 1 1 A 32 32 LYS CB C 32 31.602 32.928 -1.326 2
1 315 . 1 1 A 33 33 ASN H H 33 7.925 8.604 -0.679 2
1 316 . 1 1 A 33 33 ASN HA H 33 4.799 4.710 0.089 2
1 321 . 1 1 A 33 33 ASN C C 33 174.005 175.262 -1.257 2
1 322 . 1 1 A 33 33 ASN CA C 33 52.407 54.701 -2.294 2
1 323 . 1 1 A 33 33 ASN CB C 33 39.879 39.256 0.623 2
1 324 . 1 1 A 33 33 ASN N N 33 116.990 119.295 -2.305 2
1 326 . 1 1 A 34 34 TRP H H 34 8.798 8.152 0.646 2
1 327 . 1 1 A 34 34 TRP HA H 34 4.755 5.140 -0.385 2
1 336 . 1 1 A 34 34 TRP C C 34 176.090 175.760 0.330 2
1 337 . 1 1 A 34 34 TRP CA C 34 57.119 56.566 0.553 2
1 338 . 1 1 A 34 34 TRP CB C 34 30.596 31.648 -1.052 2
1 344 . 1 1 A 34 34 TRP N N 34 121.917 117.876 4.041 2
1 346 . 1 1 A 35 35 LYS H H 35 8.404 8.680 -0.276 2
1 347 . 1 1 A 35 35 LYS HA H 35 4.846 4.951 -0.105 2
1 354 . 1 1 A 35 35 LYS C C 35 176.088 175.866 0.222 2
1 355 . 1 1 A 35 35 LYS CA C 35 54.418 54.929 -0.511 2
1 356 . 1 1 A 35 35 LYS CB C 35 36.125 35.326 0.799 2
1 360 . 1 1 A 35 35 LYS N N 35 120.864 122.285 -1.421 2
1 361 . 1 1 A 36 36 VAL H H 36 8.977 8.698 0.279 2
1 362 . 1 1 A 36 36 VAL HA H 36 4.274 4.580 -0.306 2
1 370 . 1 1 A 36 36 VAL C C 36 176.733 175.882 0.851 2
1 371 . 1 1 A 36 36 VAL CA C 36 64.319 62.683 1.636 2
1 372 . 1 1 A 36 36 VAL CB C 36 31.602 32.188 -0.586 2
1 375 . 1 1 A 36 36 VAL N N 36 124.314 124.224 0.090 2
1 376 . 1 1 A 37 37 ARG H H 37 9.498 10.239 -0.741 2
1 377 . 1 1 A 37 37 ARG HA H 37 5.053 5.081 -0.028 2
1 384 . 1 1 A 37 37 ARG C C 37 174.442 174.559 -0.117 2
1 385 . 1 1 A 37 37 ARG CA C 37 53.272 54.328 -1.056 2
1 386 . 1 1 A 37 37 ARG CB C 37 34.563 34.322 0.241 2
1 389 . 1 1 A 37 37 ARG N N 37 128.121 126.731 1.390 2
1 390 . 1 1 A 38 38 ARG H H 38 8.755 8.666 0.089 2
1 391 . 1 1 A 38 38 ARG HA H 38 4.626 4.389 0.237 2
1 398 . 1 1 A 38 38 ARG C C 38 175.514 175.014 0.500 2
1 399 . 1 1 A 38 38 ARG CA C 38 55.601 55.609 -0.008 2
1 400 . 1 1 A 38 38 ARG CB C 38 32.219 30.777 1.442 2
1 403 . 1 1 A 38 38 ARG N N 38 121.442 124.344 -2.902 2
1 404 . 1 1 A 39 39 PHE H H 39 9.865 8.964 0.901 2
1 405 . 1 1 A 39 39 PHE HA H 39 5.424 5.084 0.340 2
1 413 . 1 1 A 39 39 PHE C C 39 175.423 174.771 0.652 2
1 414 . 1 1 A 39 39 PHE CA C 39 57.419 57.009 0.410 2
1 415 . 1 1 A 39 39 PHE CB C 39 42.623 40.953 1.670 2
1 421 . 1 1 A 39 39 PHE N N 39 130.027 126.470 3.557 2
1 422 . 1 1 A 40 40 VAL H H 40 9.300 9.986 -0.686 2
1 423 . 1 1 A 40 40 VAL HA H 40 4.846 5.313 -0.467 2
1 431 . 1 1 A 40 40 VAL C C 40 174.477 173.419 1.058 2
1 432 . 1 1 A 40 40 VAL CA C 40 62.343 59.897 2.446 2
1 433 . 1 1 A 40 40 VAL CB C 40 35.755 35.031 0.724 2
1 436 . 1 1 A 40 40 VAL N N 40 119.369 122.159 -2.790 2
1 437 . 1 1 A 41 41 LEU H H 41 9.557 9.989 -0.432 2
1 438 . 1 1 A 41 41 LEU HA H 41 5.292 5.450 -0.158 2
1 448 . 1 1 A 41 41 LEU C C 41 174.632 175.392 -0.760 2
1 449 . 1 1 A 41 41 LEU CA C 41 53.571 53.689 -0.118 2
1 450 . 1 1 A 41 41 LEU CB C 41 45.337 44.887 0.450 2
1 454 . 1 1 A 41 41 LEU N N 41 132.121 129.394 2.727 2
1 455 . 1 1 A 42 42 ARG H H 42 9.396 8.956 0.440 2
1 456 . 1 1 A 42 42 ARG HA H 42 5.366 5.404 -0.038 2
1 464 . 1 1 A 42 42 ARG C C 42 173.997 174.966 -0.969 2
1 465 . 1 1 A 42 42 ARG CA C 42 54.631 54.215 0.416 2
1 466 . 1 1 A 42 42 ARG CB C 42 35.550 34.301 1.249 2
1 469 . 1 1 A 42 42 ARG N N 42 128.120 124.494 3.626 2
1 471 . 1 1 A 43 43 LYS H H 43 8.597 8.955 -0.358 2
1 472 . 1 1 A 43 43 LYS HA H 43 4.558 4.934 -0.376 2
1 481 . 1 1 A 43 43 LYS C C 43 174.648 175.186 -0.538 2
1 482 . 1 1 A 43 43 LYS CA C 43 53.378 54.765 -1.387 2
1 483 . 1 1 A 43 43 LYS CB C 43 37.303 35.913 1.390 2
1 487 . 1 1 A 43 43 LYS N N 43 114.484 118.649 -4.165 2
1 488 . 1 1 A 44 44 ASP H H 44 8.388 8.952 -0.564 2
1 489 . 1 1 A 44 44 ASP HA H 44 4.349 4.230 0.119 2
1 492 . 1 1 A 44 44 ASP C C 44 173.376 174.445 -1.069 2
1 493 . 1 1 A 44 44 ASP CA C 44 54.842 54.903 -0.061 2
1 494 . 1 1 A 44 44 ASP CB C 44 39.991 39.524 0.467 2
1 495 . 1 1 A 44 44 ASP N N 44 115.453 119.059 -3.606 2
1 496 . 1 1 A 45 45 PRO HA H 45 4.652 4.567 0.085 2
1 503 . 1 1 A 45 45 PRO C C 45 176.914 175.566 1.347 2
1 504 . 1 1 A 45 45 PRO CA C 45 63.490 62.644 0.846 2
1 505 . 1 1 A 45 45 PRO CB C 45 34.892 32.622 2.270 2
1 508 . 1 1 A 46 46 ALA H H 46 8.112 8.280 -0.168 2
1 509 . 1 1 A 46 46 ALA HA H 46 5.455 4.660 0.795 2
1 513 . 1 1 A 46 46 ALA C C 46 177.234 176.589 0.645 2
1 514 . 1 1 A 46 46 ALA CA C 46 51.560 50.908 0.652 2
1 515 . 1 1 A 46 46 ALA CB C 46 20.122 19.629 0.493 2
1 516 . 1 1 A 46 46 ALA N N 46 120.155 123.182 -3.027 2
1 517 . 1 1 A 47 47 PHE H H 47 8.717 8.956 -0.239 2
1 518 . 1 1 A 47 47 PHE HA H 47 4.795 5.070 -0.275 2
1 526 . 1 1 A 47 47 PHE C C 47 172.588 174.286 -1.698 2
1 527 . 1 1 A 47 47 PHE CA C 47 57.348 56.298 1.050 2
1 528 . 1 1 A 47 47 PHE CB C 47 47.123 44.041 3.082 2
1 534 . 1 1 A 47 47 PHE N N 47 129.946 119.964 9.982 2
1 535 . 1 1 A 48 48 LEU H H 48 7.883 8.247 -0.364 2
1 536 . 1 1 A 48 48 LEU HA H 48 5.198 5.168 0.030 2
1 546 . 1 1 A 48 48 LEU C C 48 173.569 174.428 -0.859 2
1 547 . 1 1 A 48 48 LEU CA C 48 53.290 54.087 -0.797 2
1 548 . 1 1 A 48 48 LEU CB C 48 45.502 45.336 0.166 2
1 552 . 1 1 A 48 48 LEU N N 48 121.108 122.200 -1.092 2
1 553 . 1 1 A 49 49 HIS H H 49 8.606 8.970 -0.364 2
1 554 . 1 1 A 49 49 HIS HA H 49 5.035 5.032 0.003 2
1 559 . 1 1 A 49 49 HIS C C 49 173.993 173.722 0.271 2
1 560 . 1 1 A 49 49 HIS CA C 49 56.483 54.056 2.427 2
1 561 . 1 1 A 49 49 HIS CB C 49 35.919 33.602 2.317 2
1 564 . 1 1 A 49 49 HIS N N 49 121.199 125.522 -4.323 2
1 565 . 1 1 A 50 50 TYR H H 50 7.777 8.298 -0.521 2
1 566 . 1 1 A 50 50 TYR HA H 50 5.695 5.606 0.089 2
1 573 . 1 1 A 50 50 TYR C C 50 174.284 172.235 2.049 2
1 574 . 1 1 A 50 50 TYR CA C 50 53.430 55.296 -1.866 2
1 575 . 1 1 A 50 50 TYR CB C 50 38.552 41.011 -2.459 2
1 580 . 1 1 A 50 50 TYR N N 50 114.156 117.589 -3.433 2
1 581 . 1 1 A 51 51 TYR H H 51 9.323 9.513 -0.190 2
1 582 . 1 1 A 51 51 TYR HA H 51 4.600 5.007 -0.407 2
1 589 . 1 1 A 51 51 TYR C C 51 175.352 174.363 0.989 2
1 590 . 1 1 A 51 51 TYR CA C 51 57.330 56.344 0.986 2
1 591 . 1 1 A 51 51 TYR CB C 51 41.683 42.132 -0.449 2
1 596 . 1 1 A 51 51 TYR N N 51 119.100 119.347 -0.247 2
1 597 . 1 1 A 52 52 ASP H H 52 9.375 8.695 0.680 2
1 598 . 1 1 A 52 52 ASP HA H 52 5.064 4.957 0.107 2
1 601 . 1 1 A 52 52 ASP C C 52 175.484 175.876 -0.392 2
1 602 . 1 1 A 52 52 ASP CA C 52 51.313 51.408 -0.095 2
1 603 . 1 1 A 52 52 ASP CB C 52 41.883 42.028 -0.145 2
1 604 . 1 1 A 52 52 ASP N N 52 124.636 123.436 1.200 2
1 605 . 1 1 A 53 53 PRO HA H 53 4.678 4.593 0.085 2
1 612 . 1 1 A 53 53 PRO C C 53 176.781 177.686 -0.905 2
1 613 . 1 1 A 53 53 PRO CA C 53 64.054 64.329 -0.275 2
1 614 . 1 1 A 53 53 PRO CB C 53 32.589 32.124 0.465 2
1 617 . 1 1 A 54 54 SER H H 54 8.685 8.696 -0.011 2
1 618 . 1 1 A 54 54 SER HA H 54 4.483 4.440 0.043 2
1 621 . 1 1 A 54 54 SER C C 54 174.006 174.522 -0.516 2
1 622 . 1 1 A 54 54 SER CA C 54 59.378 60.467 -1.089 2
1 623 . 1 1 A 54 54 SER CB C 54 64.132 63.836 0.296 2
1 624 . 1 1 A 54 54 SER N N 54 113.769 112.683 1.086 2
1 625 . 1 1 A 55 55 LYS H H 55 7.706 7.849 -0.143 2
1 626 . 1 1 A 55 55 LYS HA H 55 4.580 4.674 -0.094 2
1 635 . 1 1 A 55 55 LYS C C 55 175.969 175.479 0.490 2
1 636 . 1 1 A 55 55 LYS CA C 55 55.160 55.323 -0.163 2
1 637 . 1 1 A 55 55 LYS CB C 55 34.069 34.367 -0.298 2
1 641 . 1 1 A 55 55 LYS N N 55 122.222 119.793 2.429 2
1 642 . 1 1 A 56 56 GLU H H 56 8.666 8.724 -0.058 2
1 643 . 1 1 A 56 56 GLU HA H 56 4.174 4.944 -0.770 2
1 648 . 1 1 A 56 56 GLU C C 56 177.084 174.857 2.227 2
1 649 . 1 1 A 56 56 GLU CA C 56 57.099 55.680 1.419 2
1 650 . 1 1 A 56 56 GLU CB C 56 29.694 31.024 -1.331 2
1 652 . 1 1 A 56 56 GLU N N 56 122.015 119.677 2.338 2
1 653 . 1 1 A 57 57 GLU H H 57 8.303 8.611 -0.308 2
1 654 . 1 1 A 57 57 GLU HA H 57 4.214 4.722 -0.508 2
1 659 . 1 1 A 57 57 GLU CA C 57 56.960 55.510 1.450 2
1 660 . 1 1 A 57 57 GLU CB C 57 30.264 33.063 -2.799 2
1 662 . 1 1 A 57 57 GLU N N 57 119.884 123.601 -3.717 2
1 663 . 1 1 A 58 58 ASN HA H 58 4.768 4.846 -0.078 2
1 668 . 1 1 A 58 58 ASN C C 58 174.902 174.037 0.865 2
1 669 . 1 1 A 58 58 ASN CA C 58 52.740 53.421 -0.681 2
1 670 . 1 1 A 58 58 ASN CB C 58 38.116 37.480 0.636 2
1 672 . 1 1 A 59 59 ARG H H 59 7.805 7.943 -0.138 2
1 673 . 1 1 A 59 59 ARG HA H 59 4.762 4.710 0.052 2
1 680 . 1 1 A 59 59 ARG CA C 59 53.151 54.179 -1.028 2
1 681 . 1 1 A 59 59 ARG CB C 59 31.519 32.858 -1.339 2
1 684 . 1 1 A 59 59 ARG N N 59 121.060 120.315 0.745 2
1 685 . 1 1 A 60 60 PRO HA H 60 3.357 3.984 -0.627 2
1 692 . 1 1 A 60 60 PRO C C 60 176.817 176.439 0.378 2
1 693 . 1 1 A 60 60 PRO CA C 60 63.031 61.825 1.206 2
1 694 . 1 1 A 60 60 PRO CB C 60 31.273 32.167 -0.894 2
1 697 . 1 1 A 61 61 VAL H H 61 8.627 8.535 0.092 2
1 698 . 1 1 A 61 61 VAL HA H 61 3.966 3.863 0.103 2
1 706 . 1 1 A 61 61 VAL C C 61 176.503 176.103 0.400 2
1 707 . 1 1 A 61 61 VAL CA C 61 63.154 64.011 -0.857 2
1 708 . 1 1 A 61 61 VAL CB C 61 32.048 32.318 -0.270 2
1 711 . 1 1 A 61 61 VAL N N 61 119.185 119.508 -0.323 2
1 712 . 1 1 A 62 62 GLY H H 62 6.715 6.519 0.196 2
1 713 . 1 1 A 62 62 GLY HA2 H 62 3.940 3.875 0.065 2
1 714 . 1 1 A 62 62 GLY HA3 H 62 3.538 3.942 -0.404 2
1 715 . 1 1 A 62 62 GLY C C 62 169.983 172.404 -2.421 2
1 716 . 1 1 A 62 62 GLY CA C 62 44.465 45.512 -1.047 2
1 717 . 1 1 A 62 62 GLY N N 62 105.813 106.456 -0.643 2
1 718 . 1 1 A 63 63 GLY H H 63 8.004 8.317 -0.313 2
1 719 . 1 1 A 63 63 GLY HA2 H 63 4.095 3.264 0.831 2
1 720 . 1 1 A 63 63 GLY HA3 H 63 3.813 3.761 0.052 2
1 721 . 1 1 A 63 63 GLY C C 63 171.870 172.410 -0.540 2
1 722 . 1 1 A 63 63 GLY CA C 63 47.148 44.360 2.788 2
1 723 . 1 1 A 63 63 GLY N N 63 105.089 108.109 -3.020 2
1 724 . 1 1 A 64 64 PHE H H 64 7.967 7.586 0.381 2
1 725 . 1 1 A 64 64 PHE HA H 64 4.934 5.524 -0.590 2
1 733 . 1 1 A 64 64 PHE C C 64 173.140 174.053 -0.913 2
1 734 . 1 1 A 64 64 PHE CA C 64 55.248 55.317 -0.069 2
1 735 . 1 1 A 64 64 PHE CB C 64 40.238 42.120 -1.882 2
1 741 . 1 1 A 64 64 PHE N N 64 113.387 119.451 -6.064 2
1 742 . 1 1 A 65 65 SER H H 65 8.518 8.998 -0.480 2
1 743 . 1 1 A 65 65 SER HA H 65 3.264 4.411 -1.147 2
1 746 . 1 1 A 65 65 SER C C 65 176.417 174.415 2.002 2
1 747 . 1 1 A 65 65 SER CA C 65 56.819 57.911 -1.092 2
1 748 . 1 1 A 65 65 SER CB C 65 63.391 64.314 -0.923 2
1 749 . 1 1 A 65 65 SER N N 65 114.674 115.882 -1.208 2
1 750 . 1 1 A 66 66 LEU H H 66 7.404 8.117 -0.713 2
1 751 . 1 1 A 66 66 LEU HA H 66 4.470 4.413 0.057 2
1 761 . 1 1 A 66 66 LEU C C 66 177.993 178.075 -0.082 2
1 762 . 1 1 A 66 66 LEU CA C 66 54.242 56.290 -2.048 2
1 763 . 1 1 A 66 66 LEU CB C 66 42.787 42.428 0.359 2
1 767 . 1 1 A 66 66 LEU N N 66 123.988 123.727 0.261 2
1 768 . 1 1 A 67 67 ARG H H 67 7.865 7.796 0.069 2
1 769 . 1 1 A 67 67 ARG HA H 67 4.175 3.988 0.187 2
1 776 . 1 1 A 67 67 ARG C C 67 178.562 177.697 0.865 2
1 777 . 1 1 A 67 67 ARG CA C 67 58.143 58.942 -0.799 2
1 778 . 1 1 A 67 67 ARG CB C 67 29.052 30.053 -1.001 2
1 781 . 1 1 A 67 67 ARG N N 67 122.494 118.331 4.163 2
1 782 . 1 1 A 68 68 GLY H H 68 9.398 8.281 1.117 2
1 783 . 1 1 A 68 68 GLY HA2 H 68 4.066 3.947 0.119 2
1 784 . 1 1 A 68 68 GLY HA3 H 68 3.908 3.952 -0.044 2
1 785 . 1 1 A 68 68 GLY C C 68 173.982 173.761 0.221 2
1 786 . 1 1 A 68 68 GLY CA C 68 46.230 46.238 -0.008 2
1 787 . 1 1 A 68 68 GLY N N 68 117.548 109.539 8.009 2
1 788 . 1 1 A 69 69 SER H H 69 7.829 7.856 -0.027 2
1 789 . 1 1 A 69 69 SER HA H 69 4.807 5.159 -0.352 2
1 792 . 1 1 A 69 69 SER C C 69 172.854 172.881 -0.027 2
1 793 . 1 1 A 69 69 SER CA C 69 59.290 57.065 2.225 2
1 794 . 1 1 A 69 69 SER CB C 69 65.366 67.241 -1.875 2
1 795 . 1 1 A 69 69 SER N N 69 115.188 114.342 0.846 2
1 796 . 1 1 A 70 70 LEU H H 70 8.805 8.670 0.135 2
1 797 . 1 1 A 70 70 LEU HA H 70 4.846 4.866 -0.020 2
1 807 . 1 1 A 70 70 LEU C C 70 175.775 174.250 1.525 2
1 808 . 1 1 A 70 70 LEU CA C 70 53.907 53.947 -0.040 2
1 809 . 1 1 A 70 70 LEU CB C 70 45.337 45.594 -0.257 2
1 813 . 1 1 A 70 70 LEU N N 70 121.265 122.763 -1.498 2
1 814 . 1 1 A 71 71 VAL H H 71 8.644 8.755 -0.111 2
1 815 . 1 1 A 71 71 VAL HA H 71 5.555 5.184 0.371 2
1 823 . 1 1 A 71 71 VAL C C 71 173.636 173.387 0.249 2
1 824 . 1 1 A 71 71 VAL CA C 71 58.760 59.853 -1.093 2
1 825 . 1 1 A 71 71 VAL CB C 71 34.891 35.732 -0.841 2
1 828 . 1 1 A 71 71 VAL N N 71 122.315 122.317 -0.002 2
1 829 . 1 1 A 72 72 SER H H 72 8.750 8.946 -0.196 2
1 830 . 1 1 A 72 72 SER HA H 72 4.742 5.004 -0.262 2
1 833 . 1 1 A 72 72 SER C C 72 173.058 172.636 0.422 2
1 834 . 1 1 A 72 72 SER CA C 72 57.190 57.641 -0.451 2
1 835 . 1 1 A 72 72 SER CB C 72 65.612 67.319 -1.707 2
1 836 . 1 1 A 72 72 SER N N 72 118.611 121.844 -3.233 2
1 837 . 1 1 A 73 73 ALA H H 73 9.009 8.667 0.342 2
1 838 . 1 1 A 73 73 ALA HA H 73 4.406 5.101 -0.695 2
1 842 . 1 1 A 73 73 ALA C C 73 176.708 176.778 -0.070 2
1 843 . 1 1 A 73 73 ALA CA C 73 52.672 50.528 2.144 2
1 844 . 1 1 A 73 73 ALA CB C 73 18.812 21.247 -2.435 2
1 845 . 1 1 A 73 73 ALA N N 73 125.694 125.442 0.252 2
1 846 . 1 1 A 74 74 LEU H H 74 7.800 8.474 -0.674 2
1 847 . 1 1 A 74 74 LEU HA H 74 4.716 4.758 -0.042 2
1 857 . 1 1 A 74 74 LEU C C 74 176.551 176.410 0.141 2
1 858 . 1 1 A 74 74 LEU CA C 74 53.784 53.904 -0.120 2
1 859 . 1 1 A 74 74 LEU CB C 74 43.446 42.736 0.710 2
1 863 . 1 1 A 74 74 LEU N N 74 122.271 121.275 0.996 2
1 864 . 1 1 A 75 75 GLU H H 75 8.855 8.655 0.200 2
1 865 . 1 1 A 75 75 GLU HA H 75 4.336 4.566 -0.230 2
1 870 . 1 1 A 75 75 GLU C C 75 176.465 175.698 0.767 2
1 871 . 1 1 A 75 75 GLU CA C 75 56.507 56.110 0.397 2
1 872 . 1 1 A 75 75 GLU CB C 75 30.245 30.762 -0.517 2
1 874 . 1 1 A 75 75 GLU N N 75 122.678 122.114 0.564 2
1 875 . 1 1 A 76 76 ASP H H 76 8.542 8.588 -0.046 2
1 876 . 1 1 A 76 76 ASP HA H 76 4.665 4.809 -0.144 2
1 879 . 1 1 A 76 76 ASP C C 76 176.087 175.572 0.515 2
1 880 . 1 1 A 76 76 ASP CA C 76 55.107 54.456 0.651 2
1 881 . 1 1 A 76 76 ASP CB C 76 41.431 41.565 -0.134 2
1 882 . 1 1 A 76 76 ASP N N 76 121.488 121.530 -0.042 2
1 883 . 1 1 A 77 77 ASN H H 77 8.322 8.581 -0.259 2
1 884 . 1 1 A 77 77 ASN HA H 77 4.729 4.678 0.051 2
1 889 . 1 1 A 77 77 ASN C C 77 175.566 175.471 0.095 2
1 890 . 1 1 A 77 77 ASN CA C 77 53.131 53.877 -0.746 2
1 891 . 1 1 A 77 77 ASN CB C 77 38.617 38.978 -0.361 2
1 892 . 1 1 A 77 77 ASN N N 77 118.676 120.747 -2.071 2
1 894 . 1 1 A 78 78 GLY H H 78 8.311 8.474 -0.163 2
1 895 . 1 1 A 78 78 GLY HA2 H 78 3.897 3.967 -0.070 2
1 896 . 1 1 A 78 78 GLY HA3 H 78 3.897 3.971 -0.074 2
1 897 . 1 1 A 78 78 GLY C C 78 173.376 173.928 -0.552 2
1 898 . 1 1 A 78 78 GLY CA C 78 45.224 46.091 -0.867 2
1 899 . 1 1 A 78 78 GLY N N 78 108.939 109.643 -0.704 2
1 900 . 1 1 A 79 79 VAL H H 79 7.882 8.320 -0.438 2
1 901 . 1 1 A 79 79 VAL HA H 79 4.345 4.253 0.093 2
1 909 . 1 1 A 79 79 VAL CA C 79 59.995 61.313 -1.318 2
1 910 . 1 1 A 79 79 VAL CB C 79 32.589 32.004 0.585 2
1 913 . 1 1 A 79 79 VAL N N 79 121.135 120.002 1.133 2
1 914 . 1 1 A 80 80 PRO HA H 80 4.461 4.585 -0.124 2
1 921 . 1 1 A 80 80 PRO C C 80 176.979 176.785 0.194 2
1 922 . 1 1 A 80 80 PRO CA C 80 63.101 63.857 -0.756 2
1 923 . 1 1 A 80 80 PRO CB C 80 32.177 32.050 0.127 2
1 926 . 1 1 A 81 81 THR H H 81 8.281 8.230 0.051 2
1 927 . 1 1 A 81 81 THR HA H 81 4.095 4.251 -0.156 2
1 932 . 1 1 A 81 81 THR C C 81 175.270 175.002 0.268 2
1 933 . 1 1 A 81 81 THR CA C 81 62.872 63.205 -0.333 2
1 934 . 1 1 A 81 81 THR CB C 81 69.642 69.250 0.392 2
1 936 . 1 1 A 81 81 THR N N 81 114.684 112.713 1.971 2
1 937 . 1 1 A 82 82 GLY H H 82 8.338 8.586 -0.248 2
1 938 . 1 1 A 82 82 GLY HA2 H 82 4.095 3.882 0.213 2
1 939 . 1 1 A 82 82 GLY HA3 H 82 3.668 3.901 -0.233 2
1 940 . 1 1 A 82 82 GLY C C 82 174.139 174.074 0.065 2
1 941 . 1 1 A 82 82 GLY CA C 82 45.083 46.711 -1.628 2
1 942 . 1 1 A 82 82 GLY N N 82 111.289 112.708 -1.419 2
1 943 . 1 1 A 83 83 VAL H H 83 7.668 8.011 -0.343 2
1 944 . 1 1 A 83 83 VAL HA H 83 3.985 4.116 -0.131 2
1 952 . 1 1 A 83 83 VAL C C 83 176.054 175.585 0.469 2
1 953 . 1 1 A 83 83 VAL CA C 83 62.431 62.175 0.256 2
1 954 . 1 1 A 83 83 VAL CB C 83 32.260 32.803 -0.543 2
1 957 . 1 1 A 83 83 VAL N N 83 120.003 120.843 -0.840 2
1 958 . 1 1 A 84 84 LYS H H 84 8.645 8.339 0.306 2
1 959 . 1 1 A 84 84 LYS HA H 84 4.276 4.034 0.242 2
1 968 . 1 1 A 84 84 LYS C C 84 176.832 177.414 -0.582 2
1 969 . 1 1 A 84 84 LYS CA C 84 56.272 57.952 -1.680 2
1 970 . 1 1 A 84 84 LYS CB C 84 32.876 32.286 0.590 2
1 974 . 1 1 A 84 84 LYS N N 84 126.447 124.052 2.395 2
1 975 . 1 1 A 85 85 GLY H H 85 8.410 8.602 -0.192 2
1 976 . 1 1 A 85 85 GLY HA2 H 85 4.066 3.991 0.075 2
1 977 . 1 1 A 85 85 GLY HA3 H 85 3.781 4.033 -0.252 2
1 978 . 1 1 A 85 85 GLY C C 85 173.969 173.978 -0.009 2
1 979 . 1 1 A 85 85 GLY CA C 85 45.146 45.825 -0.679 2
1 980 . 1 1 A 85 85 GLY N N 85 109.957 109.392 0.565 2
1 981 . 1 1 A 86 86 ASN H H 86 8.298 8.430 -0.132 2
1 982 . 1 1 A 86 86 ASN HA H 86 4.665 4.944 -0.279 2
1 987 . 1 1 A 86 86 ASN C C 86 174.987 174.578 0.409 2
1 988 . 1 1 A 86 86 ASN CA C 86 52.989 53.011 -0.022 2
1 989 . 1 1 A 86 86 ASN CB C 86 38.376 39.360 -0.984 2
1 990 . 1 1 A 86 86 ASN N N 86 118.457 119.131 -0.674 2
1 992 . 1 1 A 87 87 VAL H H 87 7.660 8.380 -0.720 2
1 993 . 1 1 A 87 87 VAL HA H 87 3.946 4.146 -0.200 2
1 1001 . 1 1 A 87 87 VAL C C 87 174.902 175.848 -0.946 2
1 1002 . 1 1 A 87 87 VAL CA C 87 62.307 61.517 0.790 2
1 1003 . 1 1 A 87 87 VAL CB C 87 32.548 33.129 -0.581 2
1 1006 . 1 1 A 87 87 VAL N N 87 120.557 120.470 0.087 2
1 1007 . 1 1 A 88 88 GLN H H 88 8.115 8.318 -0.203 2
1 1008 . 1 1 A 88 88 GLN HA H 88 4.302 4.328 -0.026 2
1 1015 . 1 1 A 88 88 GLN C C 88 175.637 176.063 -0.426 2
1 1016 . 1 1 A 88 88 GLN CA C 88 55.336 56.380 -1.044 2
1 1017 . 1 1 A 88 88 GLN CB C 88 30.574 29.693 0.881 2
1 1019 . 1 1 A 88 88 GLN N N 88 122.280 121.899 0.381 2
1 1021 . 1 1 A 89 89 GLY H H 89 8.544 8.111 0.433 2
1 1022 . 1 1 A 89 89 GLY HA2 H 89 3.885 4.038 -0.153 2
1 1023 . 1 1 A 89 89 GLY HA3 H 89 3.885 4.049 -0.164 2
1 1024 . 1 1 A 89 89 GLY C C 89 172.861 174.310 -1.449 2
1 1025 . 1 1 A 89 89 GLY CA C 89 44.889 45.340 -0.451 2
1 1026 . 1 1 A 89 89 GLY N N 89 110.135 107.690 2.445 2
1 1027 . 1 1 A 90 90 ASN H H 90 8.451 8.441 0.009 2
1 1028 . 1 1 A 90 90 ASN HA H 90 4.222 4.705 -0.483 2
1 1033 . 1 1 A 90 90 ASN C C 90 174.926 174.758 0.168 2
1 1034 . 1 1 A 90 90 ASN CA C 90 54.613 53.686 0.927 2
1 1035 . 1 1 A 90 90 ASN CB C 90 37.852 38.027 -0.175 2
1 1036 . 1 1 A 90 90 ASN N N 90 114.322 118.391 -4.069 2
1 1038 . 1 1 A 91 91 LEU H H 91 8.933 7.979 0.954 2
1 1039 . 1 1 A 91 91 LEU HA H 91 5.367 4.710 0.657 2
1 1049 . 1 1 A 91 91 LEU C C 91 178.732 175.774 2.958 2
1 1050 . 1 1 A 91 91 LEU CA C 91 55.160 54.760 0.400 2
1 1051 . 1 1 A 91 91 LEU CB C 91 45.461 42.916 2.545 2
1 1055 . 1 1 A 91 91 LEU N N 91 120.057 120.392 -0.335 2
1 1056 . 1 1 A 92 92 PHE H H 92 9.901 8.191 1.710 2
1 1057 . 1 1 A 92 92 PHE HA H 92 5.105 5.242 -0.137 2
1 1065 . 1 1 A 92 92 PHE C C 92 170.140 172.725 -2.585 2
1 1066 . 1 1 A 92 92 PHE CA C 92 56.236 56.058 0.178 2
1 1067 . 1 1 A 92 92 PHE CB C 92 42.664 41.410 1.254 2
1 1073 . 1 1 A 92 92 PHE N N 92 119.740 116.493 3.247 2
1 1074 . 1 1 A 93 93 LYS H H 93 9.154 9.116 0.038 2
1 1075 . 1 1 A 93 93 LYS HA H 93 5.584 5.220 0.364 2
1 1083 . 1 1 A 93 93 LYS C C 93 174.830 174.979 -0.149 2
1 1084 . 1 1 A 93 93 LYS CA C 93 53.148 54.038 -0.890 2
1 1085 . 1 1 A 93 93 LYS CB C 93 36.660 36.161 0.499 2
1 1089 . 1 1 A 93 93 LYS N N 93 117.710 118.383 -0.673 2
1 1090 . 1 1 A 94 94 VAL H H 94 8.507 8.658 -0.151 2
1 1091 . 1 1 A 94 94 VAL HA H 94 4.872 5.060 -0.188 2
1 1099 . 1 1 A 94 94 VAL C C 94 174.408 174.835 -0.427 2
1 1100 . 1 1 A 94 94 VAL CA C 94 60.525 61.466 -0.941 2
1 1101 . 1 1 A 94 94 VAL CB C 94 34.862 34.217 0.645 2
1 1104 . 1 1 A 94 94 VAL N N 94 121.741 120.467 1.274 2
1 1105 . 1 1 A 95 95 ILE H H 95 8.959 9.012 -0.053 2
1 1106 . 1 1 A 95 95 ILE HA H 95 4.794 4.883 -0.089 2
1 1116 . 1 1 A 95 95 ILE C C 95 177.642 176.238 1.404 2
1 1117 . 1 1 A 95 95 ILE CA C 95 59.713 60.562 -0.849 2
1 1118 . 1 1 A 95 95 ILE CB C 95 40.032 37.948 2.084 2
1 1122 . 1 1 A 95 95 ILE N N 95 126.794 128.566 -1.772 2
1 1123 . 1 1 A 96 96 THR H H 96 8.765 8.840 -0.075 2
1 1124 . 1 1 A 96 96 THR HA H 96 4.584 4.828 -0.244 2
1 1129 . 1 1 A 96 96 THR C C 96 177.023 176.081 0.942 2
1 1130 . 1 1 A 96 96 THR CA C 96 61.372 60.684 0.688 2
1 1131 . 1 1 A 96 96 THR CB C 96 70.794 71.589 -0.795 2
1 1133 . 1 1 A 96 96 THR N N 96 117.225 120.443 -3.218 2
1 1134 . 1 1 A 97 97 LYS H H 97 8.736 8.860 -0.124 2
1 1135 . 1 1 A 97 97 LYS HA H 97 4.101 4.074 0.027 2
1 1144 . 1 1 A 97 97 LYS C C 97 176.490 177.102 -0.612 2
1 1145 . 1 1 A 97 97 LYS CA C 97 58.583 58.815 -0.232 2
1 1146 . 1 1 A 97 97 LYS CB C 97 31.848 32.173 -0.325 2
1 1150 . 1 1 A 97 97 LYS N N 97 120.457 120.566 -0.109 2
1 1151 . 1 1 A 98 98 ASP H H 98 7.762 7.808 -0.046 2
1 1152 . 1 1 A 98 98 ASP HA H 98 4.633 4.769 -0.136 2
1 1155 . 1 1 A 98 98 ASP C C 98 175.270 174.996 0.274 2
1 1156 . 1 1 A 98 98 ASP CA C 98 53.272 53.995 -0.723 2
1 1157 . 1 1 A 98 98 ASP CB C 98 39.909 40.894 -0.985 2
1 1158 . 1 1 A 98 98 ASP N N 98 116.281 118.120 -1.839 2
1 1159 . 1 1 A 99 99 ASP H H 99 8.340 8.342 -0.002 2
1 1160 . 1 1 A 99 99 ASP HA H 99 4.245 4.494 -0.248 2
1 1163 . 1 1 A 99 99 ASP C C 99 175.315 175.488 -0.173 2
1 1164 . 1 1 A 99 99 ASP CA C 99 55.989 55.326 0.663 2
1 1165 . 1 1 A 99 99 ASP CB C 99 39.827 39.405 0.422 2
1 1166 . 1 1 A 99 99 ASP N N 99 116.687 117.377 -0.690 2
1 1167 . 1 1 A 100 100 THR H H 100 7.511 7.717 -0.206 2
1 1168 . 1 1 A 100 100 THR HA H 100 4.185 3.992 0.193 2
1 1173 . 1 1 A 100 100 THR C C 100 173.376 174.243 -0.867 2
1 1174 . 1 1 A 100 100 THR CA C 100 63.489 64.528 -1.039 2
1 1175 . 1 1 A 100 100 THR CB C 100 67.909 69.213 -1.304 2
1 1177 . 1 1 A 100 100 THR N N 100 116.525 112.730 3.795 2
1 1178 . 1 1 A 101 101 HIS H H 101 8.753 8.451 0.302 2
1 1179 . 1 1 A 101 101 HIS HA H 101 4.898 4.605 0.293 2
1 1184 . 1 1 A 101 101 HIS C C 101 174.345 173.768 0.577 2
1 1185 . 1 1 A 101 101 HIS CA C 101 55.072 55.495 -0.423 2
1 1186 . 1 1 A 101 101 HIS CB C 101 32.835 28.652 4.183 2
1 1189 . 1 1 A 101 101 HIS N N 101 125.953 120.335 5.618 2
1 1190 . 1 1 A 102 102 TYR H H 102 9.023 8.959 0.064 2
1 1191 . 1 1 A 102 102 TYR HA H 102 4.545 4.875 -0.330 2
1 1198 . 1 1 A 102 102 TYR C C 102 174.126 174.923 -0.797 2
1 1199 . 1 1 A 102 102 TYR CA C 102 57.260 56.552 0.708 2
1 1200 . 1 1 A 102 102 TYR CB C 102 40.381 38.658 1.722 2
1 1205 . 1 1 A 102 102 TYR N N 102 121.975 122.533 -0.558 2
1 1206 . 1 1 A 103 103 TYR H H 103 8.899 8.941 -0.042 2
1 1207 . 1 1 A 103 103 TYR HA H 103 4.729 4.846 -0.117 2
1 1214 . 1 1 A 103 103 TYR C C 103 174.139 175.806 -1.667 2
1 1215 . 1 1 A 103 103 TYR CA C 103 58.036 58.133 -0.097 2
1 1216 . 1 1 A 103 103 TYR CB C 103 40.485 39.158 1.327 2
1 1221 . 1 1 A 103 103 TYR N N 103 122.012 124.116 -2.104 2
1 1222 . 1 1 A 104 104 ILE H H 104 8.605 8.653 -0.048 2
1 1223 . 1 1 A 104 104 ILE HA H 104 4.859 4.892 -0.033 2
1 1233 . 1 1 A 104 104 ILE C C 104 172.769 174.144 -1.375 2
1 1234 . 1 1 A 104 104 ILE CA C 104 59.554 59.560 -0.006 2
1 1235 . 1 1 A 104 104 ILE CB C 104 40.631 41.582 -0.951 2
1 1239 . 1 1 A 104 104 ILE N N 104 123.443 123.502 -0.059 2
1 1240 . 1 1 A 105 105 GLN H H 105 9.369 8.549 0.820 2
1 1241 . 1 1 A 105 105 GLN HA H 105 4.895 5.062 -0.167 2
1 1248 . 1 1 A 105 105 GLN C C 105 175.642 174.927 0.715 2
1 1249 . 1 1 A 105 105 GLN CA C 105 54.965 53.927 1.038 2
1 1250 . 1 1 A 105 105 GLN CB C 105 32.856 32.190 0.666 2
1 1252 . 1 1 A 105 105 GLN N N 105 125.079 124.183 0.896 2
1 1254 . 1 1 A 106 106 ALA H H 106 8.513 8.465 0.048 2
1 1255 . 1 1 A 106 106 ALA HA H 106 4.962 4.807 0.155 2
1 1259 . 1 1 A 106 106 ALA C C 106 175.854 177.903 -2.049 2
1 1260 . 1 1 A 106 106 ALA CA C 106 50.272 50.501 -0.229 2
1 1261 . 1 1 A 106 106 ALA CB C 106 21.197 21.714 -0.517 2
1 1262 . 1 1 A 106 106 ALA N N 106 129.303 128.247 1.056 2
1 1263 . 1 1 A 107 107 SER H H 107 9.468 8.918 0.550 2
1 1264 . 1 1 A 107 107 SER HA H 107 4.447 4.385 0.062 2
1 1267 . 1 1 A 107 107 SER C C 107 173.785 174.084 -0.299 2
1 1268 . 1 1 A 107 107 SER CA C 107 60.048 61.431 -1.383 2
1 1269 . 1 1 A 107 107 SER CB C 107 64.643 63.540 1.103 2
1 1270 . 1 1 A 107 107 SER N N 107 112.962 115.914 -2.952 2
1 1271 . 1 1 A 108 108 SER H H 108 7.555 7.930 -0.375 2
1 1272 . 1 1 A 108 108 SER HA H 108 4.665 4.884 -0.219 2
1 1275 . 1 1 A 108 108 SER C C 108 174.381 174.440 -0.059 2
1 1276 . 1 1 A 108 108 SER CA C 108 56.907 56.713 0.194 2
1 1277 . 1 1 A 108 108 SER CB C 108 66.370 66.185 0.185 2
1 1278 . 1 1 A 108 108 SER N N 108 112.243 113.483 -1.240 2
1 1279 . 1 1 A 109 109 LYS H H 109 8.978 8.915 0.063 2
1 1280 . 1 1 A 109 109 LYS HA H 109 4.777 3.965 0.812 2
1 1287 . 1 1 A 109 109 LYS C C 109 179.992 178.230 1.762 2
1 1288 . 1 1 A 109 109 LYS CA C 109 59.766 60.011 -0.245 2
1 1289 . 1 1 A 109 109 LYS CB C 109 32.342 32.143 0.199 2
1 1293 . 1 1 A 109 109 LYS N N 109 123.170 124.921 -1.751 2
1 1294 . 1 1 A 110 110 ALA H H 110 8.608 8.077 0.531 2
1 1295 . 1 1 A 110 110 ALA HA H 110 4.178 4.062 0.116 2
1 1299 . 1 1 A 110 110 ALA C C 110 179.895 179.233 0.662 2
1 1300 . 1 1 A 110 110 ALA CA C 110 54.871 55.402 -0.531 2
1 1301 . 1 1 A 110 110 ALA CB C 110 18.065 18.488 -0.423 2
1 1302 . 1 1 A 110 110 ALA N N 110 123.750 121.569 2.181 2
1 1303 . 1 1 A 111 111 GLU H H 111 8.185 8.313 -0.128 2
1 1304 . 1 1 A 111 111 GLU HA H 111 4.180 4.040 0.140 2
1 1309 . 1 1 A 111 111 GLU C C 111 178.587 178.959 -0.372 2
1 1310 . 1 1 A 111 111 GLU CA C 111 59.466 59.796 -0.330 2
1 1311 . 1 1 A 111 111 GLU CB C 111 31.067 29.439 1.628 2
1 1313 . 1 1 A 111 111 GLU N N 111 119.757 118.662 1.095 2
1 1314 . 1 1 A 112 112 ARG H H 112 8.008 7.924 0.084 2
1 1315 . 1 1 A 112 112 ARG HA H 112 3.642 4.122 -0.480 2
1 1322 . 1 1 A 112 112 ARG C C 112 176.481 178.277 -1.796 2
1 1323 . 1 1 A 112 112 ARG CA C 112 60.419 59.562 0.857 2
1 1324 . 1 1 A 112 112 ARG CB C 112 29.957 30.123 -0.166 2
1 1327 . 1 1 A 112 112 ARG N N 112 118.430 119.789 -1.359 2
1 1328 . 1 1 A 113 113 ALA H H 113 7.985 7.773 0.212 2
1 1329 . 1 1 A 113 113 ALA HA H 113 3.925 4.058 -0.133 2
1 1333 . 1 1 A 113 113 ALA C C 113 180.117 179.961 0.156 2
1 1334 . 1 1 A 113 113 ALA CA C 113 55.372 55.168 0.204 2
1 1335 . 1 1 A 113 113 ALA CB C 113 17.825 18.489 -0.664 2
1 1336 . 1 1 A 113 113 ALA N N 113 119.980 120.785 -0.805 2
1 1337 . 1 1 A 114 114 GLU H H 114 8.093 8.314 -0.221 2
1 1338 . 1 1 A 114 114 GLU HA H 114 3.936 3.931 0.005 2
1 1343 . 1 1 A 114 114 GLU C C 114 180.586 179.251 1.335 2
1 1344 . 1 1 A 114 114 GLU CA C 114 59.148 59.260 -0.112 2
1 1345 . 1 1 A 114 114 GLU CB C 114 30.080 29.311 0.769 2
1 1347 . 1 1 A 114 114 GLU N N 114 117.168 117.696 -0.528 2
1 1348 . 1 1 A 115 115 TRP H H 115 7.980 8.735 -0.755 2
1 1349 . 1 1 A 115 115 TRP HA H 115 3.775 4.365 -0.590 2
1 1358 . 1 1 A 115 115 TRP C C 115 177.714 178.635 -0.921 2
1 1359 . 1 1 A 115 115 TRP CA C 115 62.696 59.669 3.027 2
1 1360 . 1 1 A 115 115 TRP CB C 115 29.052 29.087 -0.035 2
1 1366 . 1 1 A 115 115 TRP N N 115 120.974 120.749 0.225 2
1 1368 . 1 1 A 116 116 ILE H H 116 8.297 8.779 -0.482 2
1 1369 . 1 1 A 116 116 ILE HA H 116 3.270 3.496 -0.226 2
1 1379 . 1 1 A 116 116 ILE C C 116 177.568 177.778 -0.210 2
1 1380 . 1 1 A 116 116 ILE CA C 116 66.643 64.605 2.038 2
1 1381 . 1 1 A 116 116 ILE CB C 116 37.606 37.467 0.139 2
1 1385 . 1 1 A 116 116 ILE N N 116 118.408 120.254 -1.845 2
1 1386 . 1 1 A 117 117 GLU H H 117 8.026 8.872 -0.846 2
1 1387 . 1 1 A 117 117 GLU HA H 117 3.880 3.972 -0.092 2
1 1392 . 1 1 A 117 117 GLU C C 117 178.476 178.955 -0.479 2
1 1393 . 1 1 A 117 117 GLU CA C 117 59.219 59.728 -0.509 2
1 1394 . 1 1 A 117 117 GLU CB C 117 29.381 29.430 -0.049 2
1 1396 . 1 1 A 117 117 GLU N N 117 117.096 120.352 -3.256 2
1 1397 . 1 1 A 118 118 ALA H H 118 7.555 8.138 -0.583 2
1 1398 . 1 1 A 118 118 ALA HA H 118 3.952 4.042 -0.090 2
1 1402 . 1 1 A 118 118 ALA C C 118 179.862 179.960 -0.098 2
1 1403 . 1 1 A 118 118 ALA CA C 118 54.772 55.071 -0.299 2
1 1404 . 1 1 A 118 118 ALA CB C 118 18.277 18.466 -0.189 2
1 1405 . 1 1 A 118 118 ALA N N 118 119.817 121.730 -1.913 2
1 1406 . 1 1 A 119 119 ILE H H 119 8.167 8.109 0.058 2
1 1407 . 1 1 A 119 119 ILE HA H 119 3.558 3.731 -0.172 2
1 1417 . 1 1 A 119 119 ILE C C 119 178.564 178.000 0.564 2
1 1418 . 1 1 A 119 119 ILE CA C 119 65.766 65.292 0.474 2
1 1419 . 1 1 A 119 119 ILE CB C 119 38.840 37.965 0.875 2
1 1423 . 1 1 A 119 119 ILE N N 119 116.280 117.940 -1.660 2
1 1424 . 1 1 A 120 120 LYS H H 120 8.790 8.157 0.633 2
1 1425 . 1 1 A 120 120 LYS HA H 120 3.965 4.227 -0.262 2
1 1434 . 1 1 A 120 120 LYS C C 120 179.673 179.295 0.378 2
1 1435 . 1 1 A 120 120 LYS CA C 120 60.031 60.287 -0.256 2
1 1436 . 1 1 A 120 120 LYS CB C 120 32.547 32.262 0.285 2
1 1440 . 1 1 A 120 120 LYS N N 120 119.650 118.889 0.761 2
1 1441 . 1 1 A 121 121 LYS H H 121 7.594 8.257 -0.663 2
1 1442 . 1 1 A 121 121 LYS HA H 121 4.095 3.991 0.104 2
1 1451 . 1 1 A 121 121 LYS C C 121 177.962 179.127 -1.165 2
1 1452 . 1 1 A 121 121 LYS CA C 121 58.848 59.303 -0.455 2
1 1453 . 1 1 A 121 121 LYS CB C 121 32.547 32.278 0.269 2
1 1457 . 1 1 A 121 121 LYS N N 121 117.197 119.743 -2.546 2
1 1458 . 1 1 A 122 122 LEU H H 122 7.586 7.841 -0.255 2
1 1459 . 1 1 A 122 122 LEU HA H 122 4.535 3.960 0.575 2
1 1469 . 1 1 A 122 122 LEU C C 122 177.902 178.094 -0.192 2
1 1470 . 1 1 A 122 122 LEU CA C 122 55.071 57.985 -2.914 2
1 1471 . 1 1 A 122 122 LEU CB C 122 42.888 41.878 1.010 2
1 1475 . 1 1 A 122 122 LEU N N 122 116.861 120.106 -3.245 2
1 1476 . 1 1 A 123 123 THR H H 123 7.636 7.937 -0.301 2
1 1477 . 1 1 A 123 123 THR HA H 123 4.445 4.277 0.168 2
1 1482 . 1 1 A 123 123 THR C C 123 175.714 174.571 1.143 2
1 1483 . 1 1 A 123 123 THR CA C 123 62.643 62.316 0.327 2
1 1484 . 1 1 A 123 123 THR CB C 123 70.259 69.164 1.095 2
1 1486 . 1 1 A 123 123 THR N N 123 108.963 110.208 -1.245 2
1 1487 . 1 1 A 124 124 SER H H 124 7.912 8.520 -0.608 2
1 1488 . 1 1 A 124 124 SER HA H 124 4.626 4.473 0.153 2
1 1491 . 1 1 A 124 124 SER C C 124 174.405 174.266 0.139 2
1 1492 . 1 1 A 124 124 SER CA C 124 58.390 59.175 -0.785 2
1 1493 . 1 1 A 124 124 SER CB C 124 64.255 63.825 0.430 2
1 1494 . 1 1 A 124 124 SER N N 124 116.876 117.100 -0.224 2
1 1495 . 1 1 A 125 125 GLY H H 125 8.307 8.310 -0.003 2
1 1496 . 1 1 A 125 125 GLY HA2 H 125 4.166 4.105 0.061 2
1 1497 . 1 1 A 125 125 GLY HA3 H 125 4.166 4.107 0.059 2
1 1498 . 1 1 A 125 125 GLY C C 125 171.921 173.371 -1.450 2
1 1499 . 1 1 A 125 125 GLY CA C 125 44.748 45.151 -0.403 2
1 1500 . 1 1 A 125 125 GLY N N 125 110.006 111.097 -1.091 2
1 1501 . 1 1 A 126 126 PRO HA H 126 4.510 4.530 -0.020 2
1 1508 . 1 1 A 126 126 PRO C C 126 177.471 176.430 1.041 2
1 1509 . 1 1 A 126 126 PRO CA C 126 63.419 63.341 0.078 2
1 1510 . 1 1 A 126 126 PRO CB C 126 32.106 31.863 0.243 2
1 1513 . 1 1 A 127 127 SER H H 127 8.607 8.412 0.195 2
1 1514 . 1 1 A 127 127 SER C C 127 174.628 173.687 0.941 2
1 1515 . 1 1 A 127 127 SER CA C 127 58.513 58.392 0.121 2
1 1516 . 1 1 A 127 127 SER CB C 127 63.679 63.974 -0.295 2
1 1517 . 1 1 A 127 127 SER N N 127 116.390 115.323 1.067 2
1 1518 . 1 1 A 128 128 SER H H 128 8.272 8.467 -0.195 2
1 1519 . 1 1 A 128 128 SER HA H 128 4.496 4.684 -0.188 2
1 1520 . 1 1 A 128 128 SER C C 128 173.921 174.098 -0.177 2
1 1521 . 1 1 A 128 128 SER CA C 128 58.442 58.425 0.017 2
1 1522 . 1 1 A 128 128 SER CB C 128 64.173 64.531 -0.358 2
1 1523 . 1 1 A 128 128 SER N N 128 117.506 118.052 -0.546 2
stop_
save_