data_10260_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 10260
_Entry.PDB_ID 2DJU
_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 6 6 SER HA H 6 4.492 4.704 -0.212 1
1 4 . 1 1 1 A 6 6 SER CA C 6 55.621 57.045 -1.424 1
1 5 . 1 1 1 A 6 6 SER CB C 6 62.104 62.502 -0.398 1
1 6 . 1 1 1 A 7 7 GLY H H 7 8.244 7.892 0.352 1
1 7 . 1 1 1 A 7 7 GLY HA2 H 7 3.873 4.017 -0.144 1
1 8 . 1 1 1 A 7 7 GLY HA3 H 7 3.737 4.026 -0.289 1
1 9 . 1 1 1 A 7 7 GLY CA C 7 41.743 44.060 -2.317 1
1 10 . 1 1 1 A 7 7 GLY N N 7 109.193 114.239 -5.046 1
1 11 . 1 1 1 A 8 8 PRO HA H 8 4.286 4.596 -0.310 1
1 18 . 1 1 1 A 8 8 PRO C C 8 173.841 175.471 -1.630 1
1 19 . 1 1 1 A 8 8 PRO CA C 8 60.528 62.549 -2.021 1
1 20 . 1 1 1 A 8 8 PRO CB C 8 30.299 33.042 -2.743 1
1 23 . 1 1 1 A 9 9 LYS H H 9 8.877 8.331 0.546 1
1 24 . 1 1 1 A 9 9 LYS HA H 9 4.360 4.827 -0.467 1
1 33 . 1 1 1 A 9 9 LYS C C 9 173.492 174.308 -0.816 1
1 34 . 1 1 1 A 9 9 LYS CA C 9 52.135 53.052 -0.917 1
1 35 . 1 1 1 A 9 9 LYS CB C 9 28.798 33.263 -4.465 1
1 39 . 1 1 1 A 9 9 LYS N N 9 120.404 120.612 -0.208 1
1 40 . 1 1 1 A 10 10 PRO HA H 10 4.284 4.599 -0.315 1
1 47 . 1 1 1 A 10 10 PRO CA C 10 59.326 61.598 -2.272 1
1 48 . 1 1 1 A 10 10 PRO CB C 10 28.825 31.539 -2.714 1
1 51 . 1 1 1 A 11 11 PRO HA H 11 4.468 4.772 -0.304 1
1 58 . 1 1 1 A 11 11 PRO C C 11 171.993 176.382 -4.389 1
1 59 . 1 1 1 A 11 11 PRO CA C 11 60.422 62.694 -2.272 1
1 60 . 1 1 1 A 11 11 PRO CB C 11 30.418 32.588 -2.170 1
1 63 . 1 1 1 A 12 12 ILE H H 12 7.554 8.053 -0.499 1
1 64 . 1 1 1 A 12 12 ILE HA H 12 4.676 4.557 0.119 1
1 74 . 1 1 1 A 12 12 ILE C C 12 171.721 174.903 -3.182 1
1 75 . 1 1 1 A 12 12 ILE CA C 12 56.843 59.058 -2.215 1
1 76 . 1 1 1 A 12 12 ILE CB C 12 40.560 40.541 0.019 1
1 80 . 1 1 1 A 12 12 ILE N N 12 109.695 117.280 -7.585 1
1 81 . 1 1 1 A 13 13 ASP H H 13 8.435 8.801 -0.366 1
1 82 . 1 1 1 A 13 13 ASP HA H 13 4.094 4.178 -0.084 1
1 85 . 1 1 1 A 13 13 ASP C C 13 171.803 174.781 -2.978 1
1 86 . 1 1 1 A 13 13 ASP CA C 13 52.610 55.137 -2.527 1
1 87 . 1 1 1 A 13 13 ASP CB C 13 36.357 39.266 -2.909 1
1 88 . 1 1 1 A 13 13 ASP N N 13 116.219 120.249 -4.030 1
1 89 . 1 1 1 A 14 14 LEU H H 14 7.483 7.971 -0.488 1
1 90 . 1 1 1 A 14 14 LEU HA H 14 4.990 4.962 0.028 1
1 100 . 1 1 1 A 14 14 LEU C C 14 174.702 175.323 -0.621 1
1 101 . 1 1 1 A 14 14 LEU CA C 14 53.811 54.933 -1.122 1
1 102 . 1 1 1 A 14 14 LEU CB C 14 40.148 41.912 -1.764 1
1 106 . 1 1 1 A 14 14 LEU N N 14 118.463 121.499 -3.036 1
1 107 . 1 1 1 A 15 15 VAL H H 15 9.209 8.498 0.711 1
1 108 . 1 1 1 A 15 15 VAL HA H 15 4.250 4.785 -0.535 1
1 116 . 1 1 1 A 15 15 VAL C C 15 172.080 173.575 -1.495 1
1 117 . 1 1 1 A 15 15 VAL CA C 15 58.570 60.468 -1.898 1
1 118 . 1 1 1 A 15 15 VAL CB C 15 34.146 35.961 -1.815 1
1 121 . 1 1 1 A 15 15 VAL N N 15 124.833 127.033 -2.200 1
1 122 . 1 1 1 A 16 16 VAL H H 16 8.390 8.706 -0.316 1
1 123 . 1 1 1 A 16 16 VAL HA H 16 4.343 4.922 -0.579 1
1 131 . 1 1 1 A 16 16 VAL C C 16 174.672 175.931 -1.259 1
1 132 . 1 1 1 A 16 16 VAL CA C 16 59.188 59.788 -0.600 1
1 133 . 1 1 1 A 16 16 VAL CB C 16 29.187 34.144 -4.957 1
1 136 . 1 1 1 A 16 16 VAL N N 16 124.654 125.389 -0.735 1
1 137 . 1 1 1 A 17 17 THR H H 17 8.638 8.400 0.238 1
1 138 . 1 1 1 A 17 17 THR HA H 17 4.195 4.394 -0.199 1
1 143 . 1 1 1 A 17 17 THR C C 17 172.661 173.662 -1.001 1
1 144 . 1 1 1 A 17 17 THR CA C 17 60.318 64.020 -3.702 1
1 145 . 1 1 1 A 17 17 THR CB C 17 66.420 70.532 -4.112 1
1 147 . 1 1 1 A 17 17 THR N N 17 120.942 121.895 -0.953 1
1 148 . 1 1 1 A 18 18 GLU H H 18 7.361 7.703 -0.342 1
1 149 . 1 1 1 A 18 18 GLU HA H 18 4.497 4.785 -0.288 1
1 154 . 1 1 1 A 18 18 GLU C C 18 171.691 175.260 -3.569 1
1 155 . 1 1 1 A 18 18 GLU CA C 18 53.687 54.842 -1.155 1
1 156 . 1 1 1 A 18 18 GLU CB C 18 30.802 32.947 -2.145 1
1 158 . 1 1 1 A 18 18 GLU N N 18 119.088 118.734 0.354 1
1 159 . 1 1 1 A 19 19 THR H H 19 8.164 8.713 -0.549 1
1 160 . 1 1 1 A 19 19 THR HA H 19 4.912 5.137 -0.225 1
1 165 . 1 1 1 A 19 19 THR C C 19 171.606 172.884 -1.278 1
1 166 . 1 1 1 A 19 19 THR CA C 19 58.473 60.710 -2.237 1
1 167 . 1 1 1 A 19 19 THR CB C 19 70.103 71.222 -1.119 1
1 169 . 1 1 1 A 19 19 THR N N 19 112.424 113.798 -1.374 1
1 170 . 1 1 1 A 20 20 THR H H 20 8.750 8.958 -0.208 1
1 171 . 1 1 1 A 20 20 THR HA H 20 4.710 4.831 -0.121 1
1 176 . 1 1 1 A 20 20 THR C C 20 172.785 176.116 -3.331 1
1 177 . 1 1 1 A 20 20 THR CA C 20 58.059 61.058 -2.999 1
1 178 . 1 1 1 A 20 20 THR CB C 20 68.782 71.225 -2.443 1
1 180 . 1 1 1 A 20 20 THR N N 20 113.438 121.226 -7.788 1
1 181 . 1 1 1 A 21 21 ALA H H 21 8.453 8.977 -0.524 1
1 182 . 1 1 1 A 21 21 ALA HA H 21 4.079 4.330 -0.251 1
1 186 . 1 1 1 A 21 21 ALA C C 21 174.130 177.829 -3.699 1
1 187 . 1 1 1 A 21 21 ALA CA C 21 52.680 54.935 -2.255 1
1 188 . 1 1 1 A 21 21 ALA CB C 21 16.893 18.608 -1.715 1
1 189 . 1 1 1 A 21 21 ALA N N 21 120.078 125.735 -5.657 1
1 190 . 1 1 1 A 22 22 THR H H 22 7.132 7.570 -0.438 1
1 191 . 1 1 1 A 22 22 THR HA H 22 4.433 4.769 -0.336 1
1 196 . 1 1 1 A 22 22 THR C C 22 171.434 173.466 -2.032 1
1 197 . 1 1 1 A 22 22 THR CA C 22 56.836 60.492 -3.656 1
1 198 . 1 1 1 A 22 22 THR CB C 22 68.772 69.375 -0.603 1
1 200 . 1 1 1 A 22 22 THR N N 22 95.772 104.141 -8.369 1
1 201 . 1 1 1 A 23 23 SER H H 23 7.326 7.747 -0.421 1
1 202 . 1 1 1 A 23 23 SER HA H 23 5.562 5.229 0.333 1
1 205 . 1 1 1 A 23 23 SER C C 23 169.267 172.374 -3.107 1
1 206 . 1 1 1 A 23 23 SER CA C 23 54.445 57.923 -3.478 1
1 207 . 1 1 1 A 23 23 SER CB C 23 65.905 66.651 -0.746 1
1 208 . 1 1 1 A 23 23 SER N N 23 115.757 115.757 0.000 1
1 209 . 1 1 1 A 24 24 VAL H H 24 7.983 8.504 -0.521 1
1 210 . 1 1 1 A 24 24 VAL HA H 24 4.334 4.770 -0.436 1
1 218 . 1 1 1 A 24 24 VAL C C 24 171.917 174.657 -2.740 1
1 219 . 1 1 1 A 24 24 VAL CA C 24 58.642 60.639 -1.997 1
1 220 . 1 1 1 A 24 24 VAL CB C 24 34.254 35.995 -1.741 1
1 223 . 1 1 1 A 24 24 VAL N N 24 116.595 121.405 -4.810 1
1 224 . 1 1 1 A 25 25 THR H H 25 8.636 9.051 -0.415 1
1 225 . 1 1 1 A 25 25 THR HA H 25 4.833 4.845 -0.012 1
1 230 . 1 1 1 A 25 25 THR C C 25 169.721 173.057 -3.336 1
1 231 . 1 1 1 A 25 25 THR CA C 25 59.699 62.167 -2.468 1
1 232 . 1 1 1 A 25 25 THR CB C 25 67.303 69.439 -2.136 1
1 234 . 1 1 1 A 25 25 THR N N 25 121.690 122.569 -0.879 1
1 235 . 1 1 1 A 26 26 LEU H H 26 8.629 8.911 -0.282 1
1 236 . 1 1 1 A 26 26 LEU HA H 26 5.315 5.204 0.111 1
1 246 . 1 1 1 A 26 26 LEU C C 26 173.182 175.445 -2.263 1
1 247 . 1 1 1 A 26 26 LEU CA C 26 50.643 53.219 -2.576 1
1 248 . 1 1 1 A 26 26 LEU CB C 26 43.976 45.277 -1.301 1
1 252 . 1 1 1 A 26 26 LEU N N 26 126.843 129.754 -2.911 1
1 253 . 1 1 1 A 27 27 THR H H 27 8.704 9.143 -0.439 1
1 254 . 1 1 1 A 27 27 THR HA H 27 4.822 5.250 -0.428 1
1 259 . 1 1 1 A 27 27 THR C C 27 169.840 173.078 -3.238 1
1 260 . 1 1 1 A 27 27 THR CA C 27 58.077 59.244 -1.167 1
1 261 . 1 1 1 A 27 27 THR CB C 27 69.666 72.455 -2.789 1
1 263 . 1 1 1 A 27 27 THR N N 27 111.513 115.564 -4.051 1
1 264 . 1 1 1 A 28 28 TRP H H 28 7.339 8.408 -1.069 1
1 265 . 1 1 1 A 28 28 TRP HA H 28 4.963 5.475 -0.512 1
1 274 . 1 1 1 A 28 28 TRP C C 28 170.637 172.428 -1.791 1
1 275 . 1 1 1 A 28 28 TRP CA C 28 54.438 55.812 -1.374 1
1 276 . 1 1 1 A 28 28 TRP CB C 28 27.497 31.007 -3.510 1
1 282 . 1 1 1 A 28 28 TRP N N 28 117.895 118.537 -0.642 1
1 284 . 1 1 1 A 29 29 ASP H H 29 8.696 9.397 -0.701 1
1 285 . 1 1 1 A 29 29 ASP HA H 29 4.971 5.090 -0.119 1
1 288 . 1 1 1 A 29 29 ASP C C 29 174.901 177.648 -2.747 1
1 289 . 1 1 1 A 29 29 ASP CA C 29 50.178 52.519 -2.341 1
1 290 . 1 1 1 A 29 29 ASP CB C 29 42.291 43.070 -0.779 1
1 291 . 1 1 1 A 29 29 ASP N N 29 117.477 121.914 -4.437 1
1 292 . 1 1 1 A 30 30 SER H H 30 8.800 8.824 -0.024 1
1 293 . 1 1 1 A 30 30 SER HA H 30 4.389 4.249 0.140 1
1 296 . 1 1 1 A 30 30 SER C C 30 174.032 175.788 -1.756 1
1 297 . 1 1 1 A 30 30 SER CA C 30 58.694 60.571 -1.877 1
1 298 . 1 1 1 A 30 30 SER CB C 30 62.428 63.514 -1.086 1
1 299 . 1 1 1 A 30 30 SER N N 30 118.275 120.335 -2.060 1
1 300 . 1 1 1 A 31 31 GLY H H 31 8.759 7.915 0.844 1
1 301 . 1 1 1 A 31 31 GLY HA2 H 31 4.239 4.023 0.216 1
1 302 . 1 1 1 A 31 31 GLY HA3 H 31 3.555 4.051 -0.496 1
1 303 . 1 1 1 A 31 31 GLY C C 31 171.325 174.176 -2.851 1
1 304 . 1 1 1 A 31 31 GLY CA C 31 43.637 45.658 -2.021 1
1 305 . 1 1 1 A 31 31 GLY N N 31 107.961 111.098 -3.137 1
1 306 . 1 1 1 A 32 32 ASN H H 32 8.173 8.140 0.033 1
1 307 . 1 1 1 A 32 32 ASN HA H 32 4.749 4.918 -0.169 1
1 312 . 1 1 1 A 32 32 ASN C C 32 171.355 175.452 -4.097 1
1 313 . 1 1 1 A 32 32 ASN CA C 32 50.795 52.618 -1.823 1
1 314 . 1 1 1 A 32 32 ASN CB C 32 41.508 39.469 2.039 1
1 315 . 1 1 1 A 32 32 ASN N N 32 117.781 118.373 -0.592 1
1 317 . 1 1 1 A 33 33 SER HA H 33 4.291 4.559 -0.268 1
1 320 . 1 1 1 A 33 33 SER C C 33 172.449 174.849 -2.400 1
1 321 . 1 1 1 A 33 33 SER CA C 33 56.733 60.733 -4.000 1
1 322 . 1 1 1 A 33 33 SER CB C 33 60.884 63.694 -2.810 1
1 323 . 1 1 1 A 34 34 GLU H H 34 7.731 7.578 0.153 1
1 324 . 1 1 1 A 34 34 GLU HA H 34 4.556 4.559 -0.003 1
1 329 . 1 1 1 A 34 34 GLU C C 34 171.792 175.731 -3.939 1
1 330 . 1 1 1 A 34 34 GLU CA C 34 51.818 55.195 -3.377 1
1 331 . 1 1 1 A 34 34 GLU CB C 34 26.891 29.774 -2.883 1
1 333 . 1 1 1 A 34 34 GLU N N 34 122.319 119.611 2.708 1
1 334 . 1 1 1 A 35 35 PRO HA H 35 4.165 4.750 -0.585 1
1 341 . 1 1 1 A 35 35 PRO C C 35 174.288 176.188 -1.900 1
1 342 . 1 1 1 A 35 35 PRO CA C 35 61.374 62.742 -1.368 1
1 343 . 1 1 1 A 35 35 PRO CB C 35 29.887 31.816 -1.929 1
1 346 . 1 1 1 A 36 36 VAL H H 36 8.348 8.639 -0.291 1
1 347 . 1 1 1 A 36 36 VAL HA H 36 3.899 4.426 -0.527 1
1 355 . 1 1 1 A 36 36 VAL C C 36 173.344 176.464 -3.120 1
1 356 . 1 1 1 A 36 36 VAL CA C 36 59.014 61.593 -2.579 1
1 357 . 1 1 1 A 36 36 VAL CB C 36 31.865 33.169 -1.304 1
1 360 . 1 1 1 A 36 36 VAL N N 36 122.051 124.258 -2.207 1
1 361 . 1 1 1 A 37 37 THR H H 37 8.780 8.309 0.471 1
1 362 . 1 1 1 A 37 37 THR HA H 37 3.923 4.247 -0.324 1
1 367 . 1 1 1 A 37 37 THR C C 37 172.171 174.580 -2.409 1
1 368 . 1 1 1 A 37 37 THR CA C 37 63.155 64.698 -1.543 1
1 369 . 1 1 1 A 37 37 THR CB C 37 65.941 69.315 -3.374 1
1 371 . 1 1 1 A 37 37 THR N N 37 122.351 118.865 3.486 1
1 372 . 1 1 1 A 38 38 TYR H H 38 7.304 7.374 -0.070 1
1 373 . 1 1 1 A 38 38 TYR HA H 38 4.439 5.350 -0.911 1
1 380 . 1 1 1 A 38 38 TYR C C 38 168.385 172.909 -4.524 1
1 381 . 1 1 1 A 38 38 TYR CA C 38 54.101 55.832 -1.731 1
1 382 . 1 1 1 A 38 38 TYR CB C 38 35.874 41.564 -5.690 1
1 387 . 1 1 1 A 38 38 TYR N N 38 113.984 115.115 -1.131 1
1 388 . 1 1 1 A 39 39 TYR H H 39 9.445 8.741 0.704 1
1 389 . 1 1 1 A 39 39 TYR HA H 39 5.293 5.260 0.033 1
1 396 . 1 1 1 A 39 39 TYR C C 39 172.781 175.685 -2.904 1
1 397 . 1 1 1 A 39 39 TYR CA C 39 54.322 55.629 -1.307 1
1 398 . 1 1 1 A 39 39 TYR CB C 39 39.035 41.302 -2.267 1
1 401 . 1 1 1 A 39 39 TYR N N 39 115.092 118.125 -3.033 1
1 402 . 1 1 1 A 40 40 GLY H H 40 8.870 8.534 0.336 1
1 403 . 1 1 1 A 40 40 GLY HA2 H 40 5.137 4.127 1.010 1
1 404 . 1 1 1 A 40 40 GLY HA3 H 40 3.285 4.202 -0.917 1
1 405 . 1 1 1 A 40 40 GLY C C 40 169.688 172.684 -2.996 1
1 406 . 1 1 1 A 40 40 GLY CA C 40 41.415 44.603 -3.188 1
1 407 . 1 1 1 A 40 40 GLY N N 40 106.573 112.095 -5.522 1
1 408 . 1 1 1 A 41 41 ILE H H 41 8.917 8.542 0.375 1
1 409 . 1 1 1 A 41 41 ILE HA H 41 4.527 4.848 -0.321 1
1 419 . 1 1 1 A 41 41 ILE C C 41 172.692 175.296 -2.604 1
1 420 . 1 1 1 A 41 41 ILE CA C 41 57.597 59.745 -2.148 1
1 421 . 1 1 1 A 41 41 ILE CB C 41 37.840 41.774 -3.934 1
1 425 . 1 1 1 A 41 41 ILE N N 41 121.746 121.733 0.013 1
1 426 . 1 1 1 A 42 42 GLN H H 42 9.063 8.787 0.276 1
1 427 . 1 1 1 A 42 42 GLN HA H 42 5.655 5.756 -0.101 1
1 434 . 1 1 1 A 42 42 GLN C C 42 172.841 174.728 -1.887 1
1 435 . 1 1 1 A 42 42 GLN CA C 42 50.789 54.421 -3.632 1
1 436 . 1 1 1 A 42 42 GLN CB C 42 28.898 32.804 -3.906 1
1 438 . 1 1 1 A 42 42 GLN N N 42 125.141 125.156 -0.015 1
1 440 . 1 1 1 A 43 43 TYR H H 43 9.066 9.012 0.054 1
1 441 . 1 1 1 A 43 43 TYR HA H 43 5.922 6.052 -0.130 1
1 448 . 1 1 1 A 43 43 TYR C C 43 171.219 173.409 -2.190 1
1 449 . 1 1 1 A 43 43 TYR CA C 43 53.349 56.759 -3.410 1
1 450 . 1 1 1 A 43 43 TYR CB C 43 41.074 41.720 -0.646 1
1 455 . 1 1 1 A 43 43 TYR N N 43 118.018 119.253 -1.235 1
1 456 . 1 1 1 A 44 44 ARG H H 44 8.400 8.760 -0.360 1
1 457 . 1 1 1 A 44 44 ARG HA H 44 4.542 4.579 -0.037 1
1 464 . 1 1 1 A 44 44 ARG C C 44 171.974 174.237 -2.263 1
1 465 . 1 1 1 A 44 44 ARG CA C 44 52.453 55.326 -2.873 1
1 466 . 1 1 1 A 44 44 ARG CB C 44 31.125 33.682 -2.557 1
1 469 . 1 1 1 A 44 44 ARG N N 44 115.214 120.406 -5.192 1
1 470 . 1 1 1 A 45 45 ALA H H 45 8.846 8.284 0.562 1
1 471 . 1 1 1 A 45 45 ALA HA H 45 3.894 2.696 1.198 1
1 475 . 1 1 1 A 45 45 ALA C C 45 175.721 177.339 -1.618 1
1 476 . 1 1 1 A 45 45 ALA CA C 45 50.372 52.388 -2.016 1
1 477 . 1 1 1 A 45 45 ALA CB C 45 15.732 19.125 -3.393 1
1 478 . 1 1 1 A 45 45 ALA N N 45 126.463 126.891 -0.428 1
1 479 . 1 1 1 A 46 46 ALA H H 46 8.282 7.939 0.343 1
1 480 . 1 1 1 A 46 46 ALA HA H 46 3.922 3.872 0.050 1
1 484 . 1 1 1 A 46 46 ALA C C 46 176.236 178.171 -1.935 1
1 485 . 1 1 1 A 46 46 ALA CA C 46 50.773 53.752 -2.979 1
1 486 . 1 1 1 A 46 46 ALA CB C 46 16.244 18.443 -2.199 1
1 487 . 1 1 1 A 46 46 ALA N N 46 126.301 126.168 0.133 1
1 488 . 1 1 1 A 47 47 GLY HA2 H 47 3.882 3.963 -0.081 1
1 489 . 1 1 1 A 47 47 GLY HA3 H 47 3.695 4.000 -0.305 1
1 490 . 1 1 1 A 47 47 GLY C C 47 171.795 174.686 -2.891 1
1 491 . 1 1 1 A 47 47 GLY CA C 47 43.327 45.464 -2.137 1
1 492 . 1 1 1 A 48 48 THR H H 48 7.145 7.653 -0.508 1
1 493 . 1 1 1 A 48 48 THR HA H 48 4.417 4.105 0.312 1
1 498 . 1 1 1 A 48 48 THR C C 48 171.325 175.015 -3.690 1
1 499 . 1 1 1 A 48 48 THR CA C 48 58.271 63.331 -5.060 1
1 500 . 1 1 1 A 48 48 THR CB C 48 68.846 68.990 -0.144 1
1 502 . 1 1 1 A 48 48 THR N N 48 110.190 115.236 -5.046 1
1 503 . 1 1 1 A 49 49 GLU H H 49 8.346 8.996 -0.650 1
1 504 . 1 1 1 A 49 49 GLU HA H 49 4.277 4.657 -0.380 1
1 509 . 1 1 1 A 49 49 GLU C C 49 174.109 176.029 -1.920 1
1 510 . 1 1 1 A 49 49 GLU CA C 49 52.909 56.340 -3.431 1
1 511 . 1 1 1 A 49 49 GLU CB C 49 27.845 30.035 -2.190 1
1 513 . 1 1 1 A 49 49 GLU N N 49 119.985 124.694 -4.709 1
1 514 . 1 1 1 A 50 50 GLY H H 50 7.617 8.119 -0.502 1
1 515 . 1 1 1 A 50 50 GLY HA2 H 50 3.935 4.076 -0.141 1
1 516 . 1 1 1 A 50 50 GLY HA3 H 50 3.935 4.112 -0.177 1
1 517 . 1 1 1 A 50 50 GLY C C 50 168.223 172.435 -4.212 1
1 518 . 1 1 1 A 50 50 GLY CA C 50 42.121 44.020 -1.899 1
1 519 . 1 1 1 A 50 50 GLY N N 50 108.670 108.658 0.012 1
1 520 . 1 1 1 A 51 51 PRO HA H 51 4.298 4.773 -0.475 1
1 527 . 1 1 1 A 51 51 PRO C C 51 175.067 176.345 -1.278 1
1 528 . 1 1 1 A 51 51 PRO CA C 51 60.175 62.952 -2.777 1
1 529 . 1 1 1 A 51 51 PRO CB C 51 30.052 32.668 -2.616 1
1 532 . 1 1 1 A 52 52 PHE H H 52 8.442 8.635 -0.193 1
1 533 . 1 1 1 A 52 52 PHE HA H 52 3.981 4.656 -0.675 1
1 541 . 1 1 1 A 52 52 PHE C C 52 175.141 175.707 -0.566 1
1 542 . 1 1 1 A 52 52 PHE CA C 52 56.808 57.387 -0.579 1
1 543 . 1 1 1 A 52 52 PHE CB C 52 36.830 40.922 -4.092 1
1 549 . 1 1 1 A 52 52 PHE N N 52 118.707 121.212 -2.505 1
1 550 . 1 1 1 A 53 53 GLN H H 53 8.778 8.398 0.380 1
1 551 . 1 1 1 A 53 53 GLN HA H 53 4.149 4.105 0.044 1
1 558 . 1 1 1 A 53 53 GLN C C 53 172.773 175.444 -2.671 1
1 559 . 1 1 1 A 53 53 GLN CA C 53 52.999 56.895 -3.896 1
1 560 . 1 1 1 A 53 53 GLN CB C 53 26.962 29.054 -2.092 1
1 562 . 1 1 1 A 53 53 GLN N N 53 122.164 121.830 0.334 1
1 564 . 1 1 1 A 54 54 GLU H H 54 8.432 8.576 -0.144 1
1 565 . 1 1 1 A 54 54 GLU HA H 54 5.533 5.331 0.202 1
1 570 . 1 1 1 A 54 54 GLU C C 54 173.930 174.807 -0.877 1
1 571 . 1 1 1 A 54 54 GLU CA C 54 52.981 54.995 -2.014 1
1 572 . 1 1 1 A 54 54 GLU CB C 54 31.712 33.075 -1.363 1
1 574 . 1 1 1 A 54 54 GLU N N 54 119.688 121.360 -1.672 1
1 575 . 1 1 1 A 55 55 VAL H H 55 9.077 8.860 0.217 1
1 576 . 1 1 1 A 55 55 VAL HA H 55 4.180 4.887 -0.707 1
1 584 . 1 1 1 A 55 55 VAL C C 55 171.811 174.546 -2.735 1
1 585 . 1 1 1 A 55 55 VAL CA C 55 59.664 61.155 -1.491 1
1 586 . 1 1 1 A 55 55 VAL CB C 55 31.827 34.700 -2.873 1
1 589 . 1 1 1 A 55 55 VAL N N 55 125.328 126.078 -0.750 1
1 590 . 1 1 1 A 56 56 ASP H H 56 8.639 8.832 -0.193 1
1 591 . 1 1 1 A 56 56 ASP HA H 56 5.250 5.677 -0.427 1
1 594 . 1 1 1 A 56 56 ASP C C 56 174.252 176.015 -1.763 1
1 595 . 1 1 1 A 56 56 ASP CA C 56 50.108 52.365 -2.257 1
1 596 . 1 1 1 A 56 56 ASP CB C 56 41.407 44.278 -2.871 1
1 597 . 1 1 1 A 56 56 ASP N N 56 125.773 124.906 0.867 1
1 598 . 1 1 1 A 57 57 GLY H H 57 7.222 8.729 -1.507 1
1 599 . 1 1 1 A 57 57 GLY HA2 H 57 3.479 3.911 -0.432 1
1 600 . 1 1 1 A 57 57 GLY HA3 H 57 2.719 3.973 -1.254 1
1 601 . 1 1 1 A 57 57 GLY C C 57 172.281 174.462 -2.181 1
1 602 . 1 1 1 A 57 57 GLY CA C 57 43.919 45.413 -1.494 1
1 603 . 1 1 1 A 57 57 GLY N N 57 105.564 110.797 -5.233 1
1 604 . 1 1 1 A 58 58 VAL H H 58 8.338 8.086 0.252 1
1 605 . 1 1 1 A 58 58 VAL HA H 58 3.860 4.366 -0.506 1
1 613 . 1 1 1 A 58 58 VAL C C 58 173.981 175.315 -1.334 1
1 614 . 1 1 1 A 58 58 VAL CA C 58 61.233 61.517 -0.284 1
1 615 . 1 1 1 A 58 58 VAL CB C 58 29.708 32.415 -2.707 1
1 618 . 1 1 1 A 58 58 VAL N N 58 121.466 121.087 0.379 1
1 619 . 1 1 1 A 59 59 ALA H H 59 9.038 8.764 0.274 1
1 620 . 1 1 1 A 59 59 ALA HA H 59 4.676 4.515 0.161 1
1 624 . 1 1 1 A 59 59 ALA C C 59 175.105 176.808 -1.703 1
1 625 . 1 1 1 A 59 59 ALA CA C 59 50.866 52.334 -1.468 1
1 626 . 1 1 1 A 59 59 ALA CB C 59 17.647 19.084 -1.437 1
1 627 . 1 1 1 A 59 59 ALA N N 59 130.928 130.094 0.834 1
1 628 . 1 1 1 A 60 60 THR H H 60 7.445 7.697 -0.252 1
1 629 . 1 1 1 A 60 60 THR HA H 60 4.642 4.647 -0.005 1
1 634 . 1 1 1 A 60 60 THR C C 60 169.528 174.435 -4.907 1
1 635 . 1 1 1 A 60 60 THR CA C 60 57.101 59.264 -2.163 1
1 636 . 1 1 1 A 60 60 THR CB C 60 67.982 72.185 -4.203 1
1 638 . 1 1 1 A 60 60 THR N N 60 109.256 109.340 -0.084 1
1 639 . 1 1 1 A 61 61 THR H H 61 7.325 8.270 -0.945 1
1 640 . 1 1 1 A 61 61 THR HA H 61 2.896 3.605 -0.709 1
1 645 . 1 1 1 A 61 61 THR C C 61 169.678 173.018 -3.340 1
1 646 . 1 1 1 A 61 61 THR CA C 61 57.246 62.417 -5.171 1
1 647 . 1 1 1 A 61 61 THR CB C 61 63.794 68.556 -4.762 1
1 649 . 1 1 1 A 61 61 THR N N 61 105.670 111.473 -5.803 1
1 650 . 1 1 1 A 62 62 ARG H H 62 6.490 7.238 -0.748 1
1 651 . 1 1 1 A 62 62 ARG HA H 62 4.698 4.505 0.193 1
1 658 . 1 1 1 A 62 62 ARG C C 62 172.881 174.117 -1.236 1
1 659 . 1 1 1 A 62 62 ARG CA C 62 52.276 54.109 -1.833 1
1 660 . 1 1 1 A 62 62 ARG CB C 62 30.774 32.916 -2.142 1
1 663 . 1 1 1 A 62 62 ARG N N 62 117.485 121.746 -4.261 1
1 664 . 1 1 1 A 63 63 TYR H H 63 8.891 8.668 0.223 1
1 665 . 1 1 1 A 63 63 TYR HA H 63 4.356 5.050 -0.694 1
1 672 . 1 1 1 A 63 63 TYR C C 63 170.393 173.874 -3.481 1
1 673 . 1 1 1 A 63 63 TYR CA C 63 57.284 57.593 -0.309 1
1 674 . 1 1 1 A 63 63 TYR CB C 63 41.467 42.305 -0.838 1
1 679 . 1 1 1 A 63 63 TYR N N 63 124.712 127.156 -2.444 1
1 680 . 1 1 1 A 64 64 SER H H 64 7.244 8.440 -1.196 1
1 681 . 1 1 1 A 64 64 SER HA H 64 5.077 5.665 -0.588 1
1 684 . 1 1 1 A 64 64 SER C C 64 169.712 173.287 -3.575 1
1 685 . 1 1 1 A 64 64 SER CA C 64 54.181 55.823 -1.642 1
1 686 . 1 1 1 A 64 64 SER CB C 64 61.122 65.132 -4.010 1
1 687 . 1 1 1 A 64 64 SER N N 64 120.593 120.970 -0.377 1
1 688 . 1 1 1 A 65 65 ILE H H 65 8.686 8.927 -0.241 1
1 689 . 1 1 1 A 65 65 ILE HA H 65 3.937 4.685 -0.748 1
1 699 . 1 1 1 A 65 65 ILE C C 65 172.217 175.289 -3.072 1
1 700 . 1 1 1 A 65 65 ILE CA C 65 58.288 59.670 -1.382 1
1 701 . 1 1 1 A 65 65 ILE CB C 65 36.110 39.235 -3.125 1
1 705 . 1 1 1 A 65 65 ILE N N 65 127.792 125.623 2.169 1
1 706 . 1 1 1 A 66 66 GLY H H 66 7.883 8.645 -0.762 1
1 707 . 1 1 1 A 66 66 GLY HA2 H 66 4.799 4.267 0.532 1
1 708 . 1 1 1 A 66 66 GLY HA3 H 66 3.468 4.273 -0.805 1
1 709 . 1 1 1 A 66 66 GLY C C 66 171.983 173.977 -1.994 1
1 710 . 1 1 1 A 66 66 GLY CA C 66 40.534 44.797 -4.263 1
1 711 . 1 1 1 A 66 66 GLY N N 66 112.632 113.826 -1.194 1
1 712 . 1 1 1 A 67 67 GLY H H 67 8.483 8.274 0.209 1
1 713 . 1 1 1 A 67 67 GLY HA2 H 67 3.836 3.938 -0.102 1
1 714 . 1 1 1 A 67 67 GLY HA3 H 67 3.682 3.959 -0.277 1
1 715 . 1 1 1 A 67 67 GLY C C 67 172.954 174.375 -1.421 1
1 716 . 1 1 1 A 67 67 GLY CA C 67 43.568 46.322 -2.754 1
1 717 . 1 1 1 A 67 67 GLY N N 67 104.625 109.141 -4.516 1
1 718 . 1 1 1 A 68 68 LEU H H 68 8.236 7.796 0.440 1
1 719 . 1 1 1 A 68 68 LEU HA H 68 4.154 4.702 -0.548 1
1 729 . 1 1 1 A 68 68 LEU C C 68 173.838 175.820 -1.982 1
1 730 . 1 1 1 A 68 68 LEU CA C 68 51.025 53.198 -2.173 1
1 731 . 1 1 1 A 68 68 LEU CB C 68 38.837 43.522 -4.685 1
1 735 . 1 1 1 A 68 68 LEU N N 68 118.919 121.204 -2.285 1
1 736 . 1 1 1 A 69 69 SER H H 69 8.284 8.806 -0.522 1
1 737 . 1 1 1 A 69 69 SER HA H 69 4.765 5.098 -0.333 1
1 740 . 1 1 1 A 69 69 SER C C 69 170.044 172.267 -2.223 1
1 741 . 1 1 1 A 69 69 SER CA C 69 54.639 56.444 -1.805 1
1 742 . 1 1 1 A 69 69 SER CB C 69 61.216 63.680 -2.464 1
1 743 . 1 1 1 A 69 69 SER N N 69 116.361 117.433 -1.072 1
1 744 . 1 1 1 A 70 70 PRO HA H 70 5.141 4.763 0.378 1
1 751 . 1 1 1 A 70 70 PRO C C 70 174.858 177.491 -2.633 1
1 752 . 1 1 1 A 70 70 PRO CA C 70 60.810 63.854 -3.044 1
1 753 . 1 1 1 A 70 70 PRO CB C 70 30.657 32.114 -1.457 1
1 756 . 1 1 1 A 71 71 PHE H H 71 8.139 9.350 -1.211 1
1 757 . 1 1 1 A 71 71 PHE HA H 71 4.202 4.303 -0.101 1
1 765 . 1 1 1 A 71 71 PHE C C 71 172.870 174.352 -1.482 1
1 766 . 1 1 1 A 71 71 PHE CA C 71 55.410 58.926 -3.516 1
1 767 . 1 1 1 A 71 71 PHE CB C 71 36.027 37.656 -1.629 1
1 773 . 1 1 1 A 71 71 PHE N N 71 125.409 123.399 2.010 1
1 774 . 1 1 1 A 72 72 SER H H 72 8.182 7.747 0.435 1
1 775 . 1 1 1 A 72 72 SER HA H 72 4.755 4.985 -0.230 1
1 778 . 1 1 1 A 72 72 SER C C 72 168.850 172.619 -3.769 1
1 779 . 1 1 1 A 72 72 SER CA C 72 55.926 56.554 -0.628 1
1 780 . 1 1 1 A 72 72 SER CB C 72 64.208 66.869 -2.661 1
1 781 . 1 1 1 A 72 72 SER N N 72 113.509 110.285 3.224 1
1 782 . 1 1 1 A 73 73 GLU H H 73 8.422 8.710 -0.288 1
1 783 . 1 1 1 A 73 73 GLU HA H 73 4.966 5.146 -0.180 1
1 788 . 1 1 1 A 73 73 GLU C C 73 173.192 174.481 -1.289 1
1 789 . 1 1 1 A 73 73 GLU CA C 73 52.815 54.770 -1.955 1
1 790 . 1 1 1 A 73 73 GLU CB C 73 29.416 32.769 -3.353 1
1 792 . 1 1 1 A 73 73 GLU N N 73 123.046 122.399 0.647 1
1 793 . 1 1 1 A 74 74 TYR H H 74 9.205 8.587 0.618 1
1 794 . 1 1 1 A 74 74 TYR HA H 74 4.799 4.875 -0.076 1
1 801 . 1 1 1 A 74 74 TYR C C 74 170.775 174.117 -3.342 1
1 802 . 1 1 1 A 74 74 TYR CA C 74 55.291 56.853 -1.562 1
1 803 . 1 1 1 A 74 74 TYR CB C 74 42.943 42.386 0.557 1
1 808 . 1 1 1 A 74 74 TYR N N 74 125.351 124.511 0.840 1
1 809 . 1 1 1 A 75 75 ALA H H 75 8.639 8.252 0.387 1
1 810 . 1 1 1 A 75 75 ALA HA H 75 5.271 5.501 -0.230 1
1 814 . 1 1 1 A 75 75 ALA C C 75 173.698 176.393 -2.695 1
1 815 . 1 1 1 A 75 75 ALA CA C 75 47.904 50.461 -2.557 1
1 816 . 1 1 1 A 75 75 ALA CB C 75 19.634 21.177 -1.543 1
1 817 . 1 1 1 A 75 75 ALA N N 75 121.555 125.098 -3.543 1
1 818 . 1 1 1 A 76 76 PHE H H 76 9.066 9.478 -0.412 1
1 819 . 1 1 1 A 76 76 PHE HA H 76 5.496 5.460 0.036 1
1 827 . 1 1 1 A 76 76 PHE C C 76 172.268 174.671 -2.403 1
1 828 . 1 1 1 A 76 76 PHE CA C 76 54.216 56.190 -1.974 1
1 829 . 1 1 1 A 76 76 PHE CB C 76 41.901 42.915 -1.014 1
1 835 . 1 1 1 A 76 76 PHE N N 76 116.545 119.770 -3.225 1
1 836 . 1 1 1 A 77 77 ARG H H 77 9.216 8.734 0.482 1
1 837 . 1 1 1 A 77 77 ARG HA H 77 4.357 5.137 -0.780 1
1 845 . 1 1 1 A 77 77 ARG C C 77 169.998 174.119 -4.121 1
1 846 . 1 1 1 A 77 77 ARG CA C 77 52.414 54.660 -2.246 1
1 847 . 1 1 1 A 77 77 ARG CB C 77 30.794 33.700 -2.906 1
1 850 . 1 1 1 A 77 77 ARG N N 77 115.738 119.022 -3.284 1
1 852 . 1 1 1 A 78 78 VAL H H 78 8.135 8.797 -0.662 1
1 853 . 1 1 1 A 78 78 VAL HA H 78 4.884 4.723 0.161 1
1 861 . 1 1 1 A 78 78 VAL C C 78 171.098 174.436 -3.338 1
1 862 . 1 1 1 A 78 78 VAL CA C 78 57.566 60.690 -3.124 1
1 863 . 1 1 1 A 78 78 VAL CB C 78 33.146 32.996 0.150 1
1 866 . 1 1 1 A 78 78 VAL N N 78 117.942 124.707 -6.765 1
1 867 . 1 1 1 A 79 79 LEU H H 79 9.167 8.491 0.676 1
1 868 . 1 1 1 A 79 79 LEU HA H 79 4.575 4.851 -0.276 1
1 878 . 1 1 1 A 79 79 LEU C C 79 171.447 175.065 -3.618 1
1 879 . 1 1 1 A 79 79 LEU CA C 79 51.642 53.710 -2.068 1
1 880 . 1 1 1 A 79 79 LEU CB C 79 42.776 45.433 -2.657 1
1 884 . 1 1 1 A 79 79 LEU N N 79 123.913 120.725 3.188 1
1 885 . 1 1 1 A 80 80 ALA H H 80 9.325 8.405 0.920 1
1 886 . 1 1 1 A 80 80 ALA HA H 80 4.654 3.825 0.829 1
1 890 . 1 1 1 A 80 80 ALA C C 80 172.070 176.489 -4.419 1
1 891 . 1 1 1 A 80 80 ALA CA C 80 48.169 50.666 -2.497 1
1 892 . 1 1 1 A 80 80 ALA CB C 80 20.366 19.970 0.396 1
1 893 . 1 1 1 A 80 80 ALA N N 80 124.135 121.768 2.367 1
1 894 . 1 1 1 A 81 81 VAL H H 81 7.953 7.948 0.005 1
1 895 . 1 1 1 A 81 81 VAL HA H 81 4.293 4.531 -0.238 1
1 903 . 1 1 1 A 81 81 VAL C C 81 172.873 174.295 -1.422 1
1 904 . 1 1 1 A 81 81 VAL CA C 81 58.959 60.389 -1.430 1
1 905 . 1 1 1 A 81 81 VAL CB C 81 31.412 35.286 -3.874 1
1 908 . 1 1 1 A 81 81 VAL N N 81 118.503 119.977 -1.474 1
1 909 . 1 1 1 A 82 82 ASN H H 82 8.262 8.536 -0.274 1
1 910 . 1 1 1 A 82 82 ASN HA H 82 4.945 5.280 -0.335 1
1 915 . 1 1 1 A 82 82 ASN C C 82 173.273 175.704 -2.431 1
1 916 . 1 1 1 A 82 82 ASN CA C 82 48.714 51.477 -2.763 1
1 917 . 1 1 1 A 82 82 ASN CB C 82 36.796 40.303 -3.507 1
1 918 . 1 1 1 A 82 82 ASN N N 82 125.425 123.816 1.609 1
1 920 . 1 1 1 A 83 83 SER HA H 83 3.966 4.159 -0.193 1
1 923 . 1 1 1 A 83 83 SER C C 83 172.812 176.833 -4.021 1
1 924 . 1 1 1 A 83 83 SER CA C 83 59.047 61.758 -2.711 1
1 925 . 1 1 1 A 83 83 SER CB C 83 60.406 62.915 -2.509 1
1 926 . 1 1 1 A 84 84 ILE H H 84 7.803 7.937 -0.134 1
1 927 . 1 1 1 A 84 84 ILE HA H 84 3.862 3.872 -0.010 1
1 937 . 1 1 1 A 84 84 ILE C C 84 174.481 176.244 -1.763 1
1 938 . 1 1 1 A 84 84 ILE CA C 84 59.188 64.008 -4.820 1
1 939 . 1 1 1 A 84 84 ILE CB C 84 34.677 38.549 -3.872 1
1 943 . 1 1 1 A 84 84 ILE N N 84 121.222 118.718 2.504 1
1 944 . 1 1 1 A 85 85 GLY H H 85 7.435 7.666 -0.231 1
1 945 . 1 1 1 A 85 85 GLY HA2 H 85 4.149 4.024 0.125 1
1 946 . 1 1 1 A 85 85 GLY HA3 H 85 3.747 4.029 -0.282 1
1 947 . 1 1 1 A 85 85 GLY C C 85 168.589 172.331 -3.742 1
1 948 . 1 1 1 A 85 85 GLY CA C 85 42.931 45.413 -2.482 1
1 949 . 1 1 1 A 85 85 GLY N N 85 106.320 105.271 1.049 1
1 950 . 1 1 1 A 86 86 ARG H H 86 8.190 8.464 -0.274 1
1 951 . 1 1 1 A 86 86 ARG HA H 86 4.452 4.537 -0.085 1
1 958 . 1 1 1 A 86 86 ARG C C 86 175.286 176.267 -0.981 1
1 959 . 1 1 1 A 86 86 ARG CA C 86 53.223 55.435 -2.212 1
1 960 . 1 1 1 A 86 86 ARG CB C 86 29.517 30.411 -0.894 1
1 963 . 1 1 1 A 86 86 ARG N N 86 118.339 116.912 1.427 1
1 964 . 1 1 1 A 87 87 GLY H H 87 8.900 8.516 0.384 1
1 965 . 1 1 1 A 87 87 GLY HA2 H 87 4.211 3.975 0.236 1
1 966 . 1 1 1 A 87 87 GLY HA3 H 87 3.967 3.993 -0.026 1
1 967 . 1 1 1 A 87 87 GLY C C 87 168.101 172.858 -4.757 1
1 968 . 1 1 1 A 87 87 GLY CA C 87 42.281 44.098 -1.817 1
1 969 . 1 1 1 A 87 87 GLY N N 87 113.482 109.058 4.424 1
1 970 . 1 1 1 A 88 88 PRO HA H 88 4.563 4.532 0.031 1
1 977 . 1 1 1 A 88 88 PRO CA C 88 60.994 62.093 -1.099 1
1 978 . 1 1 1 A 88 88 PRO CB C 88 29.873 31.508 -1.635 1
1 981 . 1 1 1 A 89 89 PRO HA H 89 4.490 4.446 0.044 1
1 987 . 1 1 1 A 89 89 PRO C C 89 174.543 176.155 -1.612 1
1 988 . 1 1 1 A 89 89 PRO CA C 89 59.435 62.386 -2.951 1
1 989 . 1 1 1 A 89 89 PRO CB C 89 29.805 31.806 -2.001 1
1 992 . 1 1 1 A 90 90 SER H H 90 8.808 8.187 0.621 1
1 993 . 1 1 1 A 90 90 SER HA H 90 4.202 4.531 -0.329 1
1 996 . 1 1 1 A 90 90 SER C C 90 171.870 173.817 -1.947 1
1 997 . 1 1 1 A 90 90 SER CA C 90 55.868 57.276 -1.408 1
1 998 . 1 1 1 A 90 90 SER CB C 90 64.504 64.405 0.099 1
1 999 . 1 1 1 A 90 90 SER N N 90 113.781 116.824 -3.043 1
1 1000 . 1 1 1 A 91 91 GLU H H 91 8.291 8.492 -0.201 1
1 1001 . 1 1 1 A 91 91 GLU HA H 91 4.131 4.113 0.018 1
1 1006 . 1 1 1 A 91 91 GLU C C 91 174.882 176.787 -1.905 1
1 1007 . 1 1 1 A 91 91 GLU CA C 91 54.984 56.992 -2.008 1
1 1008 . 1 1 1 A 91 91 GLU CB C 91 27.643 29.302 -1.659 1
1 1010 . 1 1 1 A 91 91 GLU N N 91 117.930 122.652 -4.722 1
1 1011 . 1 1 1 A 92 92 ALA H H 92 8.605 8.252 0.353 1
1 1012 . 1 1 1 A 92 92 ALA HA H 92 5.068 4.391 0.677 1
1 1016 . 1 1 1 A 92 92 ALA C C 92 176.227 177.901 -1.674 1
1 1017 . 1 1 1 A 92 92 ALA CA C 92 48.997 52.940 -3.943 1
1 1018 . 1 1 1 A 92 92 ALA CB C 92 17.756 19.087 -1.331 1
1 1019 . 1 1 1 A 92 92 ALA N N 92 126.421 127.543 -1.122 1
1 1020 . 1 1 1 A 93 93 VAL H H 93 9.051 9.049 0.002 1
1 1021 . 1 1 1 A 93 93 VAL HA H 93 4.642 5.049 -0.407 1
1 1029 . 1 1 1 A 93 93 VAL C C 93 172.010 174.522 -2.512 1
1 1030 . 1 1 1 A 93 93 VAL CA C 93 57.495 59.446 -1.951 1
1 1031 . 1 1 1 A 93 93 VAL CB C 93 32.774 34.749 -1.975 1
1 1034 . 1 1 1 A 93 93 VAL N N 93 117.322 118.053 -0.731 1
1 1035 . 1 1 1 A 94 94 ARG H H 94 8.470 8.821 -0.351 1
1 1036 . 1 1 1 A 94 94 ARG HA H 94 5.692 5.273 0.419 1
1 1043 . 1 1 1 A 94 94 ARG C C 94 173.635 174.708 -1.073 1
1 1044 . 1 1 1 A 94 94 ARG CA C 94 52.038 54.541 -2.503 1
1 1045 . 1 1 1 A 94 94 ARG CB C 94 30.966 32.621 -1.655 1
1 1048 . 1 1 1 A 94 94 ARG N N 94 122.258 121.664 0.594 1
1 1049 . 1 1 1 A 95 95 ALA H H 95 9.051 8.864 0.187 1
1 1050 . 1 1 1 A 95 95 ALA HA H 95 4.642 5.323 -0.681 1
1 1054 . 1 1 1 A 95 95 ALA C C 95 172.285 175.275 -2.990 1
1 1055 . 1 1 1 A 95 95 ALA CA C 95 49.191 50.514 -1.323 1
1 1056 . 1 1 1 A 95 95 ALA CB C 95 22.562 22.212 0.350 1
1 1057 . 1 1 1 A 95 95 ALA N N 95 121.931 126.700 -4.769 1
1 1058 . 1 1 1 A 96 96 ARG H H 96 8.550 8.633 -0.083 1
1 1059 . 1 1 1 A 96 96 ARG HA H 96 5.407 5.115 0.292 1
1 1066 . 1 1 1 A 96 96 ARG C C 96 174.547 176.106 -1.559 1
1 1067 . 1 1 1 A 96 96 ARG CA C 96 51.439 55.244 -3.805 1
1 1068 . 1 1 1 A 96 96 ARG CB C 96 30.708 31.604 -0.896 1
1 1071 . 1 1 1 A 96 96 ARG N N 96 121.155 124.526 -3.371 1
1 1072 . 1 1 1 A 97 97 THR H H 97 8.797 9.126 -0.329 1
1 1073 . 1 1 1 A 97 97 THR HA H 97 4.116 4.516 -0.400 1
1 1078 . 1 1 1 A 97 97 THR C C 97 173.577 175.011 -1.434 1
1 1079 . 1 1 1 A 97 97 THR CA C 97 58.800 61.616 -2.816 1
1 1080 . 1 1 1 A 97 97 THR CB C 97 67.461 69.811 -2.350 1
1 1082 . 1 1 1 A 97 97 THR N N 97 114.657 117.335 -2.678 1
1 1083 . 1 1 1 A 98 98 GLY H H 98 7.505 8.416 -0.911 1
1 1084 . 1 1 1 A 98 98 GLY HA2 H 98 3.866 4.153 -0.287 1
1 1085 . 1 1 1 A 98 98 GLY HA3 H 98 3.743 4.211 -0.468 1
1 1086 . 1 1 1 A 98 98 GLY C C 98 170.637 174.949 -4.312 1
1 1087 . 1 1 1 A 98 98 GLY CA C 98 42.332 44.533 -2.201 1
1 1088 . 1 1 1 A 98 98 GLY N N 98 106.172 108.288 -2.116 1
1 1089 . 1 1 1 A 99 99 GLU H H 99 8.145 8.572 -0.427 1
1 1090 . 1 1 1 A 99 99 GLU HA H 99 4.210 4.729 -0.519 1
1 1095 . 1 1 1 A 99 99 GLU C C 99 174.134 177.628 -3.494 1
1 1096 . 1 1 1 A 99 99 GLU CA C 99 53.828 55.461 -1.633 1
1 1097 . 1 1 1 A 99 99 GLU CB C 99 28.774 28.802 -0.028 1
1 1099 . 1 1 1 A 99 99 GLU N N 99 117.634 117.361 0.273 1
1 1100 . 1 1 1 A 100 100 GLN H H 100 8.647 7.922 0.725 1
1 1101 . 1 1 1 A 100 100 GLN HA H 100 4.247 3.956 0.291 1
1 1108 . 1 1 1 A 100 100 GLN C C 100 173.348 177.535 -4.187 1
1 1109 . 1 1 1 A 100 100 GLN CA C 100 53.634 58.540 -4.906 1
1 1110 . 1 1 1 A 100 100 GLN CB C 100 27.392 28.997 -1.605 1
1 1112 . 1 1 1 A 100 100 GLN N N 100 121.960 121.008 0.952 1
1 1114 . 1 1 1 A 101 101 SER H H 101 8.416 7.852 0.564 1
1 1115 . 1 1 1 A 101 101 SER HA H 101 4.418 4.223 0.195 1
1 1117 . 1 1 1 A 101 101 SER C C 101 172.148 174.768 -2.620 1
1 1118 . 1 1 1 A 101 101 SER CA C 101 55.926 61.041 -5.115 1
1 1119 . 1 1 1 A 101 101 SER CB C 101 61.617 63.141 -1.524 1
1 1120 . 1 1 1 A 101 101 SER N N 101 118.609 114.320 4.289 1
1 1121 . 1 1 1 A 102 102 GLY H H 102 8.233 8.096 0.137 1
1 1122 . 1 1 1 A 102 102 GLY HA2 H 102 4.080 3.891 0.189 1
1 1123 . 1 1 1 A 102 102 GLY HA3 H 102 3.981 3.895 0.086 1
1 1124 . 1 1 1 A 102 102 GLY C C 102 169.461 175.492 -6.031 1
1 1125 . 1 1 1 A 102 102 GLY CA C 102 42.332 46.928 -4.596 1
1 1126 . 1 1 1 A 102 102 GLY N N 102 110.483 108.313 2.170 1
1 1127 . 1 1 1 A 103 103 PRO HA H 103 4.618 4.436 0.182 1
1 1134 . 1 1 1 A 103 103 PRO CA C 103 57.843 64.839 -6.996 1
1 1135 . 1 1 1 A 103 103 PRO CB C 103 28.671 32.250 -3.579 1
1 1 . 2 1 1 A 6 6 SER HA H 6 4.492 4.654 -0.162 1
1 4 . 2 1 1 A 6 6 SER CA C 6 55.621 58.266 -2.645 1
1 5 . 2 1 1 A 6 6 SER CB C 6 62.104 64.125 -2.021 1
1 6 . 2 1 1 A 7 7 GLY H H 7 8.244 8.595 -0.351 1
1 7 . 2 1 1 A 7 7 GLY HA2 H 7 3.873 4.026 -0.153 1
1 8 . 2 1 1 A 7 7 GLY HA3 H 7 3.737 4.036 -0.299 1
1 9 . 2 1 1 A 7 7 GLY CA C 7 41.743 44.588 -2.845 1
1 10 . 2 1 1 A 7 7 GLY N N 7 109.193 117.326 -8.133 1
1 11 . 2 1 1 A 8 8 PRO HA H 8 4.286 4.542 -0.256 1
1 18 . 2 1 1 A 8 8 PRO C C 8 173.841 175.584 -1.743 1
1 19 . 2 1 1 A 8 8 PRO CA C 8 60.528 62.480 -1.952 1
1 20 . 2 1 1 A 8 8 PRO CB C 8 30.299 32.810 -2.511 1
1 23 . 2 1 1 A 9 9 LYS H H 9 8.877 8.363 0.514 1
1 24 . 2 1 1 A 9 9 LYS HA H 9 4.360 4.813 -0.453 1
1 33 . 2 1 1 A 9 9 LYS C C 9 173.492 174.303 -0.811 1
1 34 . 2 1 1 A 9 9 LYS CA C 9 52.135 53.068 -0.933 1
1 35 . 2 1 1 A 9 9 LYS CB C 9 28.798 33.148 -4.350 1
1 39 . 2 1 1 A 9 9 LYS N N 9 120.404 120.666 -0.262 1
1 40 . 2 1 1 A 10 10 PRO HA H 10 4.284 4.605 -0.321 1
1 47 . 2 1 1 A 10 10 PRO CA C 10 59.326 61.558 -2.232 1
1 48 . 2 1 1 A 10 10 PRO CB C 10 28.825 31.514 -2.689 1
1 51 . 2 1 1 A 11 11 PRO HA H 11 4.468 4.911 -0.443 1
1 58 . 2 1 1 A 11 11 PRO C C 11 171.993 176.376 -4.383 1
1 59 . 2 1 1 A 11 11 PRO CA C 11 60.422 62.769 -2.347 1
1 60 . 2 1 1 A 11 11 PRO CB C 11 30.418 32.659 -2.241 1
1 63 . 2 1 1 A 12 12 ILE H H 12 7.554 8.091 -0.537 1
1 64 . 2 1 1 A 12 12 ILE HA H 12 4.676 4.601 0.075 1
1 74 . 2 1 1 A 12 12 ILE C C 12 171.721 174.856 -3.135 1
1 75 . 2 1 1 A 12 12 ILE CA C 12 56.843 59.041 -2.198 1
1 76 . 2 1 1 A 12 12 ILE CB C 12 40.560 40.568 -0.008 1
1 80 . 2 1 1 A 12 12 ILE N N 12 109.695 117.184 -7.489 1
1 81 . 2 1 1 A 13 13 ASP H H 13 8.435 8.799 -0.364 1
1 82 . 2 1 1 A 13 13 ASP HA H 13 4.094 4.180 -0.086 1
1 85 . 2 1 1 A 13 13 ASP C C 13 171.803 174.772 -2.969 1
1 86 . 2 1 1 A 13 13 ASP CA C 13 52.610 55.023 -2.413 1
1 87 . 2 1 1 A 13 13 ASP CB C 13 36.357 39.287 -2.930 1
1 88 . 2 1 1 A 13 13 ASP N N 13 116.219 120.241 -4.022 1
1 89 . 2 1 1 A 14 14 LEU H H 14 7.483 7.966 -0.483 1
1 90 . 2 1 1 A 14 14 LEU HA H 14 4.990 5.211 -0.221 1
1 100 . 2 1 1 A 14 14 LEU C C 14 174.702 175.402 -0.700 1
1 101 . 2 1 1 A 14 14 LEU CA C 14 53.811 54.880 -1.069 1
1 102 . 2 1 1 A 14 14 LEU CB C 14 40.148 42.304 -2.156 1
1 106 . 2 1 1 A 14 14 LEU N N 14 118.463 121.443 -2.980 1
1 107 . 2 1 1 A 15 15 VAL H H 15 9.209 8.794 0.415 1
1 108 . 2 1 1 A 15 15 VAL HA H 15 4.250 4.737 -0.487 1
1 116 . 2 1 1 A 15 15 VAL C C 15 172.080 174.189 -2.109 1
1 117 . 2 1 1 A 15 15 VAL CA C 15 58.570 60.476 -1.906 1
1 118 . 2 1 1 A 15 15 VAL CB C 15 34.146 35.958 -1.812 1
1 121 . 2 1 1 A 15 15 VAL N N 15 124.833 126.875 -2.042 1
1 122 . 2 1 1 A 16 16 VAL H H 16 8.390 9.034 -0.644 1
1 123 . 2 1 1 A 16 16 VAL HA H 16 4.343 4.336 0.007 1
1 131 . 2 1 1 A 16 16 VAL C C 16 174.672 175.961 -1.289 1
1 132 . 2 1 1 A 16 16 VAL CA C 16 59.188 62.548 -3.360 1
1 133 . 2 1 1 A 16 16 VAL CB C 16 29.187 32.002 -2.815 1
1 136 . 2 1 1 A 16 16 VAL N N 16 124.654 125.927 -1.273 1
1 137 . 2 1 1 A 17 17 THR H H 17 8.638 8.835 -0.197 1
1 138 . 2 1 1 A 17 17 THR HA H 17 4.195 4.421 -0.226 1
1 143 . 2 1 1 A 17 17 THR C C 17 172.661 173.786 -1.125 1
1 144 . 2 1 1 A 17 17 THR CA C 17 60.318 63.322 -3.004 1
1 145 . 2 1 1 A 17 17 THR CB C 17 66.420 70.379 -3.959 1
1 147 . 2 1 1 A 17 17 THR N N 17 120.942 122.438 -1.496 1
1 148 . 2 1 1 A 18 18 GLU H H 18 7.361 7.627 -0.266 1
1 149 . 2 1 1 A 18 18 GLU HA H 18 4.497 4.736 -0.239 1
1 154 . 2 1 1 A 18 18 GLU C C 18 171.691 174.987 -3.296 1
1 155 . 2 1 1 A 18 18 GLU CA C 18 53.687 55.230 -1.543 1
1 156 . 2 1 1 A 18 18 GLU CB C 18 30.802 33.977 -3.175 1
1 158 . 2 1 1 A 18 18 GLU N N 18 119.088 118.643 0.445 1
1 159 . 2 1 1 A 19 19 THR H H 19 8.164 8.578 -0.414 1
1 160 . 2 1 1 A 19 19 THR HA H 19 4.912 5.095 -0.183 1
1 165 . 2 1 1 A 19 19 THR C C 19 171.606 172.928 -1.322 1
1 166 . 2 1 1 A 19 19 THR CA C 19 58.473 60.609 -2.136 1
1 167 . 2 1 1 A 19 19 THR CB C 19 70.103 71.312 -1.209 1
1 169 . 2 1 1 A 19 19 THR N N 19 112.424 114.142 -1.718 1
1 170 . 2 1 1 A 20 20 THR H H 20 8.750 8.987 -0.237 1
1 171 . 2 1 1 A 20 20 THR HA H 20 4.710 4.814 -0.104 1
1 176 . 2 1 1 A 20 20 THR C C 20 172.785 175.670 -2.885 1
1 177 . 2 1 1 A 20 20 THR CA C 20 58.059 60.758 -2.699 1
1 178 . 2 1 1 A 20 20 THR CB C 20 68.782 71.087 -2.305 1
1 180 . 2 1 1 A 20 20 THR N N 20 113.438 120.427 -6.989 1
1 181 . 2 1 1 A 21 21 ALA H H 21 8.453 8.877 -0.424 1
1 182 . 2 1 1 A 21 21 ALA HA H 21 4.079 4.369 -0.290 1
1 186 . 2 1 1 A 21 21 ALA C C 21 174.130 177.893 -3.763 1
1 187 . 2 1 1 A 21 21 ALA CA C 21 52.680 55.111 -2.431 1
1 188 . 2 1 1 A 21 21 ALA CB C 21 16.893 18.456 -1.563 1
1 189 . 2 1 1 A 21 21 ALA N N 21 120.078 124.457 -4.379 1
1 190 . 2 1 1 A 22 22 THR H H 22 7.132 7.539 -0.407 1
1 191 . 2 1 1 A 22 22 THR HA H 22 4.433 4.760 -0.327 1
1 196 . 2 1 1 A 22 22 THR C C 22 171.434 173.461 -2.027 1
1 197 . 2 1 1 A 22 22 THR CA C 22 56.836 60.426 -3.590 1
1 198 . 2 1 1 A 22 22 THR CB C 22 68.772 69.310 -0.538 1
1 200 . 2 1 1 A 22 22 THR N N 22 95.772 104.139 -8.367 1
1 201 . 2 1 1 A 23 23 SER H H 23 7.326 7.756 -0.430 1
1 202 . 2 1 1 A 23 23 SER HA H 23 5.562 5.391 0.171 1
1 205 . 2 1 1 A 23 23 SER C C 23 169.267 172.479 -3.212 1
1 206 . 2 1 1 A 23 23 SER CA C 23 54.445 57.640 -3.195 1
1 207 . 2 1 1 A 23 23 SER CB C 23 65.905 67.293 -1.388 1
1 208 . 2 1 1 A 23 23 SER N N 23 115.757 115.964 -0.207 1
1 209 . 2 1 1 A 24 24 VAL H H 24 7.983 8.451 -0.468 1
1 210 . 2 1 1 A 24 24 VAL HA H 24 4.334 4.740 -0.406 1
1 218 . 2 1 1 A 24 24 VAL C C 24 171.917 174.564 -2.647 1
1 219 . 2 1 1 A 24 24 VAL CA C 24 58.642 60.668 -2.026 1
1 220 . 2 1 1 A 24 24 VAL CB C 24 34.254 35.926 -1.672 1
1 223 . 2 1 1 A 24 24 VAL N N 24 116.595 121.341 -4.746 1
1 224 . 2 1 1 A 25 25 THR H H 25 8.636 9.004 -0.368 1
1 225 . 2 1 1 A 25 25 THR HA H 25 4.833 4.963 -0.130 1
1 230 . 2 1 1 A 25 25 THR C C 25 169.721 172.858 -3.137 1
1 231 . 2 1 1 A 25 25 THR CA C 25 59.699 61.243 -1.544 1
1 232 . 2 1 1 A 25 25 THR CB C 25 67.303 70.638 -3.335 1
1 234 . 2 1 1 A 25 25 THR N N 25 121.690 122.234 -0.544 1
1 235 . 2 1 1 A 26 26 LEU H H 26 8.629 8.823 -0.194 1
1 236 . 2 1 1 A 26 26 LEU HA H 26 5.315 5.180 0.135 1
1 246 . 2 1 1 A 26 26 LEU C C 26 173.182 175.099 -1.917 1
1 247 . 2 1 1 A 26 26 LEU CA C 26 50.643 53.639 -2.996 1
1 248 . 2 1 1 A 26 26 LEU CB C 26 43.976 46.180 -2.204 1
1 252 . 2 1 1 A 26 26 LEU N N 26 126.843 127.651 -0.808 1
1 253 . 2 1 1 A 27 27 THR H H 27 8.704 9.040 -0.336 1
1 254 . 2 1 1 A 27 27 THR HA H 27 4.822 5.344 -0.522 1
1 259 . 2 1 1 A 27 27 THR C C 27 169.840 173.660 -3.820 1
1 260 . 2 1 1 A 27 27 THR CA C 27 58.077 59.626 -1.549 1
1 261 . 2 1 1 A 27 27 THR CB C 27 69.666 71.287 -1.621 1
1 263 . 2 1 1 A 27 27 THR N N 27 111.513 116.474 -4.961 1
1 264 . 2 1 1 A 28 28 TRP H H 28 7.339 8.118 -0.779 1
1 265 . 2 1 1 A 28 28 TRP HA H 28 4.963 5.656 -0.693 1
1 274 . 2 1 1 A 28 28 TRP C C 28 170.637 172.469 -1.832 1
1 275 . 2 1 1 A 28 28 TRP CA C 28 54.438 55.422 -0.984 1
1 276 . 2 1 1 A 28 28 TRP CB C 28 27.497 31.424 -3.927 1
1 282 . 2 1 1 A 28 28 TRP N N 28 117.895 119.839 -1.944 1
1 284 . 2 1 1 A 29 29 ASP H H 29 8.696 9.392 -0.696 1
1 285 . 2 1 1 A 29 29 ASP HA H 29 4.971 5.199 -0.228 1
1 288 . 2 1 1 A 29 29 ASP C C 29 174.901 177.721 -2.820 1
1 289 . 2 1 1 A 29 29 ASP CA C 29 50.178 52.441 -2.263 1
1 290 . 2 1 1 A 29 29 ASP CB C 29 42.291 43.520 -1.229 1
1 291 . 2 1 1 A 29 29 ASP N N 29 117.477 121.523 -4.046 1
1 292 . 2 1 1 A 30 30 SER H H 30 8.800 8.893 -0.093 1
1 293 . 2 1 1 A 30 30 SER HA H 30 4.389 4.299 0.090 1
1 296 . 2 1 1 A 30 30 SER C C 30 174.032 175.787 -1.755 1
1 297 . 2 1 1 A 30 30 SER CA C 30 58.694 60.486 -1.792 1
1 298 . 2 1 1 A 30 30 SER CB C 30 62.428 63.810 -1.382 1
1 299 . 2 1 1 A 30 30 SER N N 30 118.275 120.470 -2.195 1
1 300 . 2 1 1 A 31 31 GLY H H 31 8.759 8.455 0.304 1
1 301 . 2 1 1 A 31 31 GLY HA2 H 31 4.239 4.030 0.209 1
1 302 . 2 1 1 A 31 31 GLY HA3 H 31 3.555 4.053 -0.498 1
1 303 . 2 1 1 A 31 31 GLY C C 31 171.325 174.180 -2.855 1
1 304 . 2 1 1 A 31 31 GLY CA C 31 43.637 45.602 -1.965 1
1 305 . 2 1 1 A 31 31 GLY N N 31 107.961 111.354 -3.393 1
1 306 . 2 1 1 A 32 32 ASN H H 32 8.173 8.207 -0.034 1
1 307 . 2 1 1 A 32 32 ASN HA H 32 4.749 4.977 -0.228 1
1 312 . 2 1 1 A 32 32 ASN C C 32 171.355 175.294 -3.939 1
1 313 . 2 1 1 A 32 32 ASN CA C 32 50.795 52.200 -1.405 1
1 314 . 2 1 1 A 32 32 ASN CB C 32 41.508 39.837 1.671 1
1 315 . 2 1 1 A 32 32 ASN N N 32 117.781 118.626 -0.845 1
1 317 . 2 1 1 A 33 33 SER HA H 33 4.291 4.574 -0.283 1
1 320 . 2 1 1 A 33 33 SER C C 33 172.449 175.233 -2.784 1
1 321 . 2 1 1 A 33 33 SER CA C 33 56.733 60.774 -4.041 1
1 322 . 2 1 1 A 33 33 SER CB C 33 60.884 64.072 -3.188 1
1 323 . 2 1 1 A 34 34 GLU H H 34 7.731 7.808 -0.077 1
1 324 . 2 1 1 A 34 34 GLU HA H 34 4.556 4.493 0.063 1
1 329 . 2 1 1 A 34 34 GLU C C 34 171.792 174.820 -3.028 1
1 330 . 2 1 1 A 34 34 GLU CA C 34 51.818 55.075 -3.257 1
1 331 . 2 1 1 A 34 34 GLU CB C 34 26.891 29.081 -2.190 1
1 333 . 2 1 1 A 34 34 GLU N N 34 122.319 120.120 2.199 1
1 334 . 2 1 1 A 35 35 PRO HA H 35 4.165 4.785 -0.620 1
1 341 . 2 1 1 A 35 35 PRO C C 35 174.288 176.972 -2.684 1
1 342 . 2 1 1 A 35 35 PRO CA C 35 61.374 62.611 -1.237 1
1 343 . 2 1 1 A 35 35 PRO CB C 35 29.887 31.414 -1.527 1
1 346 . 2 1 1 A 36 36 VAL H H 36 8.348 8.189 0.159 1
1 347 . 2 1 1 A 36 36 VAL HA H 36 3.899 4.417 -0.518 1
1 355 . 2 1 1 A 36 36 VAL C C 36 173.344 177.121 -3.777 1
1 356 . 2 1 1 A 36 36 VAL CA C 36 59.014 60.945 -1.931 1
1 357 . 2 1 1 A 36 36 VAL CB C 36 31.865 33.471 -1.606 1
1 360 . 2 1 1 A 36 36 VAL N N 36 122.051 118.358 3.693 1
1 361 . 2 1 1 A 37 37 THR H H 37 8.780 8.225 0.555 1
1 362 . 2 1 1 A 37 37 THR HA H 37 3.923 4.169 -0.246 1
1 367 . 2 1 1 A 37 37 THR C C 37 172.171 174.517 -2.346 1
1 368 . 2 1 1 A 37 37 THR CA C 37 63.155 65.017 -1.862 1
1 369 . 2 1 1 A 37 37 THR CB C 37 65.941 69.316 -3.375 1
1 371 . 2 1 1 A 37 37 THR N N 37 122.351 117.752 4.599 1
1 372 . 2 1 1 A 38 38 TYR H H 38 7.304 7.327 -0.023 1
1 373 . 2 1 1 A 38 38 TYR HA H 38 4.439 5.191 -0.752 1
1 380 . 2 1 1 A 38 38 TYR C C 38 168.385 172.830 -4.445 1
1 381 . 2 1 1 A 38 38 TYR CA C 38 54.101 56.269 -2.168 1
1 382 . 2 1 1 A 38 38 TYR CB C 38 35.874 40.462 -4.588 1
1 387 . 2 1 1 A 38 38 TYR N N 38 113.984 114.866 -0.882 1
1 388 . 2 1 1 A 39 39 TYR H H 39 9.445 8.802 0.643 1
1 389 . 2 1 1 A 39 39 TYR HA H 39 5.293 5.135 0.158 1
1 396 . 2 1 1 A 39 39 TYR C C 39 172.781 175.506 -2.725 1
1 397 . 2 1 1 A 39 39 TYR CA C 39 54.322 55.538 -1.216 1
1 398 . 2 1 1 A 39 39 TYR CB C 39 39.035 41.933 -2.898 1
1 401 . 2 1 1 A 39 39 TYR N N 39 115.092 117.636 -2.544 1
1 402 . 2 1 1 A 40 40 GLY H H 40 8.870 8.927 -0.057 1
1 403 . 2 1 1 A 40 40 GLY HA2 H 40 5.137 4.353 0.784 1
1 404 . 2 1 1 A 40 40 GLY HA3 H 40 3.285 4.413 -1.128 1
1 405 . 2 1 1 A 40 40 GLY C C 40 169.688 172.354 -2.666 1
1 406 . 2 1 1 A 40 40 GLY CA C 40 41.415 43.936 -2.521 1
1 407 . 2 1 1 A 40 40 GLY N N 40 106.573 111.552 -4.979 1
1 408 . 2 1 1 A 41 41 ILE H H 41 8.917 8.407 0.510 1
1 409 . 2 1 1 A 41 41 ILE HA H 41 4.527 4.806 -0.279 1
1 419 . 2 1 1 A 41 41 ILE C C 41 172.692 175.093 -2.401 1
1 420 . 2 1 1 A 41 41 ILE CA C 41 57.597 59.533 -1.936 1
1 421 . 2 1 1 A 41 41 ILE CB C 41 37.840 41.791 -3.951 1
1 425 . 2 1 1 A 41 41 ILE N N 41 121.746 121.470 0.276 1
1 426 . 2 1 1 A 42 42 GLN H H 42 9.063 8.564 0.499 1
1 427 . 2 1 1 A 42 42 GLN HA H 42 5.655 5.224 0.431 1
1 434 . 2 1 1 A 42 42 GLN C C 42 172.841 174.342 -1.501 1
1 435 . 2 1 1 A 42 42 GLN CA C 42 50.789 54.486 -3.697 1
1 436 . 2 1 1 A 42 42 GLN CB C 42 28.898 32.583 -3.685 1
1 438 . 2 1 1 A 42 42 GLN N N 42 125.141 125.078 0.063 1
1 440 . 2 1 1 A 43 43 TYR H H 43 9.066 8.840 0.226 1
1 441 . 2 1 1 A 43 43 TYR HA H 43 5.922 5.994 -0.072 1
1 448 . 2 1 1 A 43 43 TYR C C 43 171.219 172.677 -1.458 1
1 449 . 2 1 1 A 43 43 TYR CA C 43 53.349 56.072 -2.723 1
1 450 . 2 1 1 A 43 43 TYR CB C 43 41.074 42.556 -1.482 1
1 455 . 2 1 1 A 43 43 TYR N N 43 118.018 119.690 -1.672 1
1 456 . 2 1 1 A 44 44 ARG H H 44 8.400 8.663 -0.263 1
1 457 . 2 1 1 A 44 44 ARG HA H 44 4.542 4.552 -0.010 1
1 464 . 2 1 1 A 44 44 ARG C C 44 171.974 174.474 -2.500 1
1 465 . 2 1 1 A 44 44 ARG CA C 44 52.453 54.537 -2.084 1
1 466 . 2 1 1 A 44 44 ARG CB C 44 31.125 33.112 -1.987 1
1 469 . 2 1 1 A 44 44 ARG N N 44 115.214 120.295 -5.081 1
1 470 . 2 1 1 A 45 45 ALA H H 45 8.846 8.467 0.379 1
1 471 . 2 1 1 A 45 45 ALA HA H 45 3.894 2.641 1.253 1
1 475 . 2 1 1 A 45 45 ALA C C 45 175.721 176.822 -1.101 1
1 476 . 2 1 1 A 45 45 ALA CA C 45 50.372 52.266 -1.894 1
1 477 . 2 1 1 A 45 45 ALA CB C 45 15.732 18.729 -2.997 1
1 478 . 2 1 1 A 45 45 ALA N N 45 126.463 127.161 -0.698 1
1 479 . 2 1 1 A 46 46 ALA H H 46 8.282 8.161 0.121 1
1 480 . 2 1 1 A 46 46 ALA HA H 46 3.922 3.838 0.084 1
1 484 . 2 1 1 A 46 46 ALA C C 46 176.236 178.147 -1.911 1
1 485 . 2 1 1 A 46 46 ALA CA C 46 50.773 53.706 -2.933 1
1 486 . 2 1 1 A 46 46 ALA CB C 46 16.244 18.332 -2.088 1
1 487 . 2 1 1 A 46 46 ALA N N 46 126.301 126.217 0.084 1
1 488 . 2 1 1 A 47 47 GLY HA2 H 47 3.882 3.941 -0.059 1
1 489 . 2 1 1 A 47 47 GLY HA3 H 47 3.695 3.969 -0.274 1
1 490 . 2 1 1 A 47 47 GLY C C 47 171.795 174.429 -2.634 1
1 491 . 2 1 1 A 47 47 GLY CA C 47 43.327 45.305 -1.978 1
1 492 . 2 1 1 A 48 48 THR H H 48 7.145 7.205 -0.060 1
1 493 . 2 1 1 A 48 48 THR HA H 48 4.417 4.397 0.020 1
1 498 . 2 1 1 A 48 48 THR C C 48 171.325 173.747 -2.422 1
1 499 . 2 1 1 A 48 48 THR CA C 48 58.271 61.592 -3.321 1
1 500 . 2 1 1 A 48 48 THR CB C 48 68.846 69.890 -1.044 1
1 502 . 2 1 1 A 48 48 THR N N 48 110.190 116.112 -5.922 1
1 503 . 2 1 1 A 49 49 GLU H H 49 8.346 8.662 -0.316 1
1 504 . 2 1 1 A 49 49 GLU HA H 49 4.277 4.753 -0.476 1
1 509 . 2 1 1 A 49 49 GLU C C 49 174.109 175.342 -1.233 1
1 510 . 2 1 1 A 49 49 GLU CA C 49 52.909 55.243 -2.334 1
1 511 . 2 1 1 A 49 49 GLU CB C 49 27.845 30.049 -2.204 1
1 513 . 2 1 1 A 49 49 GLU N N 49 119.985 125.689 -5.704 1
1 514 . 2 1 1 A 50 50 GLY H H 50 7.617 8.344 -0.727 1
1 515 . 2 1 1 A 50 50 GLY HA2 H 50 3.935 4.105 -0.170 1
1 516 . 2 1 1 A 50 50 GLY HA3 H 50 3.935 4.136 -0.201 1
1 517 . 2 1 1 A 50 50 GLY C C 50 168.223 172.946 -4.723 1
1 518 . 2 1 1 A 50 50 GLY CA C 50 42.121 43.879 -1.758 1
1 519 . 2 1 1 A 50 50 GLY N N 50 108.670 111.720 -3.050 1
1 520 . 2 1 1 A 51 51 PRO HA H 51 4.298 4.683 -0.385 1
1 527 . 2 1 1 A 51 51 PRO C C 51 175.067 177.094 -2.027 1
1 528 . 2 1 1 A 51 51 PRO CA C 51 60.175 63.068 -2.893 1
1 529 . 2 1 1 A 51 51 PRO CB C 51 30.052 31.854 -1.802 1
1 532 . 2 1 1 A 52 52 PHE H H 52 8.442 8.758 -0.316 1
1 533 . 2 1 1 A 52 52 PHE HA H 52 3.981 4.592 -0.611 1
1 541 . 2 1 1 A 52 52 PHE C C 52 175.141 175.741 -0.600 1
1 542 . 2 1 1 A 52 52 PHE CA C 52 56.808 57.826 -1.018 1
1 543 . 2 1 1 A 52 52 PHE CB C 52 36.830 39.588 -2.758 1
1 549 . 2 1 1 A 52 52 PHE N N 52 118.707 122.529 -3.822 1
1 550 . 2 1 1 A 53 53 GLN H H 53 8.778 8.142 0.636 1
1 551 . 2 1 1 A 53 53 GLN HA H 53 4.149 4.261 -0.112 1
1 558 . 2 1 1 A 53 53 GLN C C 53 172.773 175.444 -2.671 1
1 559 . 2 1 1 A 53 53 GLN CA C 53 52.999 56.383 -3.384 1
1 560 . 2 1 1 A 53 53 GLN CB C 53 26.962 29.181 -2.219 1
1 562 . 2 1 1 A 53 53 GLN N N 53 122.164 121.531 0.633 1
1 564 . 2 1 1 A 54 54 GLU H H 54 8.432 8.601 -0.169 1
1 565 . 2 1 1 A 54 54 GLU HA H 54 5.533 5.088 0.445 1
1 570 . 2 1 1 A 54 54 GLU C C 54 173.930 174.667 -0.737 1
1 571 . 2 1 1 A 54 54 GLU CA C 54 52.981 55.553 -2.572 1
1 572 . 2 1 1 A 54 54 GLU CB C 54 31.712 33.538 -1.826 1
1 574 . 2 1 1 A 54 54 GLU N N 54 119.688 120.997 -1.309 1
1 575 . 2 1 1 A 55 55 VAL H H 55 9.077 8.407 0.670 1
1 576 . 2 1 1 A 55 55 VAL HA H 55 4.180 4.901 -0.721 1
1 584 . 2 1 1 A 55 55 VAL C C 55 171.811 174.666 -2.855 1
1 585 . 2 1 1 A 55 55 VAL CA C 55 59.664 61.013 -1.349 1
1 586 . 2 1 1 A 55 55 VAL CB C 55 31.827 34.891 -3.064 1
1 589 . 2 1 1 A 55 55 VAL N N 55 125.328 125.632 -0.304 1
1 590 . 2 1 1 A 56 56 ASP H H 56 8.639 8.795 -0.156 1
1 591 . 2 1 1 A 56 56 ASP HA H 56 5.250 5.436 -0.186 1
1 594 . 2 1 1 A 56 56 ASP C C 56 174.252 175.992 -1.740 1
1 595 . 2 1 1 A 56 56 ASP CA C 56 50.108 52.295 -2.187 1
1 596 . 2 1 1 A 56 56 ASP CB C 56 41.407 44.039 -2.632 1
1 597 . 2 1 1 A 56 56 ASP N N 56 125.773 124.936 0.837 1
1 598 . 2 1 1 A 57 57 GLY H H 57 7.222 8.533 -1.311 1
1 599 . 2 1 1 A 57 57 GLY HA2 H 57 3.479 3.883 -0.404 1
1 600 . 2 1 1 A 57 57 GLY HA3 H 57 2.719 3.946 -1.227 1
1 601 . 2 1 1 A 57 57 GLY C C 57 172.281 174.490 -2.209 1
1 602 . 2 1 1 A 57 57 GLY CA C 57 43.919 45.801 -1.882 1
1 603 . 2 1 1 A 57 57 GLY N N 57 105.564 110.975 -5.411 1
1 604 . 2 1 1 A 58 58 VAL H H 58 8.338 8.092 0.246 1
1 605 . 2 1 1 A 58 58 VAL HA H 58 3.860 4.361 -0.501 1
1 613 . 2 1 1 A 58 58 VAL C C 58 173.981 175.425 -1.444 1
1 614 . 2 1 1 A 58 58 VAL CA C 58 61.233 61.599 -0.366 1
1 615 . 2 1 1 A 58 58 VAL CB C 58 29.708 31.563 -1.855 1
1 618 . 2 1 1 A 58 58 VAL N N 58 121.466 120.950 0.516 1
1 619 . 2 1 1 A 59 59 ALA H H 59 9.038 8.727 0.311 1
1 620 . 2 1 1 A 59 59 ALA HA H 59 4.676 4.607 0.069 1
1 624 . 2 1 1 A 59 59 ALA C C 59 175.105 176.899 -1.794 1
1 625 . 2 1 1 A 59 59 ALA CA C 59 50.866 52.067 -1.201 1
1 626 . 2 1 1 A 59 59 ALA CB C 59 17.647 19.172 -1.525 1
1 627 . 2 1 1 A 59 59 ALA N N 59 130.928 130.199 0.729 1
1 628 . 2 1 1 A 60 60 THR H H 60 7.445 7.719 -0.274 1
1 629 . 2 1 1 A 60 60 THR HA H 60 4.642 4.637 0.005 1
1 634 . 2 1 1 A 60 60 THR C C 60 169.528 173.973 -4.445 1
1 635 . 2 1 1 A 60 60 THR CA C 60 57.101 59.808 -2.707 1
1 636 . 2 1 1 A 60 60 THR CB C 60 67.982 71.809 -3.827 1
1 638 . 2 1 1 A 60 60 THR N N 60 109.256 109.519 -0.263 1
1 639 . 2 1 1 A 61 61 THR H H 61 7.325 8.263 -0.938 1
1 640 . 2 1 1 A 61 61 THR HA H 61 2.896 3.688 -0.792 1
1 645 . 2 1 1 A 61 61 THR C C 61 169.678 172.769 -3.091 1
1 646 . 2 1 1 A 61 61 THR CA C 61 57.246 61.544 -4.298 1
1 647 . 2 1 1 A 61 61 THR CB C 61 63.794 68.970 -5.176 1
1 649 . 2 1 1 A 61 61 THR N N 61 105.670 110.388 -4.718 1
1 650 . 2 1 1 A 62 62 ARG H H 62 6.490 7.142 -0.652 1
1 651 . 2 1 1 A 62 62 ARG HA H 62 4.698 4.588 0.110 1
1 658 . 2 1 1 A 62 62 ARG C C 62 172.881 173.765 -0.884 1
1 659 . 2 1 1 A 62 62 ARG CA C 62 52.276 53.926 -1.650 1
1 660 . 2 1 1 A 62 62 ARG CB C 62 30.774 33.684 -2.910 1
1 663 . 2 1 1 A 62 62 ARG N N 62 117.485 122.016 -4.531 1
1 664 . 2 1 1 A 63 63 TYR H H 63 8.891 8.632 0.259 1
1 665 . 2 1 1 A 63 63 TYR HA H 63 4.356 5.011 -0.655 1
1 672 . 2 1 1 A 63 63 TYR C C 63 170.393 173.792 -3.399 1
1 673 . 2 1 1 A 63 63 TYR CA C 63 57.284 57.636 -0.352 1
1 674 . 2 1 1 A 63 63 TYR CB C 63 41.467 42.312 -0.845 1
1 679 . 2 1 1 A 63 63 TYR N N 63 124.712 126.985 -2.273 1
1 680 . 2 1 1 A 64 64 SER H H 64 7.244 8.595 -1.351 1
1 681 . 2 1 1 A 64 64 SER HA H 64 5.077 5.743 -0.666 1
1 684 . 2 1 1 A 64 64 SER C C 64 169.712 173.372 -3.660 1
1 685 . 2 1 1 A 64 64 SER CA C 64 54.181 55.702 -1.521 1
1 686 . 2 1 1 A 64 64 SER CB C 64 61.122 65.125 -4.003 1
1 687 . 2 1 1 A 64 64 SER N N 64 120.593 121.542 -0.949 1
1 688 . 2 1 1 A 65 65 ILE H H 65 8.686 9.193 -0.507 1
1 689 . 2 1 1 A 65 65 ILE HA H 65 3.937 4.835 -0.898 1
1 699 . 2 1 1 A 65 65 ILE C C 65 172.217 175.262 -3.045 1
1 700 . 2 1 1 A 65 65 ILE CA C 65 58.288 59.696 -1.408 1
1 701 . 2 1 1 A 65 65 ILE CB C 65 36.110 39.614 -3.504 1
1 705 . 2 1 1 A 65 65 ILE N N 65 127.792 125.846 1.946 1
1 706 . 2 1 1 A 66 66 GLY H H 66 7.883 8.593 -0.710 1
1 707 . 2 1 1 A 66 66 GLY HA2 H 66 4.799 4.208 0.591 1
1 708 . 2 1 1 A 66 66 GLY HA3 H 66 3.468 4.225 -0.757 1
1 709 . 2 1 1 A 66 66 GLY C C 66 171.983 174.166 -2.183 1
1 710 . 2 1 1 A 66 66 GLY CA C 66 40.534 44.374 -3.840 1
1 711 . 2 1 1 A 66 66 GLY N N 66 112.632 114.314 -1.682 1
1 712 . 2 1 1 A 67 67 GLY H H 67 8.483 8.194 0.289 1
1 713 . 2 1 1 A 67 67 GLY HA2 H 67 3.836 3.957 -0.121 1
1 714 . 2 1 1 A 67 67 GLY HA3 H 67 3.682 3.973 -0.291 1
1 715 . 2 1 1 A 67 67 GLY C C 67 172.954 174.361 -1.407 1
1 716 . 2 1 1 A 67 67 GLY CA C 67 43.568 45.930 -2.362 1
1 717 . 2 1 1 A 67 67 GLY N N 67 104.625 110.304 -5.679 1
1 718 . 2 1 1 A 68 68 LEU H H 68 8.236 7.461 0.775 1
1 719 . 2 1 1 A 68 68 LEU HA H 68 4.154 4.719 -0.565 1
1 729 . 2 1 1 A 68 68 LEU C C 68 173.838 175.908 -2.070 1
1 730 . 2 1 1 A 68 68 LEU CA C 68 51.025 53.273 -2.248 1
1 731 . 2 1 1 A 68 68 LEU CB C 68 38.837 43.426 -4.589 1
1 735 . 2 1 1 A 68 68 LEU N N 68 118.919 121.485 -2.566 1
1 736 . 2 1 1 A 69 69 SER H H 69 8.284 8.874 -0.590 1
1 737 . 2 1 1 A 69 69 SER HA H 69 4.765 5.087 -0.322 1
1 740 . 2 1 1 A 69 69 SER C C 69 170.044 172.369 -2.325 1
1 741 . 2 1 1 A 69 69 SER CA C 69 54.639 56.478 -1.839 1
1 742 . 2 1 1 A 69 69 SER CB C 69 61.216 63.792 -2.576 1
1 743 . 2 1 1 A 69 69 SER N N 69 116.361 117.161 -0.800 1
1 744 . 2 1 1 A 70 70 PRO HA H 70 5.141 4.665 0.476 1
1 751 . 2 1 1 A 70 70 PRO C C 70 174.858 177.474 -2.616 1
1 752 . 2 1 1 A 70 70 PRO CA C 70 60.810 64.012 -3.202 1
1 753 . 2 1 1 A 70 70 PRO CB C 70 30.657 31.861 -1.204 1
1 756 . 2 1 1 A 71 71 PHE H H 71 8.139 8.884 -0.745 1
1 757 . 2 1 1 A 71 71 PHE HA H 71 4.202 4.228 -0.026 1
1 765 . 2 1 1 A 71 71 PHE C C 71 172.870 174.341 -1.471 1
1 766 . 2 1 1 A 71 71 PHE CA C 71 55.410 58.992 -3.582 1
1 767 . 2 1 1 A 71 71 PHE CB C 71 36.027 37.556 -1.529 1
1 773 . 2 1 1 A 71 71 PHE N N 71 125.409 123.333 2.076 1
1 774 . 2 1 1 A 72 72 SER H H 72 8.182 7.290 0.892 1
1 775 . 2 1 1 A 72 72 SER HA H 72 4.755 5.036 -0.281 1
1 778 . 2 1 1 A 72 72 SER C C 72 168.850 172.710 -3.860 1
1 779 . 2 1 1 A 72 72 SER CA C 72 55.926 56.515 -0.589 1
1 780 . 2 1 1 A 72 72 SER CB C 72 64.208 66.911 -2.703 1
1 781 . 2 1 1 A 72 72 SER N N 72 113.509 110.343 3.166 1
1 782 . 2 1 1 A 73 73 GLU H H 73 8.422 8.708 -0.286 1
1 783 . 2 1 1 A 73 73 GLU HA H 73 4.966 5.112 -0.146 1
1 788 . 2 1 1 A 73 73 GLU C C 73 173.192 174.678 -1.486 1
1 789 . 2 1 1 A 73 73 GLU CA C 73 52.815 54.758 -1.943 1
1 790 . 2 1 1 A 73 73 GLU CB C 73 29.416 32.980 -3.564 1
1 792 . 2 1 1 A 73 73 GLU N N 73 123.046 121.284 1.762 1
1 793 . 2 1 1 A 74 74 TYR H H 74 9.205 8.664 0.541 1
1 794 . 2 1 1 A 74 74 TYR HA H 74 4.799 5.063 -0.264 1
1 801 . 2 1 1 A 74 74 TYR C C 74 170.775 174.211 -3.436 1
1 802 . 2 1 1 A 74 74 TYR CA C 74 55.291 56.820 -1.529 1
1 803 . 2 1 1 A 74 74 TYR CB C 74 42.943 42.576 0.367 1
1 808 . 2 1 1 A 74 74 TYR N N 74 125.351 124.676 0.675 1
1 809 . 2 1 1 A 75 75 ALA H H 75 8.639 8.194 0.445 1
1 810 . 2 1 1 A 75 75 ALA HA H 75 5.271 5.321 -0.050 1
1 814 . 2 1 1 A 75 75 ALA C C 75 173.698 175.893 -2.195 1
1 815 . 2 1 1 A 75 75 ALA CA C 75 47.904 50.118 -2.214 1
1 816 . 2 1 1 A 75 75 ALA CB C 75 19.634 20.764 -1.130 1
1 817 . 2 1 1 A 75 75 ALA N N 75 121.555 124.759 -3.204 1
1 818 . 2 1 1 A 76 76 PHE H H 76 9.066 9.052 0.014 1
1 819 . 2 1 1 A 76 76 PHE HA H 76 5.496 5.256 0.240 1
1 827 . 2 1 1 A 76 76 PHE C C 76 172.268 175.285 -3.017 1
1 828 . 2 1 1 A 76 76 PHE CA C 76 54.216 56.648 -2.432 1
1 829 . 2 1 1 A 76 76 PHE CB C 76 41.901 41.669 0.232 1
1 835 . 2 1 1 A 76 76 PHE N N 76 116.545 122.373 -5.828 1
1 836 . 2 1 1 A 77 77 ARG H H 77 9.216 8.793 0.423 1
1 837 . 2 1 1 A 77 77 ARG HA H 77 4.357 5.187 -0.830 1
1 845 . 2 1 1 A 77 77 ARG C C 77 169.998 174.141 -4.143 1
1 846 . 2 1 1 A 77 77 ARG CA C 77 52.414 54.632 -2.218 1
1 847 . 2 1 1 A 77 77 ARG CB C 77 30.794 33.553 -2.759 1
1 850 . 2 1 1 A 77 77 ARG N N 77 115.738 119.794 -4.056 1
1 852 . 2 1 1 A 78 78 VAL H H 78 8.135 8.974 -0.839 1
1 853 . 2 1 1 A 78 78 VAL HA H 78 4.884 4.698 0.186 1
1 861 . 2 1 1 A 78 78 VAL C C 78 171.098 174.894 -3.796 1
1 862 . 2 1 1 A 78 78 VAL CA C 78 57.566 60.901 -3.335 1
1 863 . 2 1 1 A 78 78 VAL CB C 78 33.146 33.338 -0.192 1
1 866 . 2 1 1 A 78 78 VAL N N 78 117.942 124.744 -6.802 1
1 867 . 2 1 1 A 79 79 LEU H H 79 9.167 8.387 0.780 1
1 868 . 2 1 1 A 79 79 LEU HA H 79 4.575 4.903 -0.328 1
1 878 . 2 1 1 A 79 79 LEU C C 79 171.447 174.912 -3.465 1
1 879 . 2 1 1 A 79 79 LEU CA C 79 51.642 53.542 -1.900 1
1 880 . 2 1 1 A 79 79 LEU CB C 79 42.776 45.744 -2.968 1
1 884 . 2 1 1 A 79 79 LEU N N 79 123.913 119.616 4.297 1
1 885 . 2 1 1 A 80 80 ALA H H 80 9.325 8.560 0.765 1
1 886 . 2 1 1 A 80 80 ALA HA H 80 4.654 3.613 1.041 1
1 890 . 2 1 1 A 80 80 ALA C C 80 172.070 176.863 -4.793 1
1 891 . 2 1 1 A 80 80 ALA CA C 80 48.169 51.248 -3.079 1
1 892 . 2 1 1 A 80 80 ALA CB C 80 20.366 19.390 0.976 1
1 893 . 2 1 1 A 80 80 ALA N N 80 124.135 123.053 1.082 1
1 894 . 2 1 1 A 81 81 VAL H H 81 7.953 8.168 -0.215 1
1 895 . 2 1 1 A 81 81 VAL HA H 81 4.293 4.603 -0.310 1
1 903 . 2 1 1 A 81 81 VAL C C 81 172.873 174.117 -1.244 1
1 904 . 2 1 1 A 81 81 VAL CA C 81 58.959 60.130 -1.171 1
1 905 . 2 1 1 A 81 81 VAL CB C 81 31.412 34.980 -3.568 1
1 908 . 2 1 1 A 81 81 VAL N N 81 118.503 120.558 -2.055 1
1 909 . 2 1 1 A 82 82 ASN H H 82 8.262 8.511 -0.249 1
1 910 . 2 1 1 A 82 82 ASN HA H 82 4.945 5.217 -0.272 1
1 915 . 2 1 1 A 82 82 ASN C C 82 173.273 175.314 -2.041 1
1 916 . 2 1 1 A 82 82 ASN CA C 82 48.714 51.659 -2.945 1
1 917 . 2 1 1 A 82 82 ASN CB C 82 36.796 40.100 -3.304 1
1 918 . 2 1 1 A 82 82 ASN N N 82 125.425 123.433 1.992 1
1 920 . 2 1 1 A 83 83 SER HA H 83 3.966 4.131 -0.165 1
1 923 . 2 1 1 A 83 83 SER C C 83 172.812 176.921 -4.109 1
1 924 . 2 1 1 A 83 83 SER CA C 83 59.047 62.089 -3.042 1
1 925 . 2 1 1 A 83 83 SER CB C 83 60.406 62.881 -2.475 1
1 926 . 2 1 1 A 84 84 ILE H H 84 7.803 7.797 0.006 1
1 927 . 2 1 1 A 84 84 ILE HA H 84 3.862 3.802 0.060 1
1 937 . 2 1 1 A 84 84 ILE C C 84 174.481 176.101 -1.620 1
1 938 . 2 1 1 A 84 84 ILE CA C 84 59.188 63.760 -4.572 1
1 939 . 2 1 1 A 84 84 ILE CB C 84 34.677 38.263 -3.586 1
1 943 . 2 1 1 A 84 84 ILE N N 84 121.222 118.380 2.842 1
1 944 . 2 1 1 A 85 85 GLY H H 85 7.435 7.585 -0.150 1
1 945 . 2 1 1 A 85 85 GLY HA2 H 85 4.149 4.007 0.142 1
1 946 . 2 1 1 A 85 85 GLY HA3 H 85 3.747 4.009 -0.262 1
1 947 . 2 1 1 A 85 85 GLY C C 85 168.589 172.624 -4.035 1
1 948 . 2 1 1 A 85 85 GLY CA C 85 42.931 45.291 -2.360 1
1 949 . 2 1 1 A 85 85 GLY N N 85 106.320 105.919 0.401 1
1 950 . 2 1 1 A 86 86 ARG H H 86 8.190 8.412 -0.222 1
1 951 . 2 1 1 A 86 86 ARG HA H 86 4.452 4.324 0.128 1
1 958 . 2 1 1 A 86 86 ARG C C 86 175.286 176.167 -0.881 1
1 959 . 2 1 1 A 86 86 ARG CA C 86 53.223 55.801 -2.578 1
1 960 . 2 1 1 A 86 86 ARG CB C 86 29.517 30.342 -0.825 1
1 963 . 2 1 1 A 86 86 ARG N N 86 118.339 117.552 0.787 1
1 964 . 2 1 1 A 87 87 GLY H H 87 8.900 8.565 0.335 1
1 965 . 2 1 1 A 87 87 GLY HA2 H 87 4.211 3.981 0.230 1
1 966 . 2 1 1 A 87 87 GLY HA3 H 87 3.967 3.995 -0.028 1
1 967 . 2 1 1 A 87 87 GLY C C 87 168.101 172.779 -4.678 1
1 968 . 2 1 1 A 87 87 GLY CA C 87 42.281 44.164 -1.883 1
1 969 . 2 1 1 A 87 87 GLY N N 87 113.482 109.075 4.407 1
1 970 . 2 1 1 A 88 88 PRO HA H 88 4.563 4.536 0.027 1
1 977 . 2 1 1 A 88 88 PRO CA C 88 60.994 62.099 -1.105 1
1 978 . 2 1 1 A 88 88 PRO CB C 88 29.873 31.532 -1.659 1
1 981 . 2 1 1 A 89 89 PRO HA H 89 4.490 4.456 0.034 1
1 987 . 2 1 1 A 89 89 PRO C C 89 174.543 176.371 -1.828 1
1 988 . 2 1 1 A 89 89 PRO CA C 89 59.435 62.606 -3.171 1
1 989 . 2 1 1 A 89 89 PRO CB C 89 29.805 32.014 -2.209 1
1 992 . 2 1 1 A 90 90 SER H H 90 8.808 8.439 0.369 1
1 993 . 2 1 1 A 90 90 SER HA H 90 4.202 4.533 -0.331 1
1 996 . 2 1 1 A 90 90 SER C C 90 171.870 174.074 -2.204 1
1 997 . 2 1 1 A 90 90 SER CA C 90 55.868 57.738 -1.870 1
1 998 . 2 1 1 A 90 90 SER CB C 90 64.504 63.776 0.728 1
1 999 . 2 1 1 A 90 90 SER N N 90 113.781 116.776 -2.995 1
1 1000 . 2 1 1 A 91 91 GLU H H 91 8.291 8.500 -0.209 1
1 1001 . 2 1 1 A 91 91 GLU HA H 91 4.131 4.133 -0.002 1
1 1006 . 2 1 1 A 91 91 GLU C C 91 174.882 176.773 -1.891 1
1 1007 . 2 1 1 A 91 91 GLU CA C 91 54.984 57.280 -2.296 1
1 1008 . 2 1 1 A 91 91 GLU CB C 91 27.643 29.656 -2.013 1
1 1010 . 2 1 1 A 91 91 GLU N N 91 117.930 123.566 -5.636 1
1 1011 . 2 1 1 A 92 92 ALA H H 92 8.605 8.330 0.275 1
1 1012 . 2 1 1 A 92 92 ALA HA H 92 5.068 4.397 0.671 1
1 1016 . 2 1 1 A 92 92 ALA C C 92 176.227 177.898 -1.671 1
1 1017 . 2 1 1 A 92 92 ALA CA C 92 48.997 53.001 -4.004 1
1 1018 . 2 1 1 A 92 92 ALA CB C 92 17.756 19.259 -1.503 1
1 1019 . 2 1 1 A 92 92 ALA N N 92 126.421 127.773 -1.352 1
1 1020 . 2 1 1 A 93 93 VAL H H 93 9.051 8.949 0.102 1
1 1021 . 2 1 1 A 93 93 VAL HA H 93 4.642 5.015 -0.373 1
1 1029 . 2 1 1 A 93 93 VAL C C 93 172.010 174.414 -2.404 1
1 1030 . 2 1 1 A 93 93 VAL CA C 93 57.495 59.509 -2.014 1
1 1031 . 2 1 1 A 93 93 VAL CB C 93 32.774 34.341 -1.567 1
1 1034 . 2 1 1 A 93 93 VAL N N 93 117.322 118.513 -1.191 1
1 1035 . 2 1 1 A 94 94 ARG H H 94 8.470 8.855 -0.385 1
1 1036 . 2 1 1 A 94 94 ARG HA H 94 5.692 5.197 0.495 1
1 1043 . 2 1 1 A 94 94 ARG C C 94 173.635 174.801 -1.166 1
1 1044 . 2 1 1 A 94 94 ARG CA C 94 52.038 54.301 -2.263 1
1 1045 . 2 1 1 A 94 94 ARG CB C 94 30.966 32.306 -1.340 1
1 1048 . 2 1 1 A 94 94 ARG N N 94 122.258 122.003 0.255 1
1 1049 . 2 1 1 A 95 95 ALA H H 95 9.051 8.816 0.235 1
1 1050 . 2 1 1 A 95 95 ALA HA H 95 4.642 5.233 -0.591 1
1 1054 . 2 1 1 A 95 95 ALA C C 95 172.285 175.167 -2.882 1
1 1055 . 2 1 1 A 95 95 ALA CA C 95 49.191 50.842 -1.651 1
1 1056 . 2 1 1 A 95 95 ALA CB C 95 22.562 22.200 0.362 1
1 1057 . 2 1 1 A 95 95 ALA N N 95 121.931 126.221 -4.290 1
1 1058 . 2 1 1 A 96 96 ARG H H 96 8.550 8.685 -0.135 1
1 1059 . 2 1 1 A 96 96 ARG HA H 96 5.407 5.115 0.292 1
1 1066 . 2 1 1 A 96 96 ARG C C 96 174.547 176.112 -1.565 1
1 1067 . 2 1 1 A 96 96 ARG CA C 96 51.439 55.082 -3.643 1
1 1068 . 2 1 1 A 96 96 ARG CB C 96 30.708 31.817 -1.109 1
1 1071 . 2 1 1 A 96 96 ARG N N 96 121.155 124.674 -3.519 1
1 1072 . 2 1 1 A 97 97 THR H H 97 8.797 8.732 0.065 1
1 1073 . 2 1 1 A 97 97 THR HA H 97 4.116 4.544 -0.428 1
1 1078 . 2 1 1 A 97 97 THR C C 97 173.577 175.023 -1.446 1
1 1079 . 2 1 1 A 97 97 THR CA C 97 58.800 61.304 -2.504 1
1 1080 . 2 1 1 A 97 97 THR CB C 97 67.461 69.696 -2.235 1
1 1082 . 2 1 1 A 97 97 THR N N 97 114.657 117.227 -2.570 1
1 1083 . 2 1 1 A 98 98 GLY H H 98 7.505 8.474 -0.969 1
1 1084 . 2 1 1 A 98 98 GLY HA2 H 98 3.866 4.147 -0.281 1
1 1085 . 2 1 1 A 98 98 GLY HA3 H 98 3.743 4.184 -0.441 1
1 1086 . 2 1 1 A 98 98 GLY C C 98 170.637 173.141 -2.504 1
1 1087 . 2 1 1 A 98 98 GLY CA C 98 42.332 44.340 -2.008 1
1 1088 . 2 1 1 A 98 98 GLY N N 98 106.172 108.173 -2.001 1
1 1089 . 2 1 1 A 99 99 GLU H H 99 8.145 8.652 -0.507 1
1 1090 . 2 1 1 A 99 99 GLU HA H 99 4.210 4.626 -0.416 1
1 1095 . 2 1 1 A 99 99 GLU C C 99 174.134 176.524 -2.390 1
1 1096 . 2 1 1 A 99 99 GLU CA C 99 53.828 55.840 -2.012 1
1 1097 . 2 1 1 A 99 99 GLU CB C 99 28.774 31.250 -2.476 1
1 1099 . 2 1 1 A 99 99 GLU N N 99 117.634 119.530 -1.896 1
1 1100 . 2 1 1 A 100 100 GLN H H 100 8.647 8.601 0.046 1
1 1101 . 2 1 1 A 100 100 GLN HA H 100 4.247 4.638 -0.391 1
1 1108 . 2 1 1 A 100 100 GLN C C 100 173.348 175.651 -2.303 1
1 1109 . 2 1 1 A 100 100 GLN CA C 100 53.634 54.742 -1.108 1
1 1110 . 2 1 1 A 100 100 GLN CB C 100 27.392 29.375 -1.983 1
1 1112 . 2 1 1 A 100 100 GLN N N 100 121.960 123.271 -1.311 1
1 1114 . 2 1 1 A 101 101 SER H H 101 8.416 8.150 0.266 1
1 1115 . 2 1 1 A 101 101 SER HA H 101 4.418 4.126 0.292 1
1 1117 . 2 1 1 A 101 101 SER C C 101 172.148 173.522 -1.374 1
1 1118 . 2 1 1 A 101 101 SER CA C 101 55.926 59.293 -3.367 1
1 1119 . 2 1 1 A 101 101 SER CB C 101 61.617 60.987 0.630 1
1 1120 . 2 1 1 A 101 101 SER N N 101 118.609 114.956 3.653 1
1 1121 . 2 1 1 A 102 102 GLY H H 102 8.233 8.132 0.101 1
1 1122 . 2 1 1 A 102 102 GLY HA2 H 102 4.080 3.932 0.148 1
1 1123 . 2 1 1 A 102 102 GLY HA3 H 102 3.981 3.938 0.043 1
1 1124 . 2 1 1 A 102 102 GLY C C 102 169.461 174.029 -4.568 1
1 1125 . 2 1 1 A 102 102 GLY CA C 102 42.332 45.965 -3.633 1
1 1126 . 2 1 1 A 102 102 GLY N N 102 110.483 110.241 0.242 1
1 1127 . 2 1 1 A 103 103 PRO HA H 103 4.618 4.612 0.006 1
1 1134 . 2 1 1 A 103 103 PRO CA C 103 57.843 62.889 -5.046 1
1 1135 . 2 1 1 A 103 103 PRO CB C 103 28.671 31.658 -2.987 1
1 1 . 3 1 1 A 6 6 SER HA H 6 4.492 4.514 -0.022 1
1 4 . 3 1 1 A 6 6 SER CA C 6 55.621 59.081 -3.460 1
1 5 . 3 1 1 A 6 6 SER CB C 6 62.104 63.684 -1.580 1
1 6 . 3 1 1 A 7 7 GLY H H 7 8.244 8.127 0.117 1
1 7 . 3 1 1 A 7 7 GLY HA2 H 7 3.873 4.116 -0.243 1
1 8 . 3 1 1 A 7 7 GLY HA3 H 7 3.737 4.121 -0.384 1
1 9 . 3 1 1 A 7 7 GLY CA C 7 41.743 45.224 -3.481 1
1 10 . 3 1 1 A 7 7 GLY N N 7 109.193 111.983 -2.790 1
1 11 . 3 1 1 A 8 8 PRO HA H 8 4.286 4.568 -0.282 1
1 18 . 3 1 1 A 8 8 PRO C C 8 173.841 175.602 -1.761 1
1 19 . 3 1 1 A 8 8 PRO CA C 8 60.528 62.546 -2.018 1
1 20 . 3 1 1 A 8 8 PRO CB C 8 30.299 32.962 -2.663 1
1 23 . 3 1 1 A 9 9 LYS H H 9 8.877 8.275 0.602 1
1 24 . 3 1 1 A 9 9 LYS HA H 9 4.360 4.814 -0.454 1
1 33 . 3 1 1 A 9 9 LYS C C 9 173.492 174.332 -0.840 1
1 34 . 3 1 1 A 9 9 LYS CA C 9 52.135 53.197 -1.062 1
1 35 . 3 1 1 A 9 9 LYS CB C 9 28.798 32.817 -4.019 1
1 39 . 3 1 1 A 9 9 LYS N N 9 120.404 120.705 -0.301 1
1 40 . 3 1 1 A 10 10 PRO HA H 10 4.284 4.634 -0.350 1
1 47 . 3 1 1 A 10 10 PRO CA C 10 59.326 61.646 -2.320 1
1 48 . 3 1 1 A 10 10 PRO CB C 10 28.825 31.585 -2.760 1
1 51 . 3 1 1 A 11 11 PRO HA H 11 4.468 4.756 -0.288 1
1 58 . 3 1 1 A 11 11 PRO C C 11 171.993 176.154 -4.161 1
1 59 . 3 1 1 A 11 11 PRO CA C 11 60.422 62.471 -2.049 1
1 60 . 3 1 1 A 11 11 PRO CB C 11 30.418 32.972 -2.554 1
1 63 . 3 1 1 A 12 12 ILE H H 12 7.554 7.974 -0.420 1
1 64 . 3 1 1 A 12 12 ILE HA H 12 4.676 4.746 -0.070 1
1 74 . 3 1 1 A 12 12 ILE C C 12 171.721 174.940 -3.219 1
1 75 . 3 1 1 A 12 12 ILE CA C 12 56.843 58.809 -1.966 1
1 76 . 3 1 1 A 12 12 ILE CB C 12 40.560 41.367 -0.807 1
1 80 . 3 1 1 A 12 12 ILE N N 12 109.695 116.500 -6.805 1
1 81 . 3 1 1 A 13 13 ASP H H 13 8.435 9.068 -0.633 1
1 82 . 3 1 1 A 13 13 ASP HA H 13 4.094 4.265 -0.171 1
1 85 . 3 1 1 A 13 13 ASP C C 13 171.803 176.177 -4.374 1
1 86 . 3 1 1 A 13 13 ASP CA C 13 52.610 55.188 -2.578 1
1 87 . 3 1 1 A 13 13 ASP CB C 13 36.357 40.406 -4.049 1
1 88 . 3 1 1 A 13 13 ASP N N 13 116.219 122.089 -5.870 1
1 89 . 3 1 1 A 14 14 LEU H H 14 7.483 8.005 -0.522 1
1 90 . 3 1 1 A 14 14 LEU HA H 14 4.990 4.585 0.405 1
1 100 . 3 1 1 A 14 14 LEU C C 14 174.702 175.347 -0.645 1
1 101 . 3 1 1 A 14 14 LEU CA C 14 53.811 55.455 -1.644 1
1 102 . 3 1 1 A 14 14 LEU CB C 14 40.148 42.230 -2.082 1
1 106 . 3 1 1 A 14 14 LEU N N 14 118.463 121.155 -2.692 1
1 107 . 3 1 1 A 15 15 VAL H H 15 9.209 8.527 0.682 1
1 108 . 3 1 1 A 15 15 VAL HA H 15 4.250 4.781 -0.531 1
1 116 . 3 1 1 A 15 15 VAL C C 15 172.080 174.096 -2.016 1
1 117 . 3 1 1 A 15 15 VAL CA C 15 58.570 60.371 -1.801 1
1 118 . 3 1 1 A 15 15 VAL CB C 15 34.146 36.050 -1.904 1
1 121 . 3 1 1 A 15 15 VAL N N 15 124.833 127.379 -2.546 1
1 122 . 3 1 1 A 16 16 VAL H H 16 8.390 8.890 -0.500 1
1 123 . 3 1 1 A 16 16 VAL HA H 16 4.343 4.549 -0.206 1
1 131 . 3 1 1 A 16 16 VAL C C 16 174.672 175.618 -0.946 1
1 132 . 3 1 1 A 16 16 VAL CA C 16 59.188 61.049 -1.861 1
1 133 . 3 1 1 A 16 16 VAL CB C 16 29.187 33.352 -4.165 1
1 136 . 3 1 1 A 16 16 VAL N N 16 124.654 124.855 -0.201 1
1 137 . 3 1 1 A 17 17 THR H H 17 8.638 8.362 0.276 1
1 138 . 3 1 1 A 17 17 THR HA H 17 4.195 4.456 -0.261 1
1 143 . 3 1 1 A 17 17 THR C C 17 172.661 173.244 -0.583 1
1 144 . 3 1 1 A 17 17 THR CA C 17 60.318 63.497 -3.179 1
1 145 . 3 1 1 A 17 17 THR CB C 17 66.420 71.036 -4.616 1
1 147 . 3 1 1 A 17 17 THR N N 17 120.942 121.557 -0.615 1
1 148 . 3 1 1 A 18 18 GLU H H 18 7.361 7.641 -0.280 1
1 149 . 3 1 1 A 18 18 GLU HA H 18 4.497 4.830 -0.333 1
1 154 . 3 1 1 A 18 18 GLU C C 18 171.691 175.176 -3.485 1
1 155 . 3 1 1 A 18 18 GLU CA C 18 53.687 54.905 -1.218 1
1 156 . 3 1 1 A 18 18 GLU CB C 18 30.802 33.387 -2.585 1
1 158 . 3 1 1 A 18 18 GLU N N 18 119.088 118.500 0.588 1
1 159 . 3 1 1 A 19 19 THR H H 19 8.164 8.663 -0.499 1
1 160 . 3 1 1 A 19 19 THR HA H 19 4.912 5.043 -0.131 1
1 165 . 3 1 1 A 19 19 THR C C 19 171.606 172.835 -1.229 1
1 166 . 3 1 1 A 19 19 THR CA C 19 58.473 60.676 -2.203 1
1 167 . 3 1 1 A 19 19 THR CB C 19 70.103 71.040 -0.937 1
1 169 . 3 1 1 A 19 19 THR N N 19 112.424 113.834 -1.410 1
1 170 . 3 1 1 A 20 20 THR H H 20 8.750 9.064 -0.314 1
1 171 . 3 1 1 A 20 20 THR HA H 20 4.710 4.827 -0.117 1
1 176 . 3 1 1 A 20 20 THR C C 20 172.785 176.242 -3.457 1
1 177 . 3 1 1 A 20 20 THR CA C 20 58.059 60.982 -2.923 1
1 178 . 3 1 1 A 20 20 THR CB C 20 68.782 71.040 -2.258 1
1 180 . 3 1 1 A 20 20 THR N N 20 113.438 121.434 -7.996 1
1 181 . 3 1 1 A 21 21 ALA H H 21 8.453 8.969 -0.516 1
1 182 . 3 1 1 A 21 21 ALA HA H 21 4.079 4.378 -0.299 1
1 186 . 3 1 1 A 21 21 ALA C C 21 174.130 177.954 -3.824 1
1 187 . 3 1 1 A 21 21 ALA CA C 21 52.680 54.978 -2.298 1
1 188 . 3 1 1 A 21 21 ALA CB C 21 16.893 18.413 -1.520 1
1 189 . 3 1 1 A 21 21 ALA N N 21 120.078 125.913 -5.835 1
1 190 . 3 1 1 A 22 22 THR H H 22 7.132 7.528 -0.396 1
1 191 . 3 1 1 A 22 22 THR HA H 22 4.433 4.726 -0.293 1
1 196 . 3 1 1 A 22 22 THR C C 22 171.434 173.420 -1.986 1
1 197 . 3 1 1 A 22 22 THR CA C 22 56.836 60.520 -3.684 1
1 198 . 3 1 1 A 22 22 THR CB C 22 68.772 69.487 -0.715 1
1 200 . 3 1 1 A 22 22 THR N N 22 95.772 104.073 -8.301 1
1 201 . 3 1 1 A 23 23 SER H H 23 7.326 7.755 -0.429 1
1 202 . 3 1 1 A 23 23 SER HA H 23 5.562 5.400 0.162 1
1 205 . 3 1 1 A 23 23 SER C C 23 169.267 172.162 -2.895 1
1 206 . 3 1 1 A 23 23 SER CA C 23 54.445 57.653 -3.208 1
1 207 . 3 1 1 A 23 23 SER CB C 23 65.905 67.451 -1.546 1
1 208 . 3 1 1 A 23 23 SER N N 23 115.757 115.720 0.037 1
1 209 . 3 1 1 A 24 24 VAL H H 24 7.983 8.525 -0.542 1
1 210 . 3 1 1 A 24 24 VAL HA H 24 4.334 4.519 -0.185 1
1 218 . 3 1 1 A 24 24 VAL C C 24 171.917 173.601 -1.684 1
1 219 . 3 1 1 A 24 24 VAL CA C 24 58.642 60.308 -1.666 1
1 220 . 3 1 1 A 24 24 VAL CB C 24 34.254 34.991 -0.737 1
1 223 . 3 1 1 A 24 24 VAL N N 24 116.595 120.710 -4.115 1
1 224 . 3 1 1 A 25 25 THR H H 25 8.636 8.955 -0.319 1
1 225 . 3 1 1 A 25 25 THR HA H 25 4.833 4.966 -0.133 1
1 230 . 3 1 1 A 25 25 THR C C 25 169.721 172.709 -2.988 1
1 231 . 3 1 1 A 25 25 THR CA C 25 59.699 61.568 -1.869 1
1 232 . 3 1 1 A 25 25 THR CB C 25 67.303 70.335 -3.032 1
1 234 . 3 1 1 A 25 25 THR N N 25 121.690 122.647 -0.957 1
1 235 . 3 1 1 A 26 26 LEU H H 26 8.629 9.380 -0.751 1
1 236 . 3 1 1 A 26 26 LEU HA H 26 5.315 5.339 -0.024 1
1 246 . 3 1 1 A 26 26 LEU C C 26 173.182 175.326 -2.144 1
1 247 . 3 1 1 A 26 26 LEU CA C 26 50.643 53.284 -2.641 1
1 248 . 3 1 1 A 26 26 LEU CB C 26 43.976 46.074 -2.098 1
1 252 . 3 1 1 A 26 26 LEU N N 26 126.843 130.291 -3.448 1
1 253 . 3 1 1 A 27 27 THR H H 27 8.704 8.803 -0.099 1
1 254 . 3 1 1 A 27 27 THR HA H 27 4.822 5.214 -0.392 1
1 259 . 3 1 1 A 27 27 THR C C 27 169.840 173.732 -3.892 1
1 260 . 3 1 1 A 27 27 THR CA C 27 58.077 59.955 -1.878 1
1 261 . 3 1 1 A 27 27 THR CB C 27 69.666 71.386 -1.720 1
1 263 . 3 1 1 A 27 27 THR N N 27 111.513 115.565 -4.052 1
1 264 . 3 1 1 A 28 28 TRP H H 28 7.339 8.249 -0.910 1
1 265 . 3 1 1 A 28 28 TRP HA H 28 4.963 5.470 -0.507 1
1 274 . 3 1 1 A 28 28 TRP C C 28 170.637 172.533 -1.896 1
1 275 . 3 1 1 A 28 28 TRP CA C 28 54.438 55.361 -0.923 1
1 276 . 3 1 1 A 28 28 TRP CB C 28 27.497 31.350 -3.853 1
1 282 . 3 1 1 A 28 28 TRP N N 28 117.895 119.615 -1.720 1
1 284 . 3 1 1 A 29 29 ASP H H 29 8.696 9.101 -0.405 1
1 285 . 3 1 1 A 29 29 ASP HA H 29 4.971 5.038 -0.067 1
1 288 . 3 1 1 A 29 29 ASP C C 29 174.901 176.920 -2.019 1
1 289 . 3 1 1 A 29 29 ASP CA C 29 50.178 52.717 -2.539 1
1 290 . 3 1 1 A 29 29 ASP CB C 29 42.291 43.208 -0.917 1
1 291 . 3 1 1 A 29 29 ASP N N 29 117.477 121.885 -4.408 1
1 292 . 3 1 1 A 30 30 SER H H 30 8.800 8.907 -0.107 1
1 293 . 3 1 1 A 30 30 SER HA H 30 4.389 4.112 0.277 1
1 296 . 3 1 1 A 30 30 SER C C 30 174.032 175.059 -1.027 1
1 297 . 3 1 1 A 30 30 SER CA C 30 58.694 62.029 -3.335 1
1 298 . 3 1 1 A 30 30 SER CB C 30 62.428 63.293 -0.865 1
1 299 . 3 1 1 A 30 30 SER N N 30 118.275 120.131 -1.856 1
1 300 . 3 1 1 A 31 31 GLY H H 31 8.759 8.483 0.276 1
1 301 . 3 1 1 A 31 31 GLY HA2 H 31 4.239 4.023 0.216 1
1 302 . 3 1 1 A 31 31 GLY HA3 H 31 3.555 4.059 -0.504 1
1 303 . 3 1 1 A 31 31 GLY C C 31 171.325 174.145 -2.820 1
1 304 . 3 1 1 A 31 31 GLY CA C 31 43.637 45.534 -1.897 1
1 305 . 3 1 1 A 31 31 GLY N N 31 107.961 109.513 -1.552 1
1 306 . 3 1 1 A 32 32 ASN H H 32 8.173 8.160 0.013 1
1 307 . 3 1 1 A 32 32 ASN HA H 32 4.749 5.063 -0.314 1
1 312 . 3 1 1 A 32 32 ASN C C 32 171.355 175.206 -3.851 1
1 313 . 3 1 1 A 32 32 ASN CA C 32 50.795 52.838 -2.043 1
1 314 . 3 1 1 A 32 32 ASN CB C 32 41.508 40.200 1.308 1
1 315 . 3 1 1 A 32 32 ASN N N 32 117.781 119.382 -1.601 1
1 317 . 3 1 1 A 33 33 SER HA H 33 4.291 4.554 -0.263 1
1 320 . 3 1 1 A 33 33 SER C C 33 172.449 174.227 -1.778 1
1 321 . 3 1 1 A 33 33 SER CA C 33 56.733 59.020 -2.287 1
1 322 . 3 1 1 A 33 33 SER CB C 33 60.884 65.115 -4.231 1
1 323 . 3 1 1 A 34 34 GLU H H 34 7.731 7.662 0.069 1
1 324 . 3 1 1 A 34 34 GLU HA H 34 4.556 4.646 -0.090 1
1 329 . 3 1 1 A 34 34 GLU C C 34 171.792 174.865 -3.073 1
1 330 . 3 1 1 A 34 34 GLU CA C 34 51.818 54.578 -2.760 1
1 331 . 3 1 1 A 34 34 GLU CB C 34 26.891 30.760 -3.869 1
1 333 . 3 1 1 A 34 34 GLU N N 34 122.319 118.147 4.172 1
1 334 . 3 1 1 A 35 35 PRO HA H 35 4.165 4.766 -0.601 1
1 341 . 3 1 1 A 35 35 PRO C C 35 174.288 176.758 -2.470 1
1 342 . 3 1 1 A 35 35 PRO CA C 35 61.374 62.733 -1.359 1
1 343 . 3 1 1 A 35 35 PRO CB C 35 29.887 31.717 -1.830 1
1 346 . 3 1 1 A 36 36 VAL H H 36 8.348 8.188 0.160 1
1 347 . 3 1 1 A 36 36 VAL HA H 36 3.899 4.388 -0.489 1
1 355 . 3 1 1 A 36 36 VAL C C 36 173.344 176.931 -3.587 1
1 356 . 3 1 1 A 36 36 VAL CA C 36 59.014 60.322 -1.308 1
1 357 . 3 1 1 A 36 36 VAL CB C 36 31.865 34.037 -2.172 1
1 360 . 3 1 1 A 36 36 VAL N N 36 122.051 117.905 4.146 1
1 361 . 3 1 1 A 37 37 THR H H 37 8.780 8.160 0.620 1
1 362 . 3 1 1 A 37 37 THR HA H 37 3.923 4.160 -0.237 1
1 367 . 3 1 1 A 37 37 THR C C 37 172.171 174.515 -2.344 1
1 368 . 3 1 1 A 37 37 THR CA C 37 63.155 65.067 -1.912 1
1 369 . 3 1 1 A 37 37 THR CB C 37 65.941 69.300 -3.359 1
1 371 . 3 1 1 A 37 37 THR N N 37 122.351 117.255 5.096 1
1 372 . 3 1 1 A 38 38 TYR H H 38 7.304 7.208 0.096 1
1 373 . 3 1 1 A 38 38 TYR HA H 38 4.439 5.070 -0.631 1
1 380 . 3 1 1 A 38 38 TYR C C 38 168.385 172.402 -4.017 1
1 381 . 3 1 1 A 38 38 TYR CA C 38 54.101 56.419 -2.318 1
1 382 . 3 1 1 A 38 38 TYR CB C 38 35.874 40.255 -4.381 1
1 387 . 3 1 1 A 38 38 TYR N N 38 113.984 114.962 -0.978 1
1 388 . 3 1 1 A 39 39 TYR H H 39 9.445 8.795 0.650 1
1 389 . 3 1 1 A 39 39 TYR HA H 39 5.293 5.241 0.052 1
1 396 . 3 1 1 A 39 39 TYR C C 39 172.781 175.990 -3.209 1
1 397 . 3 1 1 A 39 39 TYR CA C 39 54.322 56.042 -1.720 1
1 398 . 3 1 1 A 39 39 TYR CB C 39 39.035 41.349 -2.314 1
1 401 . 3 1 1 A 39 39 TYR N N 39 115.092 118.516 -3.424 1
1 402 . 3 1 1 A 40 40 GLY H H 40 8.870 9.079 -0.209 1
1 403 . 3 1 1 A 40 40 GLY HA2 H 40 5.137 4.203 0.934 1
1 404 . 3 1 1 A 40 40 GLY HA3 H 40 3.285 4.266 -0.981 1
1 405 . 3 1 1 A 40 40 GLY C C 40 169.688 172.715 -3.027 1
1 406 . 3 1 1 A 40 40 GLY CA C 40 41.415 44.469 -3.054 1
1 407 . 3 1 1 A 40 40 GLY N N 40 106.573 112.073 -5.500 1
1 408 . 3 1 1 A 41 41 ILE H H 41 8.917 8.505 0.412 1
1 409 . 3 1 1 A 41 41 ILE HA H 41 4.527 4.807 -0.280 1
1 419 . 3 1 1 A 41 41 ILE C C 41 172.692 174.662 -1.970 1
1 420 . 3 1 1 A 41 41 ILE CA C 41 57.597 60.121 -2.524 1
1 421 . 3 1 1 A 41 41 ILE CB C 41 37.840 42.414 -4.574 1
1 425 . 3 1 1 A 41 41 ILE N N 41 121.746 121.030 0.716 1
1 426 . 3 1 1 A 42 42 GLN H H 42 9.063 8.678 0.385 1
1 427 . 3 1 1 A 42 42 GLN HA H 42 5.655 5.437 0.218 1
1 434 . 3 1 1 A 42 42 GLN C C 42 172.841 174.411 -1.570 1
1 435 . 3 1 1 A 42 42 GLN CA C 42 50.789 54.470 -3.681 1
1 436 . 3 1 1 A 42 42 GLN CB C 42 28.898 32.348 -3.450 1
1 438 . 3 1 1 A 42 42 GLN N N 42 125.141 125.666 -0.525 1
1 440 . 3 1 1 A 43 43 TYR H H 43 9.066 8.893 0.173 1
1 441 . 3 1 1 A 43 43 TYR HA H 43 5.922 5.946 -0.024 1
1 448 . 3 1 1 A 43 43 TYR C C 43 171.219 172.869 -1.650 1
1 449 . 3 1 1 A 43 43 TYR CA C 43 53.349 56.149 -2.800 1
1 450 . 3 1 1 A 43 43 TYR CB C 43 41.074 42.063 -0.989 1
1 455 . 3 1 1 A 43 43 TYR N N 43 118.018 119.551 -1.533 1
1 456 . 3 1 1 A 44 44 ARG H H 44 8.400 8.678 -0.278 1
1 457 . 3 1 1 A 44 44 ARG HA H 44 4.542 4.511 0.031 1
1 464 . 3 1 1 A 44 44 ARG C C 44 171.974 174.389 -2.415 1
1 465 . 3 1 1 A 44 44 ARG CA C 44 52.453 54.862 -2.409 1
1 466 . 3 1 1 A 44 44 ARG CB C 44 31.125 32.904 -1.779 1
1 469 . 3 1 1 A 44 44 ARG N N 44 115.214 120.600 -5.386 1
1 470 . 3 1 1 A 45 45 ALA H H 45 8.846 8.329 0.517 1
1 471 . 3 1 1 A 45 45 ALA HA H 45 3.894 2.607 1.287 1
1 475 . 3 1 1 A 45 45 ALA C C 45 175.721 176.895 -1.174 1
1 476 . 3 1 1 A 45 45 ALA CA C 45 50.372 52.242 -1.870 1
1 477 . 3 1 1 A 45 45 ALA CB C 45 15.732 18.893 -3.161 1
1 478 . 3 1 1 A 45 45 ALA N N 45 126.463 127.201 -0.738 1
1 479 . 3 1 1 A 46 46 ALA H H 46 8.282 8.471 -0.189 1
1 480 . 3 1 1 A 46 46 ALA HA H 46 3.922 4.054 -0.132 1
1 484 . 3 1 1 A 46 46 ALA C C 46 176.236 177.584 -1.348 1
1 485 . 3 1 1 A 46 46 ALA CA C 46 50.773 52.508 -1.735 1
1 486 . 3 1 1 A 46 46 ALA CB C 46 16.244 17.636 -1.392 1
1 487 . 3 1 1 A 46 46 ALA N N 46 126.301 124.815 1.486 1
1 488 . 3 1 1 A 47 47 GLY HA2 H 47 3.882 4.024 -0.142 1
1 489 . 3 1 1 A 47 47 GLY HA3 H 47 3.695 4.049 -0.354 1
1 490 . 3 1 1 A 47 47 GLY C C 47 171.795 173.768 -1.973 1
1 491 . 3 1 1 A 47 47 GLY CA C 47 43.327 45.382 -2.055 1
1 492 . 3 1 1 A 48 48 THR H H 48 7.145 7.791 -0.646 1
1 493 . 3 1 1 A 48 48 THR HA H 48 4.417 4.854 -0.437 1
1 498 . 3 1 1 A 48 48 THR C C 48 171.325 173.036 -1.711 1
1 499 . 3 1 1 A 48 48 THR CA C 48 58.271 61.041 -2.770 1
1 500 . 3 1 1 A 48 48 THR CB C 48 68.846 72.607 -3.761 1
1 502 . 3 1 1 A 48 48 THR N N 48 110.190 113.880 -3.690 1
1 503 . 3 1 1 A 49 49 GLU H H 49 8.346 8.531 -0.185 1
1 504 . 3 1 1 A 49 49 GLU HA H 49 4.277 4.592 -0.315 1
1 509 . 3 1 1 A 49 49 GLU C C 49 174.109 175.174 -1.065 1
1 510 . 3 1 1 A 49 49 GLU CA C 49 52.909 56.293 -3.384 1
1 511 . 3 1 1 A 49 49 GLU CB C 49 27.845 28.491 -0.646 1
1 513 . 3 1 1 A 49 49 GLU N N 49 119.985 122.851 -2.866 1
1 514 . 3 1 1 A 50 50 GLY H H 50 7.617 8.237 -0.620 1
1 515 . 3 1 1 A 50 50 GLY HA2 H 50 3.935 4.252 -0.317 1
1 516 . 3 1 1 A 50 50 GLY HA3 H 50 3.935 4.288 -0.353 1
1 517 . 3 1 1 A 50 50 GLY C C 50 168.223 171.728 -3.505 1
1 518 . 3 1 1 A 50 50 GLY CA C 50 42.121 44.353 -2.232 1
1 519 . 3 1 1 A 50 50 GLY N N 50 108.670 109.064 -0.394 1
1 520 . 3 1 1 A 51 51 PRO HA H 51 4.298 4.681 -0.383 1
1 527 . 3 1 1 A 51 51 PRO C C 51 175.067 176.849 -1.782 1
1 528 . 3 1 1 A 51 51 PRO CA C 51 60.175 62.865 -2.690 1
1 529 . 3 1 1 A 51 51 PRO CB C 51 30.052 32.378 -2.326 1
1 532 . 3 1 1 A 52 52 PHE H H 52 8.442 8.674 -0.232 1
1 533 . 3 1 1 A 52 52 PHE HA H 52 3.981 4.481 -0.500 1
1 541 . 3 1 1 A 52 52 PHE C C 52 175.141 175.654 -0.513 1
1 542 . 3 1 1 A 52 52 PHE CA C 52 56.808 57.701 -0.893 1
1 543 . 3 1 1 A 52 52 PHE CB C 52 36.830 39.418 -2.588 1
1 549 . 3 1 1 A 52 52 PHE N N 52 118.707 121.932 -3.225 1
1 550 . 3 1 1 A 53 53 GLN H H 53 8.778 7.795 0.983 1
1 551 . 3 1 1 A 53 53 GLN HA H 53 4.149 4.169 -0.020 1
1 558 . 3 1 1 A 53 53 GLN C C 53 172.773 175.152 -2.379 1
1 559 . 3 1 1 A 53 53 GLN CA C 53 52.999 56.632 -3.633 1
1 560 . 3 1 1 A 53 53 GLN CB C 53 26.962 29.268 -2.306 1
1 562 . 3 1 1 A 53 53 GLN N N 53 122.164 122.329 -0.165 1
1 564 . 3 1 1 A 54 54 GLU H H 54 8.432 8.541 -0.109 1
1 565 . 3 1 1 A 54 54 GLU HA H 54 5.533 5.084 0.449 1
1 570 . 3 1 1 A 54 54 GLU C C 54 173.930 174.715 -0.785 1
1 571 . 3 1 1 A 54 54 GLU CA C 54 52.981 55.388 -2.407 1
1 572 . 3 1 1 A 54 54 GLU CB C 54 31.712 33.116 -1.404 1
1 574 . 3 1 1 A 54 54 GLU N N 54 119.688 121.861 -2.173 1
1 575 . 3 1 1 A 55 55 VAL H H 55 9.077 9.044 0.033 1
1 576 . 3 1 1 A 55 55 VAL HA H 55 4.180 5.007 -0.827 1
1 584 . 3 1 1 A 55 55 VAL C C 55 171.811 174.716 -2.905 1
1 585 . 3 1 1 A 55 55 VAL CA C 55 59.664 61.067 -1.403 1
1 586 . 3 1 1 A 55 55 VAL CB C 55 31.827 33.956 -2.129 1
1 589 . 3 1 1 A 55 55 VAL N N 55 125.328 126.617 -1.289 1
1 590 . 3 1 1 A 56 56 ASP H H 56 8.639 8.744 -0.105 1
1 591 . 3 1 1 A 56 56 ASP HA H 56 5.250 5.425 -0.175 1
1 594 . 3 1 1 A 56 56 ASP C C 56 174.252 175.849 -1.597 1
1 595 . 3 1 1 A 56 56 ASP CA C 56 50.108 52.139 -2.031 1
1 596 . 3 1 1 A 56 56 ASP CB C 56 41.407 44.050 -2.643 1
1 597 . 3 1 1 A 56 56 ASP N N 56 125.773 124.699 1.074 1
1 598 . 3 1 1 A 57 57 GLY H H 57 7.222 8.582 -1.360 1
1 599 . 3 1 1 A 57 57 GLY HA2 H 57 3.479 3.840 -0.361 1
1 600 . 3 1 1 A 57 57 GLY HA3 H 57 2.719 3.887 -1.168 1
1 601 . 3 1 1 A 57 57 GLY C C 57 172.281 174.411 -2.130 1
1 602 . 3 1 1 A 57 57 GLY CA C 57 43.919 45.912 -1.993 1
1 603 . 3 1 1 A 57 57 GLY N N 57 105.564 110.689 -5.125 1
1 604 . 3 1 1 A 58 58 VAL H H 58 8.338 8.035 0.303 1
1 605 . 3 1 1 A 58 58 VAL HA H 58 3.860 4.320 -0.460 1
1 613 . 3 1 1 A 58 58 VAL C C 58 173.981 175.436 -1.455 1
1 614 . 3 1 1 A 58 58 VAL CA C 58 61.233 61.579 -0.346 1
1 615 . 3 1 1 A 58 58 VAL CB C 58 29.708 32.364 -2.656 1
1 618 . 3 1 1 A 58 58 VAL N N 58 121.466 120.807 0.659 1
1 619 . 3 1 1 A 59 59 ALA H H 59 9.038 8.736 0.302 1
1 620 . 3 1 1 A 59 59 ALA HA H 59 4.676 4.599 0.077 1
1 624 . 3 1 1 A 59 59 ALA C C 59 175.105 176.862 -1.757 1
1 625 . 3 1 1 A 59 59 ALA CA C 59 50.866 52.097 -1.231 1
1 626 . 3 1 1 A 59 59 ALA CB C 59 17.647 19.172 -1.525 1
1 627 . 3 1 1 A 59 59 ALA N N 59 130.928 130.253 0.675 1
1 628 . 3 1 1 A 60 60 THR H H 60 7.445 7.777 -0.332 1
1 629 . 3 1 1 A 60 60 THR HA H 60 4.642 4.709 -0.067 1
1 634 . 3 1 1 A 60 60 THR C C 60 169.528 174.074 -4.546 1
1 635 . 3 1 1 A 60 60 THR CA C 60 57.101 59.284 -2.183 1
1 636 . 3 1 1 A 60 60 THR CB C 60 67.982 71.731 -3.749 1
1 638 . 3 1 1 A 60 60 THR N N 60 109.256 109.486 -0.230 1
1 639 . 3 1 1 A 61 61 THR H H 61 7.325 8.394 -1.069 1
1 640 . 3 1 1 A 61 61 THR HA H 61 2.896 3.502 -0.606 1
1 645 . 3 1 1 A 61 61 THR C C 61 169.678 173.032 -3.354 1
1 646 . 3 1 1 A 61 61 THR CA C 61 57.246 61.125 -3.879 1
1 647 . 3 1 1 A 61 61 THR CB C 61 63.794 68.210 -4.416 1
1 649 . 3 1 1 A 61 61 THR N N 61 105.670 110.448 -4.778 1
1 650 . 3 1 1 A 62 62 ARG H H 62 6.490 7.055 -0.565 1
1 651 . 3 1 1 A 62 62 ARG HA H 62 4.698 4.736 -0.038 1
1 658 . 3 1 1 A 62 62 ARG C C 62 172.881 173.501 -0.620 1
1 659 . 3 1 1 A 62 62 ARG CA C 62 52.276 55.164 -2.888 1
1 660 . 3 1 1 A 62 62 ARG CB C 62 30.774 33.353 -2.579 1
1 663 . 3 1 1 A 62 62 ARG N N 62 117.485 122.077 -4.592 1
1 664 . 3 1 1 A 63 63 TYR H H 63 8.891 8.862 0.029 1
1 665 . 3 1 1 A 63 63 TYR HA H 63 4.356 5.376 -1.020 1
1 672 . 3 1 1 A 63 63 TYR C C 63 170.393 173.961 -3.568 1
1 673 . 3 1 1 A 63 63 TYR CA C 63 57.284 56.938 0.346 1
1 674 . 3 1 1 A 63 63 TYR CB C 63 41.467 42.687 -1.220 1
1 679 . 3 1 1 A 63 63 TYR N N 63 124.712 127.276 -2.564 1
1 680 . 3 1 1 A 64 64 SER H H 64 7.244 8.409 -1.165 1
1 681 . 3 1 1 A 64 64 SER HA H 64 5.077 5.670 -0.593 1
1 684 . 3 1 1 A 64 64 SER C C 64 169.712 173.415 -3.703 1
1 685 . 3 1 1 A 64 64 SER CA C 64 54.181 55.454 -1.273 1
1 686 . 3 1 1 A 64 64 SER CB C 64 61.122 65.845 -4.723 1
1 687 . 3 1 1 A 64 64 SER N N 64 120.593 120.077 0.516 1
1 688 . 3 1 1 A 65 65 ILE H H 65 8.686 8.863 -0.177 1
1 689 . 3 1 1 A 65 65 ILE HA H 65 3.937 4.901 -0.964 1
1 699 . 3 1 1 A 65 65 ILE C C 65 172.217 175.185 -2.968 1
1 700 . 3 1 1 A 65 65 ILE CA C 65 58.288 59.620 -1.332 1
1 701 . 3 1 1 A 65 65 ILE CB C 65 36.110 40.544 -4.434 1
1 705 . 3 1 1 A 65 65 ILE N N 65 127.792 124.334 3.458 1
1 706 . 3 1 1 A 66 66 GLY H H 66 7.883 8.586 -0.703 1
1 707 . 3 1 1 A 66 66 GLY HA2 H 66 4.799 4.181 0.618 1
1 708 . 3 1 1 A 66 66 GLY HA3 H 66 3.468 4.199 -0.731 1
1 709 . 3 1 1 A 66 66 GLY C C 66 171.983 174.240 -2.257 1
1 710 . 3 1 1 A 66 66 GLY CA C 66 40.534 44.513 -3.979 1
1 711 . 3 1 1 A 66 66 GLY N N 66 112.632 114.461 -1.829 1
1 712 . 3 1 1 A 67 67 GLY H H 67 8.483 8.221 0.262 1
1 713 . 3 1 1 A 67 67 GLY HA2 H 67 3.836 3.980 -0.144 1
1 714 . 3 1 1 A 67 67 GLY HA3 H 67 3.682 3.999 -0.317 1
1 715 . 3 1 1 A 67 67 GLY C C 67 172.954 174.226 -1.272 1
1 716 . 3 1 1 A 67 67 GLY CA C 67 43.568 45.642 -2.074 1
1 717 . 3 1 1 A 67 67 GLY N N 67 104.625 109.689 -5.064 1
1 718 . 3 1 1 A 68 68 LEU H H 68 8.236 7.975 0.261 1
1 719 . 3 1 1 A 68 68 LEU HA H 68 4.154 4.682 -0.528 1
1 729 . 3 1 1 A 68 68 LEU C C 68 173.838 176.063 -2.225 1
1 730 . 3 1 1 A 68 68 LEU CA C 68 51.025 53.449 -2.424 1
1 731 . 3 1 1 A 68 68 LEU CB C 68 38.837 42.781 -3.944 1
1 735 . 3 1 1 A 68 68 LEU N N 68 118.919 122.182 -3.263 1
1 736 . 3 1 1 A 69 69 SER H H 69 8.284 8.875 -0.591 1
1 737 . 3 1 1 A 69 69 SER HA H 69 4.765 5.102 -0.337 1
1 740 . 3 1 1 A 69 69 SER C C 69 170.044 172.290 -2.246 1
1 741 . 3 1 1 A 69 69 SER CA C 69 54.639 56.491 -1.852 1
1 742 . 3 1 1 A 69 69 SER CB C 69 61.216 63.702 -2.486 1
1 743 . 3 1 1 A 69 69 SER N N 69 116.361 117.329 -0.968 1
1 744 . 3 1 1 A 70 70 PRO HA H 70 5.141 4.640 0.501 1
1 751 . 3 1 1 A 70 70 PRO C C 70 174.858 177.456 -2.598 1
1 752 . 3 1 1 A 70 70 PRO CA C 70 60.810 63.999 -3.189 1
1 753 . 3 1 1 A 70 70 PRO CB C 70 30.657 32.031 -1.374 1
1 756 . 3 1 1 A 71 71 PHE H H 71 8.139 9.045 -0.906 1
1 757 . 3 1 1 A 71 71 PHE HA H 71 4.202 4.266 -0.064 1
1 765 . 3 1 1 A 71 71 PHE C C 71 172.870 174.440 -1.570 1
1 766 . 3 1 1 A 71 71 PHE CA C 71 55.410 59.064 -3.654 1
1 767 . 3 1 1 A 71 71 PHE CB C 71 36.027 37.709 -1.682 1
1 773 . 3 1 1 A 71 71 PHE N N 71 125.409 122.813 2.596 1
1 774 . 3 1 1 A 72 72 SER H H 72 8.182 7.368 0.814 1
1 775 . 3 1 1 A 72 72 SER HA H 72 4.755 5.030 -0.275 1
1 778 . 3 1 1 A 72 72 SER C C 72 168.850 172.585 -3.735 1
1 779 . 3 1 1 A 72 72 SER CA C 72 55.926 56.401 -0.475 1
1 780 . 3 1 1 A 72 72 SER CB C 72 64.208 66.865 -2.657 1
1 781 . 3 1 1 A 72 72 SER N N 72 113.509 110.469 3.040 1
1 782 . 3 1 1 A 73 73 GLU H H 73 8.422 8.783 -0.361 1
1 783 . 3 1 1 A 73 73 GLU HA H 73 4.966 5.157 -0.191 1
1 788 . 3 1 1 A 73 73 GLU C C 73 173.192 174.555 -1.363 1
1 789 . 3 1 1 A 73 73 GLU CA C 73 52.815 54.916 -2.101 1
1 790 . 3 1 1 A 73 73 GLU CB C 73 29.416 32.482 -3.066 1
1 792 . 3 1 1 A 73 73 GLU N N 73 123.046 123.554 -0.508 1
1 793 . 3 1 1 A 74 74 TYR H H 74 9.205 8.964 0.241 1
1 794 . 3 1 1 A 74 74 TYR HA H 74 4.799 5.020 -0.221 1
1 801 . 3 1 1 A 74 74 TYR C C 74 170.775 174.261 -3.486 1
1 802 . 3 1 1 A 74 74 TYR CA C 74 55.291 56.840 -1.549 1
1 803 . 3 1 1 A 74 74 TYR CB C 74 42.943 42.690 0.253 1
1 808 . 3 1 1 A 74 74 TYR N N 74 125.351 124.726 0.625 1
1 809 . 3 1 1 A 75 75 ALA H H 75 8.639 8.234 0.405 1
1 810 . 3 1 1 A 75 75 ALA HA H 75 5.271 5.420 -0.149 1
1 814 . 3 1 1 A 75 75 ALA C C 75 173.698 176.366 -2.668 1
1 815 . 3 1 1 A 75 75 ALA CA C 75 47.904 50.390 -2.486 1
1 816 . 3 1 1 A 75 75 ALA CB C 75 19.634 20.637 -1.003 1
1 817 . 3 1 1 A 75 75 ALA N N 75 121.555 124.850 -3.295 1
1 818 . 3 1 1 A 76 76 PHE H H 76 9.066 9.476 -0.410 1
1 819 . 3 1 1 A 76 76 PHE HA H 76 5.496 5.371 0.125 1
1 827 . 3 1 1 A 76 76 PHE C C 76 172.268 175.012 -2.744 1
1 828 . 3 1 1 A 76 76 PHE CA C 76 54.216 57.295 -3.079 1
1 829 . 3 1 1 A 76 76 PHE CB C 76 41.901 41.607 0.294 1
1 835 . 3 1 1 A 76 76 PHE N N 76 116.545 122.851 -6.306 1
1 836 . 3 1 1 A 77 77 ARG H H 77 9.216 8.679 0.537 1
1 837 . 3 1 1 A 77 77 ARG HA H 77 4.357 5.155 -0.798 1
1 845 . 3 1 1 A 77 77 ARG C C 77 169.998 174.173 -4.175 1
1 846 . 3 1 1 A 77 77 ARG CA C 77 52.414 54.835 -2.421 1
1 847 . 3 1 1 A 77 77 ARG CB C 77 30.794 34.082 -3.288 1
1 850 . 3 1 1 A 77 77 ARG N N 77 115.738 119.073 -3.335 1
1 852 . 3 1 1 A 78 78 VAL H H 78 8.135 8.753 -0.618 1
1 853 . 3 1 1 A 78 78 VAL HA H 78 4.884 4.499 0.385 1
1 861 . 3 1 1 A 78 78 VAL C C 78 171.098 175.392 -4.294 1
1 862 . 3 1 1 A 78 78 VAL CA C 78 57.566 61.369 -3.803 1
1 863 . 3 1 1 A 78 78 VAL CB C 78 33.146 32.421 0.725 1
1 866 . 3 1 1 A 78 78 VAL N N 78 117.942 124.829 -6.887 1
1 867 . 3 1 1 A 79 79 LEU H H 79 9.167 8.565 0.602 1
1 868 . 3 1 1 A 79 79 LEU HA H 79 4.575 5.015 -0.440 1
1 878 . 3 1 1 A 79 79 LEU C C 79 171.447 175.012 -3.565 1
1 879 . 3 1 1 A 79 79 LEU CA C 79 51.642 53.156 -1.514 1
1 880 . 3 1 1 A 79 79 LEU CB C 79 42.776 45.486 -2.710 1
1 884 . 3 1 1 A 79 79 LEU N N 79 123.913 121.482 2.431 1
1 885 . 3 1 1 A 80 80 ALA H H 80 9.325 8.581 0.744 1
1 886 . 3 1 1 A 80 80 ALA HA H 80 4.654 3.708 0.946 1
1 890 . 3 1 1 A 80 80 ALA C C 80 172.070 177.125 -5.055 1
1 891 . 3 1 1 A 80 80 ALA CA C 80 48.169 51.741 -3.572 1
1 892 . 3 1 1 A 80 80 ALA CB C 80 20.366 19.163 1.203 1
1 893 . 3 1 1 A 80 80 ALA N N 80 124.135 124.945 -0.810 1
1 894 . 3 1 1 A 81 81 VAL H H 81 7.953 7.960 -0.007 1
1 895 . 3 1 1 A 81 81 VAL HA H 81 4.293 4.622 -0.329 1
1 903 . 3 1 1 A 81 81 VAL C C 81 172.873 174.070 -1.197 1
1 904 . 3 1 1 A 81 81 VAL CA C 81 58.959 60.136 -1.177 1
1 905 . 3 1 1 A 81 81 VAL CB C 81 31.412 34.631 -3.219 1
1 908 . 3 1 1 A 81 81 VAL N N 81 118.503 120.704 -2.201 1
1 909 . 3 1 1 A 82 82 ASN H H 82 8.262 8.523 -0.261 1
1 910 . 3 1 1 A 82 82 ASN HA H 82 4.945 5.246 -0.301 1
1 915 . 3 1 1 A 82 82 ASN C C 82 173.273 175.281 -2.008 1
1 916 . 3 1 1 A 82 82 ASN CA C 82 48.714 51.639 -2.925 1
1 917 . 3 1 1 A 82 82 ASN CB C 82 36.796 40.129 -3.333 1
1 918 . 3 1 1 A 82 82 ASN N N 82 125.425 123.371 2.054 1
1 920 . 3 1 1 A 83 83 SER HA H 83 3.966 4.099 -0.133 1
1 923 . 3 1 1 A 83 83 SER C C 83 172.812 176.832 -4.020 1
1 924 . 3 1 1 A 83 83 SER CA C 83 59.047 62.309 -3.262 1
1 925 . 3 1 1 A 83 83 SER CB C 83 60.406 62.831 -2.425 1
1 926 . 3 1 1 A 84 84 ILE H H 84 7.803 7.813 -0.010 1
1 927 . 3 1 1 A 84 84 ILE HA H 84 3.862 3.803 0.059 1
1 937 . 3 1 1 A 84 84 ILE C C 84 174.481 176.047 -1.566 1
1 938 . 3 1 1 A 84 84 ILE CA C 84 59.188 63.900 -4.712 1
1 939 . 3 1 1 A 84 84 ILE CB C 84 34.677 38.360 -3.683 1
1 943 . 3 1 1 A 84 84 ILE N N 84 121.222 118.373 2.849 1
1 944 . 3 1 1 A 85 85 GLY H H 85 7.435 7.457 -0.022 1
1 945 . 3 1 1 A 85 85 GLY HA2 H 85 4.149 4.014 0.135 1
1 946 . 3 1 1 A 85 85 GLY HA3 H 85 3.747 4.018 -0.271 1
1 947 . 3 1 1 A 85 85 GLY C C 85 168.589 172.635 -4.046 1
1 948 . 3 1 1 A 85 85 GLY CA C 85 42.931 45.145 -2.214 1
1 949 . 3 1 1 A 85 85 GLY N N 85 106.320 106.051 0.269 1
1 950 . 3 1 1 A 86 86 ARG H H 86 8.190 8.409 -0.219 1
1 951 . 3 1 1 A 86 86 ARG HA H 86 4.452 4.297 0.155 1
1 958 . 3 1 1 A 86 86 ARG C C 86 175.286 176.282 -0.996 1
1 959 . 3 1 1 A 86 86 ARG CA C 86 53.223 55.900 -2.677 1
1 960 . 3 1 1 A 86 86 ARG CB C 86 29.517 30.375 -0.858 1
1 963 . 3 1 1 A 86 86 ARG N N 86 118.339 117.429 0.910 1
1 964 . 3 1 1 A 87 87 GLY H H 87 8.900 8.688 0.212 1
1 965 . 3 1 1 A 87 87 GLY HA2 H 87 4.211 4.038 0.173 1
1 966 . 3 1 1 A 87 87 GLY HA3 H 87 3.967 4.050 -0.083 1
1 967 . 3 1 1 A 87 87 GLY C C 87 168.101 172.877 -4.776 1
1 968 . 3 1 1 A 87 87 GLY CA C 87 42.281 43.935 -1.654 1
1 969 . 3 1 1 A 87 87 GLY N N 87 113.482 108.903 4.579 1
1 970 . 3 1 1 A 88 88 PRO HA H 88 4.563 4.568 -0.005 1
1 977 . 3 1 1 A 88 88 PRO CA C 88 60.994 62.121 -1.127 1
1 978 . 3 1 1 A 88 88 PRO CB C 88 29.873 31.601 -1.728 1
1 981 . 3 1 1 A 89 89 PRO HA H 89 4.490 4.480 0.010 1
1 987 . 3 1 1 A 89 89 PRO C C 89 174.543 176.110 -1.567 1
1 988 . 3 1 1 A 89 89 PRO CA C 89 59.435 62.283 -2.848 1
1 989 . 3 1 1 A 89 89 PRO CB C 89 29.805 32.009 -2.204 1
1 992 . 3 1 1 A 90 90 SER H H 90 8.808 8.278 0.530 1
1 993 . 3 1 1 A 90 90 SER HA H 90 4.202 4.571 -0.369 1
1 996 . 3 1 1 A 90 90 SER C C 90 171.870 173.855 -1.985 1
1 997 . 3 1 1 A 90 90 SER CA C 90 55.868 57.069 -1.201 1
1 998 . 3 1 1 A 90 90 SER CB C 90 64.504 64.936 -0.432 1
1 999 . 3 1 1 A 90 90 SER N N 90 113.781 116.430 -2.649 1
1 1000 . 3 1 1 A 91 91 GLU H H 91 8.291 8.468 -0.177 1
1 1001 . 3 1 1 A 91 91 GLU HA H 91 4.131 4.125 0.006 1
1 1006 . 3 1 1 A 91 91 GLU C C 91 174.882 176.761 -1.879 1
1 1007 . 3 1 1 A 91 91 GLU CA C 91 54.984 57.086 -2.102 1
1 1008 . 3 1 1 A 91 91 GLU CB C 91 27.643 29.356 -1.713 1
1 1010 . 3 1 1 A 91 91 GLU N N 91 117.930 122.749 -4.819 1
1 1011 . 3 1 1 A 92 92 ALA H H 92 8.605 8.279 0.326 1
1 1012 . 3 1 1 A 92 92 ALA HA H 92 5.068 4.381 0.687 1
1 1016 . 3 1 1 A 92 92 ALA C C 92 176.227 177.938 -1.711 1
1 1017 . 3 1 1 A 92 92 ALA CA C 92 48.997 53.042 -4.045 1
1 1018 . 3 1 1 A 92 92 ALA CB C 92 17.756 19.199 -1.443 1
1 1019 . 3 1 1 A 92 92 ALA N N 92 126.421 127.319 -0.898 1
1 1020 . 3 1 1 A 93 93 VAL H H 93 9.051 9.125 -0.074 1
1 1021 . 3 1 1 A 93 93 VAL HA H 93 4.642 5.011 -0.369 1
1 1029 . 3 1 1 A 93 93 VAL C C 93 172.010 174.407 -2.397 1
1 1030 . 3 1 1 A 93 93 VAL CA C 93 57.495 59.243 -1.748 1
1 1031 . 3 1 1 A 93 93 VAL CB C 93 32.774 34.385 -1.611 1
1 1034 . 3 1 1 A 93 93 VAL N N 93 117.322 117.858 -0.536 1
1 1035 . 3 1 1 A 94 94 ARG H H 94 8.470 8.890 -0.420 1
1 1036 . 3 1 1 A 94 94 ARG HA H 94 5.692 5.323 0.369 1
1 1043 . 3 1 1 A 94 94 ARG C C 94 173.635 174.957 -1.322 1
1 1044 . 3 1 1 A 94 94 ARG CA C 94 52.038 54.489 -2.451 1
1 1045 . 3 1 1 A 94 94 ARG CB C 94 30.966 32.055 -1.089 1
1 1048 . 3 1 1 A 94 94 ARG N N 94 122.258 122.455 -0.197 1
1 1049 . 3 1 1 A 95 95 ALA H H 95 9.051 9.150 -0.099 1
1 1050 . 3 1 1 A 95 95 ALA HA H 95 4.642 5.270 -0.628 1
1 1054 . 3 1 1 A 95 95 ALA C C 95 172.285 175.044 -2.759 1
1 1055 . 3 1 1 A 95 95 ALA CA C 95 49.191 50.665 -1.474 1
1 1056 . 3 1 1 A 95 95 ALA CB C 95 22.562 22.284 0.278 1
1 1057 . 3 1 1 A 95 95 ALA N N 95 121.931 126.368 -4.437 1
1 1058 . 3 1 1 A 96 96 ARG H H 96 8.550 8.864 -0.314 1
1 1059 . 3 1 1 A 96 96 ARG HA H 96 5.407 5.154 0.253 1
1 1066 . 3 1 1 A 96 96 ARG C C 96 174.547 176.193 -1.646 1
1 1067 . 3 1 1 A 96 96 ARG CA C 96 51.439 54.964 -3.525 1
1 1068 . 3 1 1 A 96 96 ARG CB C 96 30.708 31.670 -0.962 1
1 1071 . 3 1 1 A 96 96 ARG N N 96 121.155 124.219 -3.064 1
1 1072 . 3 1 1 A 97 97 THR H H 97 8.797 8.921 -0.124 1
1 1073 . 3 1 1 A 97 97 THR HA H 97 4.116 4.519 -0.403 1
1 1078 . 3 1 1 A 97 97 THR C C 97 173.577 174.946 -1.369 1
1 1079 . 3 1 1 A 97 97 THR CA C 97 58.800 61.449 -2.649 1
1 1080 . 3 1 1 A 97 97 THR CB C 97 67.461 69.671 -2.210 1
1 1082 . 3 1 1 A 97 97 THR N N 97 114.657 117.404 -2.747 1
1 1083 . 3 1 1 A 98 98 GLY H H 98 7.505 8.506 -1.001 1
1 1084 . 3 1 1 A 98 98 GLY HA2 H 98 3.866 4.111 -0.245 1
1 1085 . 3 1 1 A 98 98 GLY HA3 H 98 3.743 4.159 -0.416 1
1 1086 . 3 1 1 A 98 98 GLY C C 98 170.637 173.012 -2.375 1
1 1087 . 3 1 1 A 98 98 GLY CA C 98 42.332 44.592 -2.260 1
1 1088 . 3 1 1 A 98 98 GLY N N 98 106.172 108.052 -1.880 1
1 1089 . 3 1 1 A 99 99 GLU H H 99 8.145 8.660 -0.515 1
1 1090 . 3 1 1 A 99 99 GLU HA H 99 4.210 5.208 -0.998 1
1 1095 . 3 1 1 A 99 99 GLU C C 99 174.134 175.207 -1.073 1
1 1096 . 3 1 1 A 99 99 GLU CA C 99 53.828 55.367 -1.539 1
1 1097 . 3 1 1 A 99 99 GLU CB C 99 28.774 32.510 -3.736 1
1 1099 . 3 1 1 A 99 99 GLU N N 99 117.634 117.285 0.349 1
1 1100 . 3 1 1 A 100 100 GLN H H 100 8.647 8.841 -0.194 1
1 1101 . 3 1 1 A 100 100 GLN HA H 100 4.247 4.497 -0.250 1
1 1108 . 3 1 1 A 100 100 GLN C C 100 173.348 174.636 -1.288 1
1 1109 . 3 1 1 A 100 100 GLN CA C 100 53.634 55.704 -2.070 1
1 1110 . 3 1 1 A 100 100 GLN CB C 100 27.392 31.140 -3.748 1
1 1112 . 3 1 1 A 100 100 GLN N N 100 121.960 122.031 -0.071 1
1 1114 . 3 1 1 A 101 101 SER H H 101 8.416 8.759 -0.343 1
1 1115 . 3 1 1 A 101 101 SER HA H 101 4.418 4.029 0.389 1
1 1117 . 3 1 1 A 101 101 SER C C 101 172.148 174.163 -2.015 1
1 1118 . 3 1 1 A 101 101 SER CA C 101 55.926 59.335 -3.409 1
1 1119 . 3 1 1 A 101 101 SER CB C 101 61.617 61.528 0.089 1
1 1120 . 3 1 1 A 101 101 SER N N 101 118.609 121.710 -3.101 1
1 1121 . 3 1 1 A 102 102 GLY H H 102 8.233 8.087 0.146 1
1 1122 . 3 1 1 A 102 102 GLY HA2 H 102 4.080 3.948 0.132 1
1 1123 . 3 1 1 A 102 102 GLY HA3 H 102 3.981 3.976 0.005 1
1 1124 . 3 1 1 A 102 102 GLY C C 102 169.461 173.118 -3.657 1
1 1125 . 3 1 1 A 102 102 GLY CA C 102 42.332 45.211 -2.879 1
1 1126 . 3 1 1 A 102 102 GLY N N 102 110.483 108.594 1.889 1
1 1127 . 3 1 1 A 103 103 PRO HA H 103 4.618 4.408 0.210 1
1 1134 . 3 1 1 A 103 103 PRO CA C 103 57.843 62.908 -5.065 1
1 1135 . 3 1 1 A 103 103 PRO CB C 103 28.671 32.043 -3.372 1
1 1 . 4 1 1 A 6 6 SER HA H 6 4.492 5.109 -0.617 1
1 4 . 4 1 1 A 6 6 SER CA C 6 55.621 56.289 -0.668 1
1 5 . 4 1 1 A 6 6 SER CB C 6 62.104 65.340 -3.236 1
1 6 . 4 1 1 A 7 7 GLY H H 7 8.244 8.685 -0.441 1
1 7 . 4 1 1 A 7 7 GLY HA2 H 7 3.873 4.008 -0.135 1
1 8 . 4 1 1 A 7 7 GLY HA3 H 7 3.737 4.018 -0.281 1
1 9 . 4 1 1 A 7 7 GLY CA C 7 41.743 44.181 -2.438 1
1 10 . 4 1 1 A 7 7 GLY N N 7 109.193 113.838 -4.645 1
1 11 . 4 1 1 A 8 8 PRO HA H 8 4.286 4.495 -0.209 1
1 18 . 4 1 1 A 8 8 PRO C C 8 173.841 175.887 -2.046 1
1 19 . 4 1 1 A 8 8 PRO CA C 8 60.528 62.616 -2.088 1
1 20 . 4 1 1 A 8 8 PRO CB C 8 30.299 32.578 -2.279 1
1 23 . 4 1 1 A 9 9 LYS H H 9 8.877 8.481 0.396 1
1 24 . 4 1 1 A 9 9 LYS HA H 9 4.360 4.741 -0.381 1
1 33 . 4 1 1 A 9 9 LYS C C 9 173.492 174.434 -0.942 1
1 34 . 4 1 1 A 9 9 LYS CA C 9 52.135 53.465 -1.330 1
1 35 . 4 1 1 A 9 9 LYS CB C 9 28.798 31.973 -3.175 1
1 39 . 4 1 1 A 9 9 LYS N N 9 120.404 120.746 -0.342 1
1 40 . 4 1 1 A 10 10 PRO HA H 10 4.284 4.622 -0.338 1
1 47 . 4 1 1 A 10 10 PRO CA C 10 59.326 61.644 -2.318 1
1 48 . 4 1 1 A 10 10 PRO CB C 10 28.825 31.611 -2.786 1
1 51 . 4 1 1 A 11 11 PRO HA H 11 4.468 4.798 -0.330 1
1 58 . 4 1 1 A 11 11 PRO C C 11 171.993 176.429 -4.436 1
1 59 . 4 1 1 A 11 11 PRO CA C 11 60.422 62.720 -2.298 1
1 60 . 4 1 1 A 11 11 PRO CB C 11 30.418 32.603 -2.185 1
1 63 . 4 1 1 A 12 12 ILE H H 12 7.554 8.524 -0.970 1
1 64 . 4 1 1 A 12 12 ILE HA H 12 4.676 4.678 -0.002 1
1 74 . 4 1 1 A 12 12 ILE C C 12 171.721 175.116 -3.395 1
1 75 . 4 1 1 A 12 12 ILE CA C 12 56.843 59.004 -2.161 1
1 76 . 4 1 1 A 12 12 ILE CB C 12 40.560 40.887 -0.327 1
1 80 . 4 1 1 A 12 12 ILE N N 12 109.695 116.747 -7.052 1
1 81 . 4 1 1 A 13 13 ASP H H 13 8.435 9.028 -0.593 1
1 82 . 4 1 1 A 13 13 ASP HA H 13 4.094 4.250 -0.156 1
1 85 . 4 1 1 A 13 13 ASP C C 13 171.803 176.116 -4.313 1
1 86 . 4 1 1 A 13 13 ASP CA C 13 52.610 55.174 -2.564 1
1 87 . 4 1 1 A 13 13 ASP CB C 13 36.357 40.268 -3.911 1
1 88 . 4 1 1 A 13 13 ASP N N 13 116.219 122.070 -5.851 1
1 89 . 4 1 1 A 14 14 LEU H H 14 7.483 8.004 -0.521 1
1 90 . 4 1 1 A 14 14 LEU HA H 14 4.990 4.824 0.166 1
1 100 . 4 1 1 A 14 14 LEU C C 14 174.702 175.399 -0.697 1
1 101 . 4 1 1 A 14 14 LEU CA C 14 53.811 55.100 -1.289 1
1 102 . 4 1 1 A 14 14 LEU CB C 14 40.148 42.379 -2.231 1
1 106 . 4 1 1 A 14 14 LEU N N 14 118.463 121.088 -2.625 1
1 107 . 4 1 1 A 15 15 VAL H H 15 9.209 8.575 0.634 1
1 108 . 4 1 1 A 15 15 VAL HA H 15 4.250 4.764 -0.514 1
1 116 . 4 1 1 A 15 15 VAL C C 15 172.080 174.390 -2.310 1
1 117 . 4 1 1 A 15 15 VAL CA C 15 58.570 60.532 -1.962 1
1 118 . 4 1 1 A 15 15 VAL CB C 15 34.146 36.159 -2.013 1
1 121 . 4 1 1 A 15 15 VAL N N 15 124.833 127.497 -2.664 1
1 122 . 4 1 1 A 16 16 VAL H H 16 8.390 9.015 -0.625 1
1 123 . 4 1 1 A 16 16 VAL HA H 16 4.343 4.363 -0.020 1
1 131 . 4 1 1 A 16 16 VAL C C 16 174.672 175.705 -1.033 1
1 132 . 4 1 1 A 16 16 VAL CA C 16 59.188 61.647 -2.459 1
1 133 . 4 1 1 A 16 16 VAL CB C 16 29.187 32.866 -3.679 1
1 136 . 4 1 1 A 16 16 VAL N N 16 124.654 125.062 -0.408 1
1 137 . 4 1 1 A 17 17 THR H H 17 8.638 8.373 0.265 1
1 138 . 4 1 1 A 17 17 THR HA H 17 4.195 4.461 -0.266 1
1 143 . 4 1 1 A 17 17 THR C C 17 172.661 173.047 -0.386 1
1 144 . 4 1 1 A 17 17 THR CA C 17 60.318 63.496 -3.178 1
1 145 . 4 1 1 A 17 17 THR CB C 17 66.420 71.168 -4.748 1
1 147 . 4 1 1 A 17 17 THR N N 17 120.942 121.899 -0.957 1
1 148 . 4 1 1 A 18 18 GLU H H 18 7.361 7.775 -0.414 1
1 149 . 4 1 1 A 18 18 GLU HA H 18 4.497 4.814 -0.317 1
1 154 . 4 1 1 A 18 18 GLU C C 18 171.691 175.449 -3.758 1
1 155 . 4 1 1 A 18 18 GLU CA C 18 53.687 54.845 -1.158 1
1 156 . 4 1 1 A 18 18 GLU CB C 18 30.802 33.003 -2.201 1
1 158 . 4 1 1 A 18 18 GLU N N 18 119.088 118.823 0.265 1
1 159 . 4 1 1 A 19 19 THR H H 19 8.164 8.744 -0.580 1
1 160 . 4 1 1 A 19 19 THR HA H 19 4.912 5.062 -0.150 1
1 165 . 4 1 1 A 19 19 THR C C 19 171.606 173.173 -1.567 1
1 166 . 4 1 1 A 19 19 THR CA C 19 58.473 60.596 -2.123 1
1 167 . 4 1 1 A 19 19 THR CB C 19 70.103 71.361 -1.258 1
1 169 . 4 1 1 A 19 19 THR N N 19 112.424 113.864 -1.440 1
1 170 . 4 1 1 A 20 20 THR H H 20 8.750 8.961 -0.211 1
1 171 . 4 1 1 A 20 20 THR HA H 20 4.710 4.817 -0.107 1
1 176 . 4 1 1 A 20 20 THR C C 20 172.785 175.319 -2.534 1
1 177 . 4 1 1 A 20 20 THR CA C 20 58.059 60.560 -2.501 1
1 178 . 4 1 1 A 20 20 THR CB C 20 68.782 71.984 -3.202 1
1 180 . 4 1 1 A 20 20 THR N N 20 113.438 118.256 -4.818 1
1 181 . 4 1 1 A 21 21 ALA H H 21 8.453 8.926 -0.473 1
1 182 . 4 1 1 A 21 21 ALA HA H 21 4.079 4.302 -0.223 1
1 186 . 4 1 1 A 21 21 ALA C C 21 174.130 177.891 -3.761 1
1 187 . 4 1 1 A 21 21 ALA CA C 21 52.680 54.968 -2.288 1
1 188 . 4 1 1 A 21 21 ALA CB C 21 16.893 18.645 -1.752 1
1 189 . 4 1 1 A 21 21 ALA N N 21 120.078 124.626 -4.548 1
1 190 . 4 1 1 A 22 22 THR H H 22 7.132 7.546 -0.414 1
1 191 . 4 1 1 A 22 22 THR HA H 22 4.433 4.713 -0.280 1
1 196 . 4 1 1 A 22 22 THR C C 22 171.434 173.456 -2.022 1
1 197 . 4 1 1 A 22 22 THR CA C 22 56.836 60.513 -3.677 1
1 198 . 4 1 1 A 22 22 THR CB C 22 68.772 69.370 -0.598 1
1 200 . 4 1 1 A 22 22 THR N N 22 95.772 104.150 -8.378 1
1 201 . 4 1 1 A 23 23 SER H H 23 7.326 7.753 -0.427 1
1 202 . 4 1 1 A 23 23 SER HA H 23 5.562 5.226 0.336 1
1 205 . 4 1 1 A 23 23 SER C C 23 169.267 172.398 -3.131 1
1 206 . 4 1 1 A 23 23 SER CA C 23 54.445 57.658 -3.213 1
1 207 . 4 1 1 A 23 23 SER CB C 23 65.905 67.083 -1.178 1
1 208 . 4 1 1 A 23 23 SER N N 23 115.757 115.921 -0.164 1
1 209 . 4 1 1 A 24 24 VAL H H 24 7.983 8.367 -0.384 1
1 210 . 4 1 1 A 24 24 VAL HA H 24 4.334 4.653 -0.319 1
1 218 . 4 1 1 A 24 24 VAL C C 24 171.917 174.591 -2.674 1
1 219 . 4 1 1 A 24 24 VAL CA C 24 58.642 60.440 -1.798 1
1 220 . 4 1 1 A 24 24 VAL CB C 24 34.254 35.897 -1.643 1
1 223 . 4 1 1 A 24 24 VAL N N 24 116.595 121.372 -4.777 1
1 224 . 4 1 1 A 25 25 THR H H 25 8.636 8.876 -0.240 1
1 225 . 4 1 1 A 25 25 THR HA H 25 4.833 4.989 -0.156 1
1 230 . 4 1 1 A 25 25 THR C C 25 169.721 172.461 -2.740 1
1 231 . 4 1 1 A 25 25 THR CA C 25 59.699 61.415 -1.716 1
1 232 . 4 1 1 A 25 25 THR CB C 25 67.303 70.593 -3.290 1
1 234 . 4 1 1 A 25 25 THR N N 25 121.690 121.383 0.307 1
1 235 . 4 1 1 A 26 26 LEU H H 26 8.629 9.050 -0.421 1
1 236 . 4 1 1 A 26 26 LEU HA H 26 5.315 5.301 0.014 1
1 246 . 4 1 1 A 26 26 LEU C C 26 173.182 175.328 -2.146 1
1 247 . 4 1 1 A 26 26 LEU CA C 26 50.643 53.446 -2.803 1
1 248 . 4 1 1 A 26 26 LEU CB C 26 43.976 46.327 -2.351 1
1 252 . 4 1 1 A 26 26 LEU N N 26 126.843 129.261 -2.418 1
1 253 . 4 1 1 A 27 27 THR H H 27 8.704 9.009 -0.305 1
1 254 . 4 1 1 A 27 27 THR HA H 27 4.822 5.344 -0.522 1
1 259 . 4 1 1 A 27 27 THR C C 27 169.840 173.708 -3.868 1
1 260 . 4 1 1 A 27 27 THR CA C 27 58.077 59.636 -1.559 1
1 261 . 4 1 1 A 27 27 THR CB C 27 69.666 71.405 -1.739 1
1 263 . 4 1 1 A 27 27 THR N N 27 111.513 116.105 -4.592 1
1 264 . 4 1 1 A 28 28 TRP H H 28 7.339 8.201 -0.862 1
1 265 . 4 1 1 A 28 28 TRP HA H 28 4.963 5.601 -0.638 1
1 274 . 4 1 1 A 28 28 TRP C C 28 170.637 172.567 -1.930 1
1 275 . 4 1 1 A 28 28 TRP CA C 28 54.438 55.357 -0.919 1
1 276 . 4 1 1 A 28 28 TRP CB C 28 27.497 31.682 -4.185 1
1 282 . 4 1 1 A 28 28 TRP N N 28 117.895 119.512 -1.617 1
1 284 . 4 1 1 A 29 29 ASP H H 29 8.696 9.172 -0.476 1
1 285 . 4 1 1 A 29 29 ASP HA H 29 4.971 4.923 0.048 1
1 288 . 4 1 1 A 29 29 ASP C C 29 174.901 177.270 -2.369 1
1 289 . 4 1 1 A 29 29 ASP CA C 29 50.178 52.754 -2.576 1
1 290 . 4 1 1 A 29 29 ASP CB C 29 42.291 42.792 -0.501 1
1 291 . 4 1 1 A 29 29 ASP N N 29 117.477 120.714 -3.237 1
1 292 . 4 1 1 A 30 30 SER H H 30 8.800 8.894 -0.094 1
1 293 . 4 1 1 A 30 30 SER HA H 30 4.389 4.149 0.240 1
1 296 . 4 1 1 A 30 30 SER C C 30 174.032 175.085 -1.053 1
1 297 . 4 1 1 A 30 30 SER CA C 30 58.694 61.959 -3.265 1
1 298 . 4 1 1 A 30 30 SER CB C 30 62.428 63.378 -0.950 1
1 299 . 4 1 1 A 30 30 SER N N 30 118.275 117.694 0.581 1
1 300 . 4 1 1 A 31 31 GLY H H 31 8.759 8.295 0.464 1
1 301 . 4 1 1 A 31 31 GLY HA2 H 31 4.239 4.017 0.222 1
1 302 . 4 1 1 A 31 31 GLY HA3 H 31 3.555 4.054 -0.499 1
1 303 . 4 1 1 A 31 31 GLY C C 31 171.325 174.074 -2.749 1
1 304 . 4 1 1 A 31 31 GLY CA C 31 43.637 45.660 -2.023 1
1 305 . 4 1 1 A 31 31 GLY N N 31 107.961 109.319 -1.358 1
1 306 . 4 1 1 A 32 32 ASN H H 32 8.173 8.316 -0.143 1
1 307 . 4 1 1 A 32 32 ASN HA H 32 4.749 4.985 -0.236 1
1 312 . 4 1 1 A 32 32 ASN C C 32 171.355 174.891 -3.536 1
1 313 . 4 1 1 A 32 32 ASN CA C 32 50.795 53.058 -2.263 1
1 314 . 4 1 1 A 32 32 ASN CB C 32 41.508 39.748 1.760 1
1 315 . 4 1 1 A 32 32 ASN N N 32 117.781 119.880 -2.099 1
1 317 . 4 1 1 A 33 33 SER HA H 33 4.291 4.545 -0.254 1
1 320 . 4 1 1 A 33 33 SER C C 33 172.449 174.193 -1.744 1
1 321 . 4 1 1 A 33 33 SER CA C 33 56.733 58.678 -1.945 1
1 322 . 4 1 1 A 33 33 SER CB C 33 60.884 64.341 -3.457 1
1 323 . 4 1 1 A 34 34 GLU H H 34 7.731 7.554 0.177 1
1 324 . 4 1 1 A 34 34 GLU HA H 34 4.556 4.607 -0.051 1
1 329 . 4 1 1 A 34 34 GLU C C 34 171.792 174.857 -3.065 1
1 330 . 4 1 1 A 34 34 GLU CA C 34 51.818 54.530 -2.712 1
1 331 . 4 1 1 A 34 34 GLU CB C 34 26.891 30.538 -3.647 1
1 333 . 4 1 1 A 34 34 GLU N N 34 122.319 118.794 3.525 1
1 334 . 4 1 1 A 35 35 PRO HA H 35 4.165 4.760 -0.595 1
1 341 . 4 1 1 A 35 35 PRO C C 35 174.288 176.876 -2.588 1
1 342 . 4 1 1 A 35 35 PRO CA C 35 61.374 62.379 -1.005 1
1 343 . 4 1 1 A 35 35 PRO CB C 35 29.887 29.851 0.036 1
1 346 . 4 1 1 A 36 36 VAL H H 36 8.348 8.085 0.263 1
1 347 . 4 1 1 A 36 36 VAL HA H 36 3.899 4.210 -0.311 1
1 355 . 4 1 1 A 36 36 VAL C C 36 173.344 176.631 -3.287 1
1 356 . 4 1 1 A 36 36 VAL CA C 36 59.014 63.204 -4.190 1
1 357 . 4 1 1 A 36 36 VAL CB C 36 31.865 31.764 0.101 1
1 360 . 4 1 1 A 36 36 VAL N N 36 122.051 123.712 -1.661 1
1 361 . 4 1 1 A 37 37 THR H H 37 8.780 8.454 0.326 1
1 362 . 4 1 1 A 37 37 THR HA H 37 3.923 4.267 -0.344 1
1 367 . 4 1 1 A 37 37 THR C C 37 172.171 174.617 -2.446 1
1 368 . 4 1 1 A 37 37 THR CA C 37 63.155 64.346 -1.191 1
1 369 . 4 1 1 A 37 37 THR CB C 37 65.941 69.271 -3.330 1
1 371 . 4 1 1 A 37 37 THR N N 37 122.351 119.204 3.147 1
1 372 . 4 1 1 A 38 38 TYR H H 38 7.304 7.836 -0.532 1
1 373 . 4 1 1 A 38 38 TYR HA H 38 4.439 5.061 -0.622 1
1 380 . 4 1 1 A 38 38 TYR C C 38 168.385 172.425 -4.040 1
1 381 . 4 1 1 A 38 38 TYR CA C 38 54.101 56.589 -2.488 1
1 382 . 4 1 1 A 38 38 TYR CB C 38 35.874 39.930 -4.056 1
1 387 . 4 1 1 A 38 38 TYR N N 38 113.984 115.138 -1.154 1
1 388 . 4 1 1 A 39 39 TYR H H 39 9.445 8.955 0.490 1
1 389 . 4 1 1 A 39 39 TYR HA H 39 5.293 5.326 -0.033 1
1 396 . 4 1 1 A 39 39 TYR C C 39 172.781 176.036 -3.255 1
1 397 . 4 1 1 A 39 39 TYR CA C 39 54.322 56.004 -1.682 1
1 398 . 4 1 1 A 39 39 TYR CB C 39 39.035 40.657 -1.622 1
1 401 . 4 1 1 A 39 39 TYR N N 39 115.092 119.269 -4.177 1
1 402 . 4 1 1 A 40 40 GLY H H 40 8.870 8.643 0.227 1
1 403 . 4 1 1 A 40 40 GLY HA2 H 40 5.137 4.126 1.011 1
1 404 . 4 1 1 A 40 40 GLY HA3 H 40 3.285 4.186 -0.901 1
1 405 . 4 1 1 A 40 40 GLY C C 40 169.688 172.876 -3.188 1
1 406 . 4 1 1 A 40 40 GLY CA C 40 41.415 44.586 -3.171 1
1 407 . 4 1 1 A 40 40 GLY N N 40 106.573 111.931 -5.358 1
1 408 . 4 1 1 A 41 41 ILE H H 41 8.917 8.378 0.539 1
1 409 . 4 1 1 A 41 41 ILE HA H 41 4.527 4.816 -0.289 1
1 419 . 4 1 1 A 41 41 ILE C C 41 172.692 174.534 -1.842 1
1 420 . 4 1 1 A 41 41 ILE CA C 41 57.597 60.036 -2.439 1
1 421 . 4 1 1 A 41 41 ILE CB C 41 37.840 42.228 -4.388 1
1 425 . 4 1 1 A 41 41 ILE N N 41 121.746 120.876 0.870 1
1 426 . 4 1 1 A 42 42 GLN H H 42 9.063 8.869 0.194 1
1 427 . 4 1 1 A 42 42 GLN HA H 42 5.655 5.269 0.386 1
1 434 . 4 1 1 A 42 42 GLN C C 42 172.841 174.368 -1.527 1
1 435 . 4 1 1 A 42 42 GLN CA C 42 50.789 54.430 -3.641 1
1 436 . 4 1 1 A 42 42 GLN CB C 42 28.898 32.299 -3.401 1
1 438 . 4 1 1 A 42 42 GLN N N 42 125.141 125.454 -0.313 1
1 440 . 4 1 1 A 43 43 TYR H H 43 9.066 8.882 0.184 1
1 441 . 4 1 1 A 43 43 TYR HA H 43 5.922 6.101 -0.179 1
1 448 . 4 1 1 A 43 43 TYR C C 43 171.219 173.495 -2.276 1
1 449 . 4 1 1 A 43 43 TYR CA C 43 53.349 56.029 -2.680 1
1 450 . 4 1 1 A 43 43 TYR CB C 43 41.074 42.718 -1.644 1
1 455 . 4 1 1 A 43 43 TYR N N 43 118.018 119.652 -1.634 1
1 456 . 4 1 1 A 44 44 ARG H H 44 8.400 8.783 -0.383 1
1 457 . 4 1 1 A 44 44 ARG HA H 44 4.542 4.682 -0.140 1
1 464 . 4 1 1 A 44 44 ARG C C 44 171.974 174.232 -2.258 1
1 465 . 4 1 1 A 44 44 ARG CA C 44 52.453 55.407 -2.954 1
1 466 . 4 1 1 A 44 44 ARG CB C 44 31.125 33.628 -2.503 1
1 469 . 4 1 1 A 44 44 ARG N N 44 115.214 120.165 -4.951 1
1 470 . 4 1 1 A 45 45 ALA H H 45 8.846 8.279 0.567 1
1 471 . 4 1 1 A 45 45 ALA HA H 45 3.894 2.829 1.065 1
1 475 . 4 1 1 A 45 45 ALA C C 45 175.721 176.681 -0.960 1
1 476 . 4 1 1 A 45 45 ALA CA C 45 50.372 52.230 -1.858 1
1 477 . 4 1 1 A 45 45 ALA CB C 45 15.732 18.672 -2.940 1
1 478 . 4 1 1 A 45 45 ALA N N 45 126.463 126.782 -0.319 1
1 479 . 4 1 1 A 46 46 ALA H H 46 8.282 8.307 -0.025 1
1 480 . 4 1 1 A 46 46 ALA HA H 46 3.922 4.299 -0.377 1
1 484 . 4 1 1 A 46 46 ALA C C 46 176.236 177.412 -1.176 1
1 485 . 4 1 1 A 46 46 ALA CA C 46 50.773 51.706 -0.933 1
1 486 . 4 1 1 A 46 46 ALA CB C 46 16.244 17.405 -1.161 1
1 487 . 4 1 1 A 46 46 ALA N N 46 126.301 124.653 1.648 1
1 488 . 4 1 1 A 47 47 GLY HA2 H 47 3.882 3.984 -0.102 1
1 489 . 4 1 1 A 47 47 GLY HA3 H 47 3.695 4.012 -0.317 1
1 490 . 4 1 1 A 47 47 GLY C C 47 171.795 174.439 -2.644 1
1 491 . 4 1 1 A 47 47 GLY CA C 47 43.327 45.886 -2.559 1
1 492 . 4 1 1 A 48 48 THR H H 48 7.145 8.011 -0.866 1
1 493 . 4 1 1 A 48 48 THR HA H 48 4.417 3.834 0.583 1
1 498 . 4 1 1 A 48 48 THR C C 48 171.325 174.365 -3.040 1
1 499 . 4 1 1 A 48 48 THR CA C 48 58.271 65.405 -7.134 1
1 500 . 4 1 1 A 48 48 THR CB C 48 68.846 68.785 0.061 1
1 502 . 4 1 1 A 48 48 THR N N 48 110.190 116.514 -6.324 1
1 503 . 4 1 1 A 49 49 GLU H H 49 8.346 7.969 0.377 1
1 504 . 4 1 1 A 49 49 GLU HA H 49 4.277 3.944 0.333 1
1 509 . 4 1 1 A 49 49 GLU C C 49 174.109 175.548 -1.439 1
1 510 . 4 1 1 A 49 49 GLU CA C 49 52.909 57.415 -4.506 1
1 511 . 4 1 1 A 49 49 GLU CB C 49 27.845 28.580 -0.735 1
1 513 . 4 1 1 A 49 49 GLU N N 49 119.985 120.372 -0.387 1
1 514 . 4 1 1 A 50 50 GLY H H 50 7.617 8.007 -0.390 1
1 515 . 4 1 1 A 50 50 GLY HA2 H 50 3.935 3.977 -0.042 1
1 516 . 4 1 1 A 50 50 GLY HA3 H 50 3.935 4.033 -0.098 1
1 517 . 4 1 1 A 50 50 GLY C C 50 168.223 172.860 -4.637 1
1 518 . 4 1 1 A 50 50 GLY CA C 50 42.121 44.062 -1.941 1
1 519 . 4 1 1 A 50 50 GLY N N 50 108.670 106.905 1.765 1
1 520 . 4 1 1 A 51 51 PRO HA H 51 4.298 4.650 -0.352 1
1 527 . 4 1 1 A 51 51 PRO C C 51 175.067 177.032 -1.965 1
1 528 . 4 1 1 A 51 51 PRO CA C 51 60.175 62.930 -2.755 1
1 529 . 4 1 1 A 51 51 PRO CB C 51 30.052 31.665 -1.613 1
1 532 . 4 1 1 A 52 52 PHE H H 52 8.442 8.676 -0.234 1
1 533 . 4 1 1 A 52 52 PHE HA H 52 3.981 4.656 -0.675 1
1 541 . 4 1 1 A 52 52 PHE C C 52 175.141 175.721 -0.580 1
1 542 . 4 1 1 A 52 52 PHE CA C 52 56.808 57.779 -0.971 1
1 543 . 4 1 1 A 52 52 PHE CB C 52 36.830 39.657 -2.827 1
1 549 . 4 1 1 A 52 52 PHE N N 52 118.707 122.680 -3.973 1
1 550 . 4 1 1 A 53 53 GLN H H 53 8.778 8.043 0.735 1
1 551 . 4 1 1 A 53 53 GLN HA H 53 4.149 4.275 -0.126 1
1 558 . 4 1 1 A 53 53 GLN C C 53 172.773 175.348 -2.575 1
1 559 . 4 1 1 A 53 53 GLN CA C 53 52.999 56.297 -3.298 1
1 560 . 4 1 1 A 53 53 GLN CB C 53 26.962 29.559 -2.597 1
1 562 . 4 1 1 A 53 53 GLN N N 53 122.164 121.741 0.423 1
1 564 . 4 1 1 A 54 54 GLU H H 54 8.432 8.635 -0.203 1
1 565 . 4 1 1 A 54 54 GLU HA H 54 5.533 4.939 0.594 1
1 570 . 4 1 1 A 54 54 GLU C C 54 173.930 174.812 -0.882 1
1 571 . 4 1 1 A 54 54 GLU CA C 54 52.981 55.339 -2.358 1
1 572 . 4 1 1 A 54 54 GLU CB C 54 31.712 32.957 -1.245 1
1 574 . 4 1 1 A 54 54 GLU N N 54 119.688 120.744 -1.056 1
1 575 . 4 1 1 A 55 55 VAL H H 55 9.077 8.641 0.436 1
1 576 . 4 1 1 A 55 55 VAL HA H 55 4.180 4.892 -0.712 1
1 584 . 4 1 1 A 55 55 VAL C C 55 171.811 174.533 -2.722 1
1 585 . 4 1 1 A 55 55 VAL CA C 55 59.664 61.188 -1.524 1
1 586 . 4 1 1 A 55 55 VAL CB C 55 31.827 34.616 -2.789 1
1 589 . 4 1 1 A 55 55 VAL N N 55 125.328 126.120 -0.792 1
1 590 . 4 1 1 A 56 56 ASP H H 56 8.639 8.840 -0.201 1
1 591 . 4 1 1 A 56 56 ASP HA H 56 5.250 5.563 -0.313 1
1 594 . 4 1 1 A 56 56 ASP C C 56 174.252 175.798 -1.546 1
1 595 . 4 1 1 A 56 56 ASP CA C 56 50.108 52.150 -2.042 1
1 596 . 4 1 1 A 56 56 ASP CB C 56 41.407 44.251 -2.844 1
1 597 . 4 1 1 A 56 56 ASP N N 56 125.773 125.207 0.566 1
1 598 . 4 1 1 A 57 57 GLY H H 57 7.222 8.524 -1.302 1
1 599 . 4 1 1 A 57 57 GLY HA2 H 57 3.479 3.800 -0.321 1
1 600 . 4 1 1 A 57 57 GLY HA3 H 57 2.719 3.869 -1.150 1
1 601 . 4 1 1 A 57 57 GLY C C 57 172.281 174.276 -1.995 1
1 602 . 4 1 1 A 57 57 GLY CA C 57 43.919 44.875 -0.956 1
1 603 . 4 1 1 A 57 57 GLY N N 57 105.564 110.926 -5.362 1
1 604 . 4 1 1 A 58 58 VAL H H 58 8.338 7.921 0.417 1
1 605 . 4 1 1 A 58 58 VAL HA H 58 3.860 4.226 -0.366 1
1 613 . 4 1 1 A 58 58 VAL C C 58 173.981 175.330 -1.349 1
1 614 . 4 1 1 A 58 58 VAL CA C 58 61.233 61.867 -0.634 1
1 615 . 4 1 1 A 58 58 VAL CB C 58 29.708 30.637 -0.929 1
1 618 . 4 1 1 A 58 58 VAL N N 58 121.466 121.857 -0.391 1
1 619 . 4 1 1 A 59 59 ALA H H 59 9.038 8.660 0.378 1
1 620 . 4 1 1 A 59 59 ALA HA H 59 4.676 4.653 0.023 1
1 624 . 4 1 1 A 59 59 ALA C C 59 175.105 176.858 -1.753 1
1 625 . 4 1 1 A 59 59 ALA CA C 59 50.866 51.927 -1.061 1
1 626 . 4 1 1 A 59 59 ALA CB C 59 17.647 19.147 -1.500 1
1 627 . 4 1 1 A 59 59 ALA N N 59 130.928 130.077 0.851 1
1 628 . 4 1 1 A 60 60 THR H H 60 7.445 7.824 -0.379 1
1 629 . 4 1 1 A 60 60 THR HA H 60 4.642 4.729 -0.087 1
1 634 . 4 1 1 A 60 60 THR C C 60 169.528 174.121 -4.593 1
1 635 . 4 1 1 A 60 60 THR CA C 60 57.101 59.327 -2.226 1
1 636 . 4 1 1 A 60 60 THR CB C 60 67.982 72.037 -4.055 1
1 638 . 4 1 1 A 60 60 THR N N 60 109.256 109.126 0.130 1
1 639 . 4 1 1 A 61 61 THR H H 61 7.325 8.423 -1.098 1
1 640 . 4 1 1 A 61 61 THR HA H 61 2.896 3.584 -0.688 1
1 645 . 4 1 1 A 61 61 THR C C 61 169.678 173.160 -3.482 1
1 646 . 4 1 1 A 61 61 THR CA C 61 57.246 61.286 -4.040 1
1 647 . 4 1 1 A 61 61 THR CB C 61 63.794 68.358 -4.564 1
1 649 . 4 1 1 A 61 61 THR N N 61 105.670 110.645 -4.975 1
1 650 . 4 1 1 A 62 62 ARG H H 62 6.490 7.094 -0.604 1
1 651 . 4 1 1 A 62 62 ARG HA H 62 4.698 4.502 0.196 1
1 658 . 4 1 1 A 62 62 ARG C C 62 172.881 173.479 -0.598 1
1 659 . 4 1 1 A 62 62 ARG CA C 62 52.276 55.205 -2.929 1
1 660 . 4 1 1 A 62 62 ARG CB C 62 30.774 33.436 -2.662 1
1 663 . 4 1 1 A 62 62 ARG N N 62 117.485 122.085 -4.600 1
1 664 . 4 1 1 A 63 63 TYR H H 63 8.891 8.636 0.255 1
1 665 . 4 1 1 A 63 63 TYR HA H 63 4.356 5.385 -1.029 1
1 672 . 4 1 1 A 63 63 TYR C C 63 170.393 173.293 -2.900 1
1 673 . 4 1 1 A 63 63 TYR CA C 63 57.284 57.178 0.106 1
1 674 . 4 1 1 A 63 63 TYR CB C 63 41.467 42.614 -1.147 1
1 679 . 4 1 1 A 63 63 TYR N N 63 124.712 127.143 -2.431 1
1 680 . 4 1 1 A 64 64 SER H H 64 7.244 7.908 -0.664 1
1 681 . 4 1 1 A 64 64 SER HA H 64 5.077 5.362 -0.285 1
1 684 . 4 1 1 A 64 64 SER C C 64 169.712 172.637 -2.925 1
1 685 . 4 1 1 A 64 64 SER CA C 64 54.181 55.852 -1.671 1
1 686 . 4 1 1 A 64 64 SER CB C 64 61.122 64.736 -3.614 1
1 687 . 4 1 1 A 64 64 SER N N 64 120.593 120.996 -0.403 1
1 688 . 4 1 1 A 65 65 ILE H H 65 8.686 8.924 -0.238 1
1 689 . 4 1 1 A 65 65 ILE HA H 65 3.937 4.776 -0.839 1
1 699 . 4 1 1 A 65 65 ILE C C 65 172.217 175.410 -3.193 1
1 700 . 4 1 1 A 65 65 ILE CA C 65 58.288 59.615 -1.327 1
1 701 . 4 1 1 A 65 65 ILE CB C 65 36.110 39.667 -3.557 1
1 705 . 4 1 1 A 65 65 ILE N N 65 127.792 127.812 -0.020 1
1 706 . 4 1 1 A 66 66 GLY H H 66 7.883 8.549 -0.666 1
1 707 . 4 1 1 A 66 66 GLY HA2 H 66 4.799 4.318 0.481 1
1 708 . 4 1 1 A 66 66 GLY HA3 H 66 3.468 4.341 -0.873 1
1 709 . 4 1 1 A 66 66 GLY C C 66 171.983 174.002 -2.019 1
1 710 . 4 1 1 A 66 66 GLY CA C 66 40.534 45.102 -4.568 1
1 711 . 4 1 1 A 66 66 GLY N N 66 112.632 112.086 0.546 1
1 712 . 4 1 1 A 67 67 GLY H H 67 8.483 8.268 0.215 1
1 713 . 4 1 1 A 67 67 GLY HA2 H 67 3.836 3.991 -0.155 1
1 714 . 4 1 1 A 67 67 GLY HA3 H 67 3.682 4.015 -0.333 1
1 715 . 4 1 1 A 67 67 GLY C C 67 172.954 174.157 -1.203 1
1 716 . 4 1 1 A 67 67 GLY CA C 67 43.568 45.759 -2.191 1
1 717 . 4 1 1 A 67 67 GLY N N 67 104.625 110.236 -5.611 1
1 718 . 4 1 1 A 68 68 LEU H H 68 8.236 7.843 0.393 1
1 719 . 4 1 1 A 68 68 LEU HA H 68 4.154 4.704 -0.550 1
1 729 . 4 1 1 A 68 68 LEU C C 68 173.838 175.556 -1.718 1
1 730 . 4 1 1 A 68 68 LEU CA C 68 51.025 53.046 -2.021 1
1 731 . 4 1 1 A 68 68 LEU CB C 68 38.837 43.585 -4.748 1
1 735 . 4 1 1 A 68 68 LEU N N 68 118.919 121.226 -2.307 1
1 736 . 4 1 1 A 69 69 SER H H 69 8.284 8.891 -0.607 1
1 737 . 4 1 1 A 69 69 SER HA H 69 4.765 5.087 -0.322 1
1 740 . 4 1 1 A 69 69 SER C C 69 170.044 172.931 -2.887 1
1 741 . 4 1 1 A 69 69 SER CA C 69 54.639 54.920 -0.281 1
1 742 . 4 1 1 A 69 69 SER CB C 69 61.216 64.000 -2.784 1
1 743 . 4 1 1 A 69 69 SER N N 69 116.361 117.200 -0.839 1
1 744 . 4 1 1 A 70 70 PRO HA H 70 5.141 4.599 0.542 1
1 751 . 4 1 1 A 70 70 PRO C C 70 174.858 177.470 -2.612 1
1 752 . 4 1 1 A 70 70 PRO CA C 70 60.810 64.015 -3.205 1
1 753 . 4 1 1 A 70 70 PRO CB C 70 30.657 31.752 -1.095 1
1 756 . 4 1 1 A 71 71 PHE H H 71 8.139 9.062 -0.923 1
1 757 . 4 1 1 A 71 71 PHE HA H 71 4.202 4.312 -0.110 1
1 765 . 4 1 1 A 71 71 PHE C C 71 172.870 174.419 -1.549 1
1 766 . 4 1 1 A 71 71 PHE CA C 71 55.410 59.065 -3.655 1
1 767 . 4 1 1 A 71 71 PHE CB C 71 36.027 37.700 -1.673 1
1 773 . 4 1 1 A 71 71 PHE N N 71 125.409 122.938 2.471 1
1 774 . 4 1 1 A 72 72 SER H H 72 8.182 7.324 0.858 1
1 775 . 4 1 1 A 72 72 SER HA H 72 4.755 4.996 -0.241 1
1 778 . 4 1 1 A 72 72 SER C C 72 168.850 172.720 -3.870 1
1 779 . 4 1 1 A 72 72 SER CA C 72 55.926 56.421 -0.495 1
1 780 . 4 1 1 A 72 72 SER CB C 72 64.208 66.811 -2.603 1
1 781 . 4 1 1 A 72 72 SER N N 72 113.509 110.436 3.073 1
1 782 . 4 1 1 A 73 73 GLU H H 73 8.422 8.741 -0.319 1
1 783 . 4 1 1 A 73 73 GLU HA H 73 4.966 5.141 -0.175 1
1 788 . 4 1 1 A 73 73 GLU C C 73 173.192 174.690 -1.498 1
1 789 . 4 1 1 A 73 73 GLU CA C 73 52.815 54.967 -2.152 1
1 790 . 4 1 1 A 73 73 GLU CB C 73 29.416 32.653 -3.237 1
1 792 . 4 1 1 A 73 73 GLU N N 73 123.046 122.454 0.592 1
1 793 . 4 1 1 A 74 74 TYR H H 74 9.205 8.821 0.384 1
1 794 . 4 1 1 A 74 74 TYR HA H 74 4.799 5.110 -0.311 1
1 801 . 4 1 1 A 74 74 TYR C C 74 170.775 174.174 -3.399 1
1 802 . 4 1 1 A 74 74 TYR CA C 74 55.291 56.813 -1.522 1
1 803 . 4 1 1 A 74 74 TYR CB C 74 42.943 42.677 0.266 1
1 808 . 4 1 1 A 74 74 TYR N N 74 125.351 124.648 0.703 1
1 809 . 4 1 1 A 75 75 ALA H H 75 8.639 8.406 0.233 1
1 810 . 4 1 1 A 75 75 ALA HA H 75 5.271 5.434 -0.163 1
1 814 . 4 1 1 A 75 75 ALA C C 75 173.698 175.641 -1.943 1
1 815 . 4 1 1 A 75 75 ALA CA C 75 47.904 50.237 -2.333 1
1 816 . 4 1 1 A 75 75 ALA CB C 75 19.634 21.159 -1.525 1
1 817 . 4 1 1 A 75 75 ALA N N 75 121.555 123.927 -2.372 1
1 818 . 4 1 1 A 76 76 PHE H H 76 9.066 9.489 -0.423 1
1 819 . 4 1 1 A 76 76 PHE HA H 76 5.496 5.304 0.192 1
1 827 . 4 1 1 A 76 76 PHE C C 76 172.268 175.236 -2.968 1
1 828 . 4 1 1 A 76 76 PHE CA C 76 54.216 56.706 -2.490 1
1 829 . 4 1 1 A 76 76 PHE CB C 76 41.901 41.929 -0.028 1
1 835 . 4 1 1 A 76 76 PHE N N 76 116.545 122.264 -5.719 1
1 836 . 4 1 1 A 77 77 ARG H H 77 9.216 8.762 0.454 1
1 837 . 4 1 1 A 77 77 ARG HA H 77 4.357 5.179 -0.822 1
1 845 . 4 1 1 A 77 77 ARG C C 77 169.998 174.148 -4.150 1
1 846 . 4 1 1 A 77 77 ARG CA C 77 52.414 54.741 -2.327 1
1 847 . 4 1 1 A 77 77 ARG CB C 77 30.794 34.003 -3.209 1
1 850 . 4 1 1 A 77 77 ARG N N 77 115.738 119.252 -3.514 1
1 852 . 4 1 1 A 78 78 VAL H H 78 8.135 8.854 -0.719 1
1 853 . 4 1 1 A 78 78 VAL HA H 78 4.884 4.759 0.125 1
1 861 . 4 1 1 A 78 78 VAL C C 78 171.098 174.529 -3.431 1
1 862 . 4 1 1 A 78 78 VAL CA C 78 57.566 60.689 -3.123 1
1 863 . 4 1 1 A 78 78 VAL CB C 78 33.146 33.622 -0.476 1
1 866 . 4 1 1 A 78 78 VAL N N 78 117.942 123.788 -5.846 1
1 867 . 4 1 1 A 79 79 LEU H H 79 9.167 8.255 0.912 1
1 868 . 4 1 1 A 79 79 LEU HA H 79 4.575 4.931 -0.356 1
1 878 . 4 1 1 A 79 79 LEU C C 79 171.447 174.923 -3.476 1
1 879 . 4 1 1 A 79 79 LEU CA C 79 51.642 53.564 -1.922 1
1 880 . 4 1 1 A 79 79 LEU CB C 79 42.776 45.678 -2.902 1
1 884 . 4 1 1 A 79 79 LEU N N 79 123.913 119.238 4.675 1
1 885 . 4 1 1 A 80 80 ALA H H 80 9.325 8.610 0.715 1
1 886 . 4 1 1 A 80 80 ALA HA H 80 4.654 3.730 0.924 1
1 890 . 4 1 1 A 80 80 ALA C C 80 172.070 177.265 -5.195 1
1 891 . 4 1 1 A 80 80 ALA CA C 80 48.169 51.787 -3.618 1
1 892 . 4 1 1 A 80 80 ALA CB C 80 20.366 19.260 1.106 1
1 893 . 4 1 1 A 80 80 ALA N N 80 124.135 124.439 -0.304 1
1 894 . 4 1 1 A 81 81 VAL H H 81 7.953 8.005 -0.052 1
1 895 . 4 1 1 A 81 81 VAL HA H 81 4.293 4.717 -0.424 1
1 903 . 4 1 1 A 81 81 VAL C C 81 172.873 174.713 -1.840 1
1 904 . 4 1 1 A 81 81 VAL CA C 81 58.959 60.672 -1.713 1
1 905 . 4 1 1 A 81 81 VAL CB C 81 31.412 34.708 -3.296 1
1 908 . 4 1 1 A 81 81 VAL N N 81 118.503 121.136 -2.633 1
1 909 . 4 1 1 A 82 82 ASN H H 82 8.262 8.412 -0.150 1
1 910 . 4 1 1 A 82 82 ASN HA H 82 4.945 5.046 -0.101 1
1 915 . 4 1 1 A 82 82 ASN C C 82 173.273 175.715 -2.442 1
1 916 . 4 1 1 A 82 82 ASN CA C 82 48.714 51.273 -2.559 1
1 917 . 4 1 1 A 82 82 ASN CB C 82 36.796 40.371 -3.575 1
1 918 . 4 1 1 A 82 82 ASN N N 82 125.425 124.851 0.574 1
1 920 . 4 1 1 A 83 83 SER HA H 83 3.966 4.052 -0.086 1
1 923 . 4 1 1 A 83 83 SER C C 83 172.812 176.654 -3.842 1
1 924 . 4 1 1 A 83 83 SER CA C 83 59.047 62.494 -3.447 1
1 925 . 4 1 1 A 83 83 SER CB C 83 60.406 62.872 -2.466 1
1 926 . 4 1 1 A 84 84 ILE H H 84 7.803 7.947 -0.144 1
1 927 . 4 1 1 A 84 84 ILE HA H 84 3.862 3.747 0.115 1
1 937 . 4 1 1 A 84 84 ILE C C 84 174.481 176.153 -1.672 1
1 938 . 4 1 1 A 84 84 ILE CA C 84 59.188 64.169 -4.981 1
1 939 . 4 1 1 A 84 84 ILE CB C 84 34.677 38.143 -3.466 1
1 943 . 4 1 1 A 84 84 ILE N N 84 121.222 119.890 1.332 1
1 944 . 4 1 1 A 85 85 GLY H H 85 7.435 7.269 0.166 1
1 945 . 4 1 1 A 85 85 GLY HA2 H 85 4.149 4.035 0.114 1
1 946 . 4 1 1 A 85 85 GLY HA3 H 85 3.747 4.039 -0.292 1
1 947 . 4 1 1 A 85 85 GLY C C 85 168.589 172.033 -3.444 1
1 948 . 4 1 1 A 85 85 GLY CA C 85 42.931 45.384 -2.453 1
1 949 . 4 1 1 A 85 85 GLY N N 85 106.320 105.748 0.572 1
1 950 . 4 1 1 A 86 86 ARG H H 86 8.190 8.387 -0.197 1
1 951 . 4 1 1 A 86 86 ARG HA H 86 4.452 4.554 -0.102 1
1 958 . 4 1 1 A 86 86 ARG C C 86 175.286 176.270 -0.984 1
1 959 . 4 1 1 A 86 86 ARG CA C 86 53.223 55.377 -2.154 1
1 960 . 4 1 1 A 86 86 ARG CB C 86 29.517 31.010 -1.493 1
1 963 . 4 1 1 A 86 86 ARG N N 86 118.339 117.258 1.081 1
1 964 . 4 1 1 A 87 87 GLY H H 87 8.900 8.924 -0.024 1
1 965 . 4 1 1 A 87 87 GLY HA2 H 87 4.211 4.036 0.175 1
1 966 . 4 1 1 A 87 87 GLY HA3 H 87 3.967 4.049 -0.082 1
1 967 . 4 1 1 A 87 87 GLY C C 87 168.101 172.859 -4.758 1
1 968 . 4 1 1 A 87 87 GLY CA C 87 42.281 43.949 -1.668 1
1 969 . 4 1 1 A 87 87 GLY N N 87 113.482 108.930 4.552 1
1 970 . 4 1 1 A 88 88 PRO HA H 88 4.563 4.565 -0.002 1
1 977 . 4 1 1 A 88 88 PRO CA C 88 60.994 62.124 -1.130 1
1 978 . 4 1 1 A 88 88 PRO CB C 88 29.873 31.651 -1.778 1
1 981 . 4 1 1 A 89 89 PRO HA H 89 4.490 4.511 -0.021 1
1 987 . 4 1 1 A 89 89 PRO C C 89 174.543 176.070 -1.527 1
1 988 . 4 1 1 A 89 89 PRO CA C 89 59.435 62.385 -2.950 1
1 989 . 4 1 1 A 89 89 PRO CB C 89 29.805 32.143 -2.338 1
1 992 . 4 1 1 A 90 90 SER H H 90 8.808 8.358 0.450 1
1 993 . 4 1 1 A 90 90 SER HA H 90 4.202 4.644 -0.442 1
1 996 . 4 1 1 A 90 90 SER C C 90 171.870 173.894 -2.024 1
1 997 . 4 1 1 A 90 90 SER CA C 90 55.868 57.173 -1.305 1
1 998 . 4 1 1 A 90 90 SER CB C 90 64.504 64.804 -0.300 1
1 999 . 4 1 1 A 90 90 SER N N 90 113.781 116.664 -2.883 1
1 1000 . 4 1 1 A 91 91 GLU H H 91 8.291 8.587 -0.296 1
1 1001 . 4 1 1 A 91 91 GLU HA H 91 4.131 4.206 -0.075 1
1 1006 . 4 1 1 A 91 91 GLU C C 91 174.882 176.386 -1.504 1
1 1007 . 4 1 1 A 91 91 GLU CA C 91 54.984 56.950 -1.966 1
1 1008 . 4 1 1 A 91 91 GLU CB C 91 27.643 29.779 -2.136 1
1 1010 . 4 1 1 A 91 91 GLU N N 91 117.930 123.174 -5.244 1
1 1011 . 4 1 1 A 92 92 ALA H H 92 8.605 8.315 0.290 1
1 1012 . 4 1 1 A 92 92 ALA HA H 92 5.068 4.396 0.672 1
1 1016 . 4 1 1 A 92 92 ALA C C 92 176.227 177.593 -1.366 1
1 1017 . 4 1 1 A 92 92 ALA CA C 92 48.997 52.758 -3.761 1
1 1018 . 4 1 1 A 92 92 ALA CB C 92 17.756 19.143 -1.387 1
1 1019 . 4 1 1 A 92 92 ALA N N 92 126.421 127.189 -0.768 1
1 1020 . 4 1 1 A 93 93 VAL H H 93 9.051 8.990 0.061 1
1 1021 . 4 1 1 A 93 93 VAL HA H 93 4.642 4.976 -0.334 1
1 1029 . 4 1 1 A 93 93 VAL C C 93 172.010 174.816 -2.806 1
1 1030 . 4 1 1 A 93 93 VAL CA C 93 57.495 60.232 -2.737 1
1 1031 . 4 1 1 A 93 93 VAL CB C 93 32.774 34.291 -1.517 1
1 1034 . 4 1 1 A 93 93 VAL N N 93 117.322 118.563 -1.241 1
1 1035 . 4 1 1 A 94 94 ARG H H 94 8.470 8.925 -0.455 1
1 1036 . 4 1 1 A 94 94 ARG HA H 94 5.692 5.230 0.462 1
1 1043 . 4 1 1 A 94 94 ARG C C 94 173.635 175.504 -1.869 1
1 1044 . 4 1 1 A 94 94 ARG CA C 94 52.038 55.254 -3.216 1
1 1045 . 4 1 1 A 94 94 ARG CB C 94 30.966 31.450 -0.484 1
1 1048 . 4 1 1 A 94 94 ARG N N 94 122.258 125.082 -2.824 1
1 1049 . 4 1 1 A 95 95 ALA H H 95 9.051 9.279 -0.228 1
1 1050 . 4 1 1 A 95 95 ALA HA H 95 4.642 5.269 -0.627 1
1 1054 . 4 1 1 A 95 95 ALA C C 95 172.285 175.376 -3.091 1
1 1055 . 4 1 1 A 95 95 ALA CA C 95 49.191 50.689 -1.498 1
1 1056 . 4 1 1 A 95 95 ALA CB C 95 22.562 22.186 0.376 1
1 1057 . 4 1 1 A 95 95 ALA N N 95 121.931 127.119 -5.188 1
1 1058 . 4 1 1 A 96 96 ARG H H 96 8.550 8.755 -0.205 1
1 1059 . 4 1 1 A 96 96 ARG HA H 96 5.407 5.142 0.265 1
1 1066 . 4 1 1 A 96 96 ARG C C 96 174.547 176.286 -1.739 1
1 1067 . 4 1 1 A 96 96 ARG CA C 96 51.439 55.277 -3.838 1
1 1068 . 4 1 1 A 96 96 ARG CB C 96 30.708 31.626 -0.918 1
1 1071 . 4 1 1 A 96 96 ARG N N 96 121.155 124.664 -3.509 1
1 1072 . 4 1 1 A 97 97 THR H H 97 8.797 8.888 -0.091 1
1 1073 . 4 1 1 A 97 97 THR HA H 97 4.116 4.674 -0.558 1
1 1078 . 4 1 1 A 97 97 THR C C 97 173.577 175.114 -1.537 1
1 1079 . 4 1 1 A 97 97 THR CA C 97 58.800 60.951 -2.151 1
1 1080 . 4 1 1 A 97 97 THR CB C 97 67.461 69.502 -2.041 1
1 1082 . 4 1 1 A 97 97 THR N N 97 114.657 116.992 -2.335 1
1 1083 . 4 1 1 A 98 98 GLY H H 98 7.505 8.462 -0.957 1
1 1084 . 4 1 1 A 98 98 GLY HA2 H 98 3.866 4.122 -0.256 1
1 1085 . 4 1 1 A 98 98 GLY HA3 H 98 3.743 4.184 -0.441 1
1 1086 . 4 1 1 A 98 98 GLY C C 98 170.637 173.204 -2.567 1
1 1087 . 4 1 1 A 98 98 GLY CA C 98 42.332 44.580 -2.248 1
1 1088 . 4 1 1 A 98 98 GLY N N 98 106.172 108.275 -2.103 1
1 1089 . 4 1 1 A 99 99 GLU H H 99 8.145 8.501 -0.356 1
1 1090 . 4 1 1 A 99 99 GLU HA H 99 4.210 4.593 -0.383 1
1 1095 . 4 1 1 A 99 99 GLU C C 99 174.134 175.711 -1.577 1
1 1096 . 4 1 1 A 99 99 GLU CA C 99 53.828 56.296 -2.468 1
1 1097 . 4 1 1 A 99 99 GLU CB C 99 28.774 31.289 -2.515 1
1 1099 . 4 1 1 A 99 99 GLU N N 99 117.634 119.148 -1.514 1
1 1100 . 4 1 1 A 100 100 GLN H H 100 8.647 8.475 0.172 1
1 1101 . 4 1 1 A 100 100 GLN HA H 100 4.247 4.690 -0.443 1
1 1108 . 4 1 1 A 100 100 GLN C C 100 173.348 174.303 -0.955 1
1 1109 . 4 1 1 A 100 100 GLN CA C 100 53.634 55.333 -1.699 1
1 1110 . 4 1 1 A 100 100 GLN CB C 100 27.392 33.089 -5.697 1
1 1112 . 4 1 1 A 100 100 GLN N N 100 121.960 120.982 0.978 1
1 1114 . 4 1 1 A 101 101 SER H H 101 8.416 9.002 -0.586 1
1 1115 . 4 1 1 A 101 101 SER HA H 101 4.418 4.535 -0.117 1
1 1117 . 4 1 1 A 101 101 SER C C 101 172.148 174.814 -2.666 1
1 1118 . 4 1 1 A 101 101 SER CA C 101 55.926 58.085 -2.159 1
1 1119 . 4 1 1 A 101 101 SER CB C 101 61.617 61.186 0.431 1
1 1120 . 4 1 1 A 101 101 SER N N 101 118.609 120.229 -1.620 1
1 1121 . 4 1 1 A 102 102 GLY H H 102 8.233 8.370 -0.137 1
1 1122 . 4 1 1 A 102 102 GLY HA2 H 102 4.080 4.081 -0.001 1
1 1123 . 4 1 1 A 102 102 GLY HA3 H 102 3.981 4.086 -0.105 1
1 1124 . 4 1 1 A 102 102 GLY C C 102 169.461 173.375 -3.914 1
1 1125 . 4 1 1 A 102 102 GLY CA C 102 42.332 45.559 -3.227 1
1 1126 . 4 1 1 A 102 102 GLY N N 102 110.483 109.592 0.891 1
1 1127 . 4 1 1 A 103 103 PRO HA H 103 4.618 4.780 -0.162 1
1 1134 . 4 1 1 A 103 103 PRO CA C 103 57.843 62.569 -4.726 1
1 1135 . 4 1 1 A 103 103 PRO CB C 103 28.671 30.308 -1.637 1
1 1 . 5 1 1 A 6 6 SER HA H 6 4.492 4.993 -0.501 1
1 4 . 5 1 1 A 6 6 SER CA C 6 55.621 56.215 -0.594 1
1 5 . 5 1 1 A 6 6 SER CB C 6 62.104 65.815 -3.711 1
1 6 . 5 1 1 A 7 7 GLY H H 7 8.244 8.572 -0.328 1
1 7 . 5 1 1 A 7 7 GLY HA2 H 7 3.873 3.997 -0.124 1
1 8 . 5 1 1 A 7 7 GLY HA3 H 7 3.737 4.006 -0.269 1
1 9 . 5 1 1 A 7 7 GLY CA C 7 41.743 44.590 -2.847 1
1 10 . 5 1 1 A 7 7 GLY N N 7 109.193 110.130 -0.937 1
1 11 . 5 1 1 A 8 8 PRO HA H 8 4.286 4.572 -0.286 1
1 18 . 5 1 1 A 8 8 PRO C C 8 173.841 175.999 -2.158 1
1 19 . 5 1 1 A 8 8 PRO CA C 8 60.528 62.611 -2.083 1
1 20 . 5 1 1 A 8 8 PRO CB C 8 30.299 32.545 -2.246 1
1 23 . 5 1 1 A 9 9 LYS H H 9 8.877 8.728 0.149 1
1 24 . 5 1 1 A 9 9 LYS HA H 9 4.360 4.762 -0.402 1
1 33 . 5 1 1 A 9 9 LYS C C 9 173.492 174.485 -0.993 1
1 34 . 5 1 1 A 9 9 LYS CA C 9 52.135 53.577 -1.442 1
1 35 . 5 1 1 A 9 9 LYS CB C 9 28.798 31.927 -3.129 1
1 39 . 5 1 1 A 9 9 LYS N N 9 120.404 121.129 -0.725 1
1 40 . 5 1 1 A 10 10 PRO HA H 10 4.284 4.639 -0.355 1
1 47 . 5 1 1 A 10 10 PRO CA C 10 59.326 61.644 -2.318 1
1 48 . 5 1 1 A 10 10 PRO CB C 10 28.825 31.606 -2.781 1
1 51 . 5 1 1 A 11 11 PRO HA H 11 4.468 4.784 -0.316 1
1 58 . 5 1 1 A 11 11 PRO C C 11 171.993 176.502 -4.509 1
1 59 . 5 1 1 A 11 11 PRO CA C 11 60.422 62.814 -2.392 1
1 60 . 5 1 1 A 11 11 PRO CB C 11 30.418 32.772 -2.354 1
1 63 . 5 1 1 A 12 12 ILE H H 12 7.554 8.016 -0.462 1
1 64 . 5 1 1 A 12 12 ILE HA H 12 4.676 4.562 0.114 1
1 74 . 5 1 1 A 12 12 ILE C C 12 171.721 175.134 -3.413 1
1 75 . 5 1 1 A 12 12 ILE CA C 12 56.843 59.044 -2.201 1
1 76 . 5 1 1 A 12 12 ILE CB C 12 40.560 40.488 0.072 1
1 80 . 5 1 1 A 12 12 ILE N N 12 109.695 117.252 -7.557 1
1 81 . 5 1 1 A 13 13 ASP H H 13 8.435 9.026 -0.591 1
1 82 . 5 1 1 A 13 13 ASP HA H 13 4.094 4.237 -0.143 1
1 85 . 5 1 1 A 13 13 ASP C C 13 171.803 176.154 -4.351 1
1 86 . 5 1 1 A 13 13 ASP CA C 13 52.610 54.893 -2.283 1
1 87 . 5 1 1 A 13 13 ASP CB C 13 36.357 39.694 -3.337 1
1 88 . 5 1 1 A 13 13 ASP N N 13 116.219 122.191 -5.972 1
1 89 . 5 1 1 A 14 14 LEU H H 14 7.483 7.944 -0.461 1
1 90 . 5 1 1 A 14 14 LEU HA H 14 4.990 5.023 -0.033 1
1 100 . 5 1 1 A 14 14 LEU C C 14 174.702 175.432 -0.730 1
1 101 . 5 1 1 A 14 14 LEU CA C 14 53.811 54.649 -0.838 1
1 102 . 5 1 1 A 14 14 LEU CB C 14 40.148 42.287 -2.139 1
1 106 . 5 1 1 A 14 14 LEU N N 14 118.463 120.969 -2.506 1
1 107 . 5 1 1 A 15 15 VAL H H 15 9.209 8.601 0.608 1
1 108 . 5 1 1 A 15 15 VAL HA H 15 4.250 4.689 -0.439 1
1 116 . 5 1 1 A 15 15 VAL C C 15 172.080 174.220 -2.140 1
1 117 . 5 1 1 A 15 15 VAL CA C 15 58.570 60.445 -1.875 1
1 118 . 5 1 1 A 15 15 VAL CB C 15 34.146 35.960 -1.814 1
1 121 . 5 1 1 A 15 15 VAL N N 15 124.833 126.887 -2.054 1
1 122 . 5 1 1 A 16 16 VAL H H 16 8.390 9.037 -0.647 1
1 123 . 5 1 1 A 16 16 VAL HA H 16 4.343 4.389 -0.046 1
1 131 . 5 1 1 A 16 16 VAL C C 16 174.672 175.938 -1.266 1
1 132 . 5 1 1 A 16 16 VAL CA C 16 59.188 62.419 -3.231 1
1 133 . 5 1 1 A 16 16 VAL CB C 16 29.187 32.155 -2.968 1
1 136 . 5 1 1 A 16 16 VAL N N 16 124.654 125.824 -1.170 1
1 137 . 5 1 1 A 17 17 THR H H 17 8.638 8.850 -0.212 1
1 138 . 5 1 1 A 17 17 THR HA H 17 4.195 4.434 -0.239 1
1 143 . 5 1 1 A 17 17 THR C C 17 172.661 173.599 -0.938 1
1 144 . 5 1 1 A 17 17 THR CA C 17 60.318 63.330 -3.012 1
1 145 . 5 1 1 A 17 17 THR CB C 17 66.420 70.630 -4.210 1
1 147 . 5 1 1 A 17 17 THR N N 17 120.942 122.674 -1.732 1
1 148 . 5 1 1 A 18 18 GLU H H 18 7.361 7.651 -0.290 1
1 149 . 5 1 1 A 18 18 GLU HA H 18 4.497 4.716 -0.219 1
1 154 . 5 1 1 A 18 18 GLU C C 18 171.691 174.825 -3.134 1
1 155 . 5 1 1 A 18 18 GLU CA C 18 53.687 55.224 -1.537 1
1 156 . 5 1 1 A 18 18 GLU CB C 18 30.802 33.996 -3.194 1
1 158 . 5 1 1 A 18 18 GLU N N 18 119.088 118.353 0.735 1
1 159 . 5 1 1 A 19 19 THR H H 19 8.164 8.630 -0.466 1
1 160 . 5 1 1 A 19 19 THR HA H 19 4.912 5.119 -0.207 1
1 165 . 5 1 1 A 19 19 THR C C 19 171.606 173.045 -1.439 1
1 166 . 5 1 1 A 19 19 THR CA C 19 58.473 60.488 -2.015 1
1 167 . 5 1 1 A 19 19 THR CB C 19 70.103 71.440 -1.337 1
1 169 . 5 1 1 A 19 19 THR N N 19 112.424 113.709 -1.285 1
1 170 . 5 1 1 A 20 20 THR H H 20 8.750 9.006 -0.256 1
1 171 . 5 1 1 A 20 20 THR HA H 20 4.710 4.826 -0.116 1
1 176 . 5 1 1 A 20 20 THR C C 20 172.785 175.335 -2.550 1
1 177 . 5 1 1 A 20 20 THR CA C 20 58.059 60.620 -2.561 1
1 178 . 5 1 1 A 20 20 THR CB C 20 68.782 71.714 -2.932 1
1 180 . 5 1 1 A 20 20 THR N N 20 113.438 118.168 -4.730 1
1 181 . 5 1 1 A 21 21 ALA H H 21 8.453 8.936 -0.483 1
1 182 . 5 1 1 A 21 21 ALA HA H 21 4.079 4.495 -0.416 1
1 186 . 5 1 1 A 21 21 ALA C C 21 174.130 177.891 -3.761 1
1 187 . 5 1 1 A 21 21 ALA CA C 21 52.680 55.269 -2.589 1
1 188 . 5 1 1 A 21 21 ALA CB C 21 16.893 18.537 -1.644 1
1 189 . 5 1 1 A 21 21 ALA N N 21 120.078 124.598 -4.520 1
1 190 . 5 1 1 A 22 22 THR H H 22 7.132 7.532 -0.400 1
1 191 . 5 1 1 A 22 22 THR HA H 22 4.433 4.723 -0.290 1
1 196 . 5 1 1 A 22 22 THR C C 22 171.434 173.322 -1.888 1
1 197 . 5 1 1 A 22 22 THR CA C 22 56.836 60.412 -3.576 1
1 198 . 5 1 1 A 22 22 THR CB C 22 68.772 69.312 -0.540 1
1 200 . 5 1 1 A 22 22 THR N N 22 95.772 104.118 -8.346 1
1 201 . 5 1 1 A 23 23 SER H H 23 7.326 7.799 -0.473 1
1 202 . 5 1 1 A 23 23 SER HA H 23 5.562 5.386 0.176 1
1 205 . 5 1 1 A 23 23 SER C C 23 169.267 172.684 -3.417 1
1 206 . 5 1 1 A 23 23 SER CA C 23 54.445 57.663 -3.218 1
1 207 . 5 1 1 A 23 23 SER CB C 23 65.905 67.745 -1.840 1
1 208 . 5 1 1 A 23 23 SER N N 23 115.757 116.076 -0.319 1
1 209 . 5 1 1 A 24 24 VAL H H 24 7.983 8.471 -0.488 1
1 210 . 5 1 1 A 24 24 VAL HA H 24 4.334 4.743 -0.409 1
1 218 . 5 1 1 A 24 24 VAL C C 24 171.917 174.533 -2.616 1
1 219 . 5 1 1 A 24 24 VAL CA C 24 58.642 60.633 -1.991 1
1 220 . 5 1 1 A 24 24 VAL CB C 24 34.254 35.934 -1.680 1
1 223 . 5 1 1 A 24 24 VAL N N 24 116.595 121.514 -4.919 1
1 224 . 5 1 1 A 25 25 THR H H 25 8.636 9.008 -0.372 1
1 225 . 5 1 1 A 25 25 THR HA H 25 4.833 4.912 -0.079 1
1 230 . 5 1 1 A 25 25 THR C C 25 169.721 172.551 -2.830 1
1 231 . 5 1 1 A 25 25 THR CA C 25 59.699 61.538 -1.839 1
1 232 . 5 1 1 A 25 25 THR CB C 25 67.303 70.312 -3.009 1
1 234 . 5 1 1 A 25 25 THR N N 25 121.690 122.467 -0.777 1
1 235 . 5 1 1 A 26 26 LEU H H 26 8.629 8.664 -0.035 1
1 236 . 5 1 1 A 26 26 LEU HA H 26 5.315 5.352 -0.037 1
1 246 . 5 1 1 A 26 26 LEU C C 26 173.182 175.317 -2.135 1
1 247 . 5 1 1 A 26 26 LEU CA C 26 50.643 53.503 -2.860 1
1 248 . 5 1 1 A 26 26 LEU CB C 26 43.976 45.965 -1.989 1
1 252 . 5 1 1 A 26 26 LEU N N 26 126.843 129.570 -2.727 1
1 253 . 5 1 1 A 27 27 THR H H 27 8.704 8.983 -0.279 1
1 254 . 5 1 1 A 27 27 THR HA H 27 4.822 5.404 -0.582 1
1 259 . 5 1 1 A 27 27 THR C C 27 169.840 173.718 -3.878 1
1 260 . 5 1 1 A 27 27 THR CA C 27 58.077 59.652 -1.575 1
1 261 . 5 1 1 A 27 27 THR CB C 27 69.666 71.322 -1.656 1
1 263 . 5 1 1 A 27 27 THR N N 27 111.513 116.949 -5.436 1
1 264 . 5 1 1 A 28 28 TRP H H 28 7.339 8.089 -0.750 1
1 265 . 5 1 1 A 28 28 TRP HA H 28 4.963 5.615 -0.652 1
1 274 . 5 1 1 A 28 28 TRP C C 28 170.637 172.385 -1.748 1
1 275 . 5 1 1 A 28 28 TRP CA C 28 54.438 55.432 -0.994 1
1 276 . 5 1 1 A 28 28 TRP CB C 28 27.497 31.637 -4.140 1
1 282 . 5 1 1 A 28 28 TRP N N 28 117.895 119.886 -1.991 1
1 284 . 5 1 1 A 29 29 ASP H H 29 8.696 9.285 -0.589 1
1 285 . 5 1 1 A 29 29 ASP HA H 29 4.971 5.008 -0.037 1
1 288 . 5 1 1 A 29 29 ASP C C 29 174.901 177.492 -2.591 1
1 289 . 5 1 1 A 29 29 ASP CA C 29 50.178 52.888 -2.710 1
1 290 . 5 1 1 A 29 29 ASP CB C 29 42.291 43.058 -0.767 1
1 291 . 5 1 1 A 29 29 ASP N N 29 117.477 122.258 -4.781 1
1 292 . 5 1 1 A 30 30 SER H H 30 8.800 8.892 -0.092 1
1 293 . 5 1 1 A 30 30 SER HA H 30 4.389 4.137 0.252 1
1 296 . 5 1 1 A 30 30 SER C C 30 174.032 175.742 -1.710 1
1 297 . 5 1 1 A 30 30 SER CA C 30 58.694 60.531 -1.837 1
1 298 . 5 1 1 A 30 30 SER CB C 30 62.428 63.505 -1.077 1
1 299 . 5 1 1 A 30 30 SER N N 30 118.275 120.986 -2.711 1
1 300 . 5 1 1 A 31 31 GLY H H 31 8.759 8.190 0.569 1
1 301 . 5 1 1 A 31 31 GLY HA2 H 31 4.239 4.023 0.216 1
1 302 . 5 1 1 A 31 31 GLY HA3 H 31 3.555 4.059 -0.504 1
1 303 . 5 1 1 A 31 31 GLY C C 31 171.325 174.344 -3.019 1
1 304 . 5 1 1 A 31 31 GLY CA C 31 43.637 45.445 -1.808 1
1 305 . 5 1 1 A 31 31 GLY N N 31 107.961 110.827 -2.866 1
1 306 . 5 1 1 A 32 32 ASN H H 32 8.173 7.994 0.179 1
1 307 . 5 1 1 A 32 32 ASN HA H 32 4.749 4.989 -0.240 1
1 312 . 5 1 1 A 32 32 ASN C C 32 171.355 175.325 -3.970 1
1 313 . 5 1 1 A 32 32 ASN CA C 32 50.795 53.113 -2.318 1
1 314 . 5 1 1 A 32 32 ASN CB C 32 41.508 39.901 1.607 1
1 315 . 5 1 1 A 32 32 ASN N N 32 117.781 119.467 -1.686 1
1 317 . 5 1 1 A 33 33 SER HA H 33 4.291 4.546 -0.255 1
1 320 . 5 1 1 A 33 33 SER C C 33 172.449 174.039 -1.590 1
1 321 . 5 1 1 A 33 33 SER CA C 33 56.733 58.948 -2.215 1
1 322 . 5 1 1 A 33 33 SER CB C 33 60.884 64.342 -3.458 1
1 323 . 5 1 1 A 34 34 GLU H H 34 7.731 7.748 -0.017 1
1 324 . 5 1 1 A 34 34 GLU HA H 34 4.556 4.583 -0.027 1
1 329 . 5 1 1 A 34 34 GLU C C 34 171.792 174.281 -2.489 1
1 330 . 5 1 1 A 34 34 GLU CA C 34 51.818 53.679 -1.861 1
1 331 . 5 1 1 A 34 34 GLU CB C 34 26.891 29.542 -2.651 1
1 333 . 5 1 1 A 34 34 GLU N N 34 122.319 120.794 1.525 1
1 334 . 5 1 1 A 35 35 PRO HA H 35 4.165 4.777 -0.612 1
1 341 . 5 1 1 A 35 35 PRO C C 35 174.288 176.887 -2.599 1
1 342 . 5 1 1 A 35 35 PRO CA C 35 61.374 62.425 -1.051 1
1 343 . 5 1 1 A 35 35 PRO CB C 35 29.887 30.282 -0.395 1
1 346 . 5 1 1 A 36 36 VAL H H 36 8.348 7.853 0.495 1
1 347 . 5 1 1 A 36 36 VAL HA H 36 3.899 4.342 -0.443 1
1 355 . 5 1 1 A 36 36 VAL C C 36 173.344 177.074 -3.730 1
1 356 . 5 1 1 A 36 36 VAL CA C 36 59.014 61.224 -2.210 1
1 357 . 5 1 1 A 36 36 VAL CB C 36 31.865 33.420 -1.555 1
1 360 . 5 1 1 A 36 36 VAL N N 36 122.051 118.368 3.683 1
1 361 . 5 1 1 A 37 37 THR H H 37 8.780 8.554 0.226 1
1 362 . 5 1 1 A 37 37 THR HA H 37 3.923 4.136 -0.213 1
1 367 . 5 1 1 A 37 37 THR C C 37 172.171 174.543 -2.372 1
1 368 . 5 1 1 A 37 37 THR CA C 37 63.155 65.264 -2.109 1
1 369 . 5 1 1 A 37 37 THR CB C 37 65.941 68.896 -2.955 1
1 371 . 5 1 1 A 37 37 THR N N 37 122.351 117.930 4.421 1
1 372 . 5 1 1 A 38 38 TYR H H 38 7.304 7.514 -0.210 1
1 373 . 5 1 1 A 38 38 TYR HA H 38 4.439 5.015 -0.576 1
1 380 . 5 1 1 A 38 38 TYR C C 38 168.385 172.818 -4.433 1
1 381 . 5 1 1 A 38 38 TYR CA C 38 54.101 56.711 -2.610 1
1 382 . 5 1 1 A 38 38 TYR CB C 38 35.874 40.276 -4.402 1
1 387 . 5 1 1 A 38 38 TYR N N 38 113.984 114.845 -0.861 1
1 388 . 5 1 1 A 39 39 TYR H H 39 9.445 8.938 0.507 1
1 389 . 5 1 1 A 39 39 TYR HA H 39 5.293 5.126 0.167 1
1 396 . 5 1 1 A 39 39 TYR C C 39 172.781 175.839 -3.058 1
1 397 . 5 1 1 A 39 39 TYR CA C 39 54.322 55.727 -1.405 1
1 398 . 5 1 1 A 39 39 TYR CB C 39 39.035 41.150 -2.115 1
1 401 . 5 1 1 A 39 39 TYR N N 39 115.092 117.799 -2.707 1
1 402 . 5 1 1 A 40 40 GLY H H 40 8.870 8.578 0.292 1
1 403 . 5 1 1 A 40 40 GLY HA2 H 40 5.137 4.151 0.986 1
1 404 . 5 1 1 A 40 40 GLY HA3 H 40 3.285 4.238 -0.953 1
1 405 . 5 1 1 A 40 40 GLY C C 40 169.688 172.823 -3.135 1
1 406 . 5 1 1 A 40 40 GLY CA C 40 41.415 44.947 -3.532 1
1 407 . 5 1 1 A 40 40 GLY N N 40 106.573 112.124 -5.551 1
1 408 . 5 1 1 A 41 41 ILE H H 41 8.917 8.499 0.418 1
1 409 . 5 1 1 A 41 41 ILE HA H 41 4.527 4.783 -0.256 1
1 419 . 5 1 1 A 41 41 ILE C C 41 172.692 174.911 -2.219 1
1 420 . 5 1 1 A 41 41 ILE CA C 41 57.597 60.033 -2.436 1
1 421 . 5 1 1 A 41 41 ILE CB C 41 37.840 41.001 -3.161 1
1 425 . 5 1 1 A 41 41 ILE N N 41 121.746 121.832 -0.086 1
1 426 . 5 1 1 A 42 42 GLN H H 42 9.063 8.712 0.351 1
1 427 . 5 1 1 A 42 42 GLN HA H 42 5.655 5.389 0.266 1
1 434 . 5 1 1 A 42 42 GLN C C 42 172.841 174.667 -1.826 1
1 435 . 5 1 1 A 42 42 GLN CA C 42 50.789 54.255 -3.466 1
1 436 . 5 1 1 A 42 42 GLN CB C 42 28.898 32.732 -3.834 1
1 438 . 5 1 1 A 42 42 GLN N N 42 125.141 125.437 -0.296 1
1 440 . 5 1 1 A 43 43 TYR H H 43 9.066 8.831 0.235 1
1 441 . 5 1 1 A 43 43 TYR HA H 43 5.922 6.039 -0.117 1
1 448 . 5 1 1 A 43 43 TYR C C 43 171.219 173.207 -1.988 1
1 449 . 5 1 1 A 43 43 TYR CA C 43 53.349 56.005 -2.656 1
1 450 . 5 1 1 A 43 43 TYR CB C 43 41.074 42.446 -1.372 1
1 455 . 5 1 1 A 43 43 TYR N N 43 118.018 119.452 -1.434 1
1 456 . 5 1 1 A 44 44 ARG H H 44 8.400 8.214 0.186 1
1 457 . 5 1 1 A 44 44 ARG HA H 44 4.542 4.648 -0.106 1
1 464 . 5 1 1 A 44 44 ARG C C 44 171.974 174.387 -2.413 1
1 465 . 5 1 1 A 44 44 ARG CA C 44 52.453 55.326 -2.873 1
1 466 . 5 1 1 A 44 44 ARG CB C 44 31.125 33.632 -2.507 1
1 469 . 5 1 1 A 44 44 ARG N N 44 115.214 120.341 -5.127 1
1 470 . 5 1 1 A 45 45 ALA H H 45 8.846 8.353 0.493 1
1 471 . 5 1 1 A 45 45 ALA HA H 45 3.894 2.840 1.054 1
1 475 . 5 1 1 A 45 45 ALA C C 45 175.721 176.593 -0.872 1
1 476 . 5 1 1 A 45 45 ALA CA C 45 50.372 51.901 -1.529 1
1 477 . 5 1 1 A 45 45 ALA CB C 45 15.732 18.584 -2.852 1
1 478 . 5 1 1 A 45 45 ALA N N 45 126.463 126.587 -0.124 1
1 479 . 5 1 1 A 46 46 ALA H H 46 8.282 8.014 0.268 1
1 480 . 5 1 1 A 46 46 ALA HA H 46 3.922 3.814 0.108 1
1 484 . 5 1 1 A 46 46 ALA C C 46 176.236 177.878 -1.642 1
1 485 . 5 1 1 A 46 46 ALA CA C 46 50.773 53.549 -2.776 1
1 486 . 5 1 1 A 46 46 ALA CB C 46 16.244 18.104 -1.860 1
1 487 . 5 1 1 A 46 46 ALA N N 46 126.301 126.309 -0.008 1
1 488 . 5 1 1 A 47 47 GLY HA2 H 47 3.882 3.937 -0.055 1
1 489 . 5 1 1 A 47 47 GLY HA3 H 47 3.695 3.958 -0.263 1
1 490 . 5 1 1 A 47 47 GLY C C 47 171.795 174.677 -2.882 1
1 491 . 5 1 1 A 47 47 GLY CA C 47 43.327 45.310 -1.983 1
1 492 . 5 1 1 A 48 48 THR H H 48 7.145 7.608 -0.463 1
1 493 . 5 1 1 A 48 48 THR HA H 48 4.417 4.097 0.320 1
1 498 . 5 1 1 A 48 48 THR C C 48 171.325 174.677 -3.352 1
1 499 . 5 1 1 A 48 48 THR CA C 48 58.271 63.268 -4.997 1
1 500 . 5 1 1 A 48 48 THR CB C 48 68.846 69.117 -0.271 1
1 502 . 5 1 1 A 48 48 THR N N 48 110.190 115.429 -5.239 1
1 503 . 5 1 1 A 49 49 GLU H H 49 8.346 8.659 -0.313 1
1 504 . 5 1 1 A 49 49 GLU HA H 49 4.277 4.337 -0.060 1
1 509 . 5 1 1 A 49 49 GLU C C 49 174.109 176.160 -2.051 1
1 510 . 5 1 1 A 49 49 GLU CA C 49 52.909 55.840 -2.931 1
1 511 . 5 1 1 A 49 49 GLU CB C 49 27.845 28.667 -0.822 1
1 513 . 5 1 1 A 49 49 GLU N N 49 119.985 122.478 -2.493 1
1 514 . 5 1 1 A 50 50 GLY H H 50 7.617 8.023 -0.406 1
1 515 . 5 1 1 A 50 50 GLY HA2 H 50 3.935 4.157 -0.222 1
1 516 . 5 1 1 A 50 50 GLY HA3 H 50 3.935 4.184 -0.249 1
1 517 . 5 1 1 A 50 50 GLY C C 50 168.223 172.052 -3.829 1
1 518 . 5 1 1 A 50 50 GLY CA C 50 42.121 43.886 -1.765 1
1 519 . 5 1 1 A 50 50 GLY N N 50 108.670 109.402 -0.732 1
1 520 . 5 1 1 A 51 51 PRO HA H 51 4.298 4.599 -0.301 1
1 527 . 5 1 1 A 51 51 PRO C C 51 175.067 176.606 -1.539 1
1 528 . 5 1 1 A 51 51 PRO CA C 51 60.175 62.718 -2.543 1
1 529 . 5 1 1 A 51 51 PRO CB C 51 30.052 32.007 -1.955 1
1 532 . 5 1 1 A 52 52 PHE H H 52 8.442 8.698 -0.256 1
1 533 . 5 1 1 A 52 52 PHE HA H 52 3.981 4.560 -0.579 1
1 541 . 5 1 1 A 52 52 PHE C C 52 175.141 175.679 -0.538 1
1 542 . 5 1 1 A 52 52 PHE CA C 52 56.808 57.782 -0.974 1
1 543 . 5 1 1 A 52 52 PHE CB C 52 36.830 39.418 -2.588 1
1 549 . 5 1 1 A 52 52 PHE N N 52 118.707 121.637 -2.930 1
1 550 . 5 1 1 A 53 53 GLN H H 53 8.778 8.320 0.458 1
1 551 . 5 1 1 A 53 53 GLN HA H 53 4.149 4.178 -0.029 1
1 558 . 5 1 1 A 53 53 GLN C C 53 172.773 175.178 -2.405 1
1 559 . 5 1 1 A 53 53 GLN CA C 53 52.999 56.523 -3.524 1
1 560 . 5 1 1 A 53 53 GLN CB C 53 26.962 29.071 -2.109 1
1 562 . 5 1 1 A 53 53 GLN N N 53 122.164 122.632 -0.468 1
1 564 . 5 1 1 A 54 54 GLU H H 54 8.432 8.549 -0.117 1
1 565 . 5 1 1 A 54 54 GLU HA H 54 5.533 5.041 0.492 1
1 570 . 5 1 1 A 54 54 GLU C C 54 173.930 174.800 -0.870 1
1 571 . 5 1 1 A 54 54 GLU CA C 54 52.981 55.312 -2.331 1
1 572 . 5 1 1 A 54 54 GLU CB C 54 31.712 33.099 -1.387 1
1 574 . 5 1 1 A 54 54 GLU N N 54 119.688 121.604 -1.916 1
1 575 . 5 1 1 A 55 55 VAL H H 55 9.077 8.796 0.281 1
1 576 . 5 1 1 A 55 55 VAL HA H 55 4.180 4.858 -0.678 1
1 584 . 5 1 1 A 55 55 VAL C C 55 171.811 174.380 -2.569 1
1 585 . 5 1 1 A 55 55 VAL CA C 55 59.664 61.173 -1.509 1
1 586 . 5 1 1 A 55 55 VAL CB C 55 31.827 34.626 -2.799 1
1 589 . 5 1 1 A 55 55 VAL N N 55 125.328 125.859 -0.531 1
1 590 . 5 1 1 A 56 56 ASP H H 56 8.639 8.741 -0.102 1
1 591 . 5 1 1 A 56 56 ASP HA H 56 5.250 5.445 -0.195 1
1 594 . 5 1 1 A 56 56 ASP C C 56 174.252 175.880 -1.628 1
1 595 . 5 1 1 A 56 56 ASP CA C 56 50.108 52.207 -2.099 1
1 596 . 5 1 1 A 56 56 ASP CB C 56 41.407 44.121 -2.714 1
1 597 . 5 1 1 A 56 56 ASP N N 56 125.773 124.915 0.858 1
1 598 . 5 1 1 A 57 57 GLY H H 57 7.222 8.062 -0.840 1
1 599 . 5 1 1 A 57 57 GLY HA2 H 57 3.479 3.706 -0.227 1
1 600 . 5 1 1 A 57 57 GLY HA3 H 57 2.719 3.839 -1.120 1
1 601 . 5 1 1 A 57 57 GLY C C 57 172.281 174.187 -1.906 1
1 602 . 5 1 1 A 57 57 GLY CA C 57 43.919 45.542 -1.623 1
1 603 . 5 1 1 A 57 57 GLY N N 57 105.564 110.616 -5.052 1
1 604 . 5 1 1 A 58 58 VAL H H 58 8.338 7.935 0.403 1
1 605 . 5 1 1 A 58 58 VAL HA H 58 3.860 4.323 -0.463 1
1 613 . 5 1 1 A 58 58 VAL C C 58 173.981 175.184 -1.203 1
1 614 . 5 1 1 A 58 58 VAL CA C 58 61.233 61.666 -0.433 1
1 615 . 5 1 1 A 58 58 VAL CB C 58 29.708 33.010 -3.302 1
1 618 . 5 1 1 A 58 58 VAL N N 58 121.466 120.860 0.606 1
1 619 . 5 1 1 A 59 59 ALA H H 59 9.038 8.729 0.309 1
1 620 . 5 1 1 A 59 59 ALA HA H 59 4.676 4.600 0.076 1
1 624 . 5 1 1 A 59 59 ALA C C 59 175.105 176.784 -1.679 1
1 625 . 5 1 1 A 59 59 ALA CA C 59 50.866 52.084 -1.218 1
1 626 . 5 1 1 A 59 59 ALA CB C 59 17.647 19.211 -1.564 1
1 627 . 5 1 1 A 59 59 ALA N N 59 130.928 130.125 0.803 1
1 628 . 5 1 1 A 60 60 THR H H 60 7.445 7.776 -0.331 1
1 629 . 5 1 1 A 60 60 THR HA H 60 4.642 4.648 -0.006 1
1 634 . 5 1 1 A 60 60 THR C C 60 169.528 174.243 -4.715 1
1 635 . 5 1 1 A 60 60 THR CA C 60 57.101 59.464 -2.363 1
1 636 . 5 1 1 A 60 60 THR CB C 60 67.982 72.347 -4.365 1
1 638 . 5 1 1 A 60 60 THR N N 60 109.256 108.996 0.260 1
1 639 . 5 1 1 A 61 61 THR H H 61 7.325 8.360 -1.035 1
1 640 . 5 1 1 A 61 61 THR HA H 61 2.896 3.679 -0.783 1
1 645 . 5 1 1 A 61 61 THR C C 61 169.678 173.213 -3.535 1
1 646 . 5 1 1 A 61 61 THR CA C 61 57.246 61.789 -4.543 1
1 647 . 5 1 1 A 61 61 THR CB C 61 63.794 68.746 -4.952 1
1 649 . 5 1 1 A 61 61 THR N N 61 105.670 111.320 -5.650 1
1 650 . 5 1 1 A 62 62 ARG H H 62 6.490 7.174 -0.684 1
1 651 . 5 1 1 A 62 62 ARG HA H 62 4.698 4.454 0.244 1
1 658 . 5 1 1 A 62 62 ARG C C 62 172.881 173.709 -0.828 1
1 659 . 5 1 1 A 62 62 ARG CA C 62 52.276 54.234 -1.958 1
1 660 . 5 1 1 A 62 62 ARG CB C 62 30.774 33.677 -2.903 1
1 663 . 5 1 1 A 62 62 ARG N N 62 117.485 121.709 -4.224 1
1 664 . 5 1 1 A 63 63 TYR H H 63 8.891 8.551 0.340 1
1 665 . 5 1 1 A 63 63 TYR HA H 63 4.356 5.012 -0.656 1
1 672 . 5 1 1 A 63 63 TYR C C 63 170.393 173.968 -3.575 1
1 673 . 5 1 1 A 63 63 TYR CA C 63 57.284 57.864 -0.580 1
1 674 . 5 1 1 A 63 63 TYR CB C 63 41.467 42.283 -0.816 1
1 679 . 5 1 1 A 63 63 TYR N N 63 124.712 127.131 -2.419 1
1 680 . 5 1 1 A 64 64 SER H H 64 7.244 8.496 -1.252 1
1 681 . 5 1 1 A 64 64 SER HA H 64 5.077 5.303 -0.226 1
1 684 . 5 1 1 A 64 64 SER C C 64 169.712 173.562 -3.850 1
1 685 . 5 1 1 A 64 64 SER CA C 64 54.181 55.752 -1.571 1
1 686 . 5 1 1 A 64 64 SER CB C 64 61.122 64.859 -3.737 1
1 687 . 5 1 1 A 64 64 SER N N 64 120.593 120.911 -0.318 1
1 688 . 5 1 1 A 65 65 ILE H H 65 8.686 8.781 -0.095 1
1 689 . 5 1 1 A 65 65 ILE HA H 65 3.937 4.892 -0.955 1
1 699 . 5 1 1 A 65 65 ILE C C 65 172.217 175.479 -3.262 1
1 700 . 5 1 1 A 65 65 ILE CA C 65 58.288 59.494 -1.206 1
1 701 . 5 1 1 A 65 65 ILE CB C 65 36.110 40.379 -4.269 1
1 705 . 5 1 1 A 65 65 ILE N N 65 127.792 124.644 3.148 1
1 706 . 5 1 1 A 66 66 GLY H H 66 7.883 8.592 -0.709 1
1 707 . 5 1 1 A 66 66 GLY HA2 H 66 4.799 4.348 0.451 1
1 708 . 5 1 1 A 66 66 GLY HA3 H 66 3.468 4.369 -0.901 1
1 709 . 5 1 1 A 66 66 GLY C C 66 171.983 173.945 -1.962 1
1 710 . 5 1 1 A 66 66 GLY CA C 66 40.534 45.196 -4.662 1
1 711 . 5 1 1 A 66 66 GLY N N 66 112.632 112.122 0.510 1
1 712 . 5 1 1 A 67 67 GLY H H 67 8.483 8.393 0.090 1
1 713 . 5 1 1 A 67 67 GLY HA2 H 67 3.836 3.977 -0.141 1
1 714 . 5 1 1 A 67 67 GLY HA3 H 67 3.682 3.996 -0.314 1
1 715 . 5 1 1 A 67 67 GLY C C 67 172.954 174.053 -1.099 1
1 716 . 5 1 1 A 67 67 GLY CA C 67 43.568 45.328 -1.760 1
1 717 . 5 1 1 A 67 67 GLY N N 67 104.625 110.553 -5.928 1
1 718 . 5 1 1 A 68 68 LEU H H 68 8.236 7.537 0.699 1
1 719 . 5 1 1 A 68 68 LEU HA H 68 4.154 4.622 -0.468 1
1 729 . 5 1 1 A 68 68 LEU C C 68 173.838 175.911 -2.073 1
1 730 . 5 1 1 A 68 68 LEU CA C 68 51.025 53.326 -2.301 1
1 731 . 5 1 1 A 68 68 LEU CB C 68 38.837 42.658 -3.821 1
1 735 . 5 1 1 A 68 68 LEU N N 68 118.919 121.533 -2.614 1
1 736 . 5 1 1 A 69 69 SER H H 69 8.284 8.790 -0.506 1
1 737 . 5 1 1 A 69 69 SER HA H 69 4.765 5.079 -0.314 1
1 740 . 5 1 1 A 69 69 SER C C 69 170.044 172.171 -2.127 1
1 741 . 5 1 1 A 69 69 SER CA C 69 54.639 56.306 -1.667 1
1 742 . 5 1 1 A 69 69 SER CB C 69 61.216 63.763 -2.547 1
1 743 . 5 1 1 A 69 69 SER N N 69 116.361 117.331 -0.970 1
1 744 . 5 1 1 A 70 70 PRO HA H 70 5.141 4.775 0.366 1
1 751 . 5 1 1 A 70 70 PRO C C 70 174.858 177.474 -2.616 1
1 752 . 5 1 1 A 70 70 PRO CA C 70 60.810 63.878 -3.068 1
1 753 . 5 1 1 A 70 70 PRO CB C 70 30.657 32.035 -1.378 1
1 756 . 5 1 1 A 71 71 PHE H H 71 8.139 9.004 -0.865 1
1 757 . 5 1 1 A 71 71 PHE HA H 71 4.202 4.407 -0.205 1
1 765 . 5 1 1 A 71 71 PHE C C 71 172.870 174.474 -1.604 1
1 766 . 5 1 1 A 71 71 PHE CA C 71 55.410 58.920 -3.510 1
1 767 . 5 1 1 A 71 71 PHE CB C 71 36.027 37.654 -1.627 1
1 773 . 5 1 1 A 71 71 PHE N N 71 125.409 123.425 1.984 1
1 774 . 5 1 1 A 72 72 SER H H 72 8.182 7.702 0.480 1
1 775 . 5 1 1 A 72 72 SER HA H 72 4.755 5.023 -0.268 1
1 778 . 5 1 1 A 72 72 SER C C 72 168.850 172.636 -3.786 1
1 779 . 5 1 1 A 72 72 SER CA C 72 55.926 56.448 -0.522 1
1 780 . 5 1 1 A 72 72 SER CB C 72 64.208 66.979 -2.771 1
1 781 . 5 1 1 A 72 72 SER N N 72 113.509 110.294 3.215 1
1 782 . 5 1 1 A 73 73 GLU H H 73 8.422 8.704 -0.282 1
1 783 . 5 1 1 A 73 73 GLU HA H 73 4.966 5.122 -0.156 1
1 788 . 5 1 1 A 73 73 GLU C C 73 173.192 174.563 -1.371 1
1 789 . 5 1 1 A 73 73 GLU CA C 73 52.815 54.824 -2.009 1
1 790 . 5 1 1 A 73 73 GLU CB C 73 29.416 32.860 -3.444 1
1 792 . 5 1 1 A 73 73 GLU N N 73 123.046 121.796 1.250 1
1 793 . 5 1 1 A 74 74 TYR H H 74 9.205 8.717 0.488 1
1 794 . 5 1 1 A 74 74 TYR HA H 74 4.799 4.951 -0.152 1
1 801 . 5 1 1 A 74 74 TYR C C 74 170.775 174.229 -3.454 1
1 802 . 5 1 1 A 74 74 TYR CA C 74 55.291 56.735 -1.444 1
1 803 . 5 1 1 A 74 74 TYR CB C 74 42.943 42.583 0.360 1
1 808 . 5 1 1 A 74 74 TYR N N 74 125.351 124.680 0.671 1
1 809 . 5 1 1 A 75 75 ALA H H 75 8.639 8.359 0.280 1
1 810 . 5 1 1 A 75 75 ALA HA H 75 5.271 5.540 -0.269 1
1 814 . 5 1 1 A 75 75 ALA C C 75 173.698 176.243 -2.545 1
1 815 . 5 1 1 A 75 75 ALA CA C 75 47.904 50.170 -2.266 1
1 816 . 5 1 1 A 75 75 ALA CB C 75 19.634 21.361 -1.727 1
1 817 . 5 1 1 A 75 75 ALA N N 75 121.555 125.069 -3.514 1
1 818 . 5 1 1 A 76 76 PHE H H 76 9.066 9.522 -0.456 1
1 819 . 5 1 1 A 76 76 PHE HA H 76 5.496 5.422 0.074 1
1 827 . 5 1 1 A 76 76 PHE C C 76 172.268 174.752 -2.484 1
1 828 . 5 1 1 A 76 76 PHE CA C 76 54.216 56.219 -2.003 1
1 829 . 5 1 1 A 76 76 PHE CB C 76 41.901 42.264 -0.363 1
1 835 . 5 1 1 A 76 76 PHE N N 76 116.545 120.084 -3.539 1
1 836 . 5 1 1 A 77 77 ARG H H 77 9.216 8.833 0.383 1
1 837 . 5 1 1 A 77 77 ARG HA H 77 4.357 5.102 -0.745 1
1 845 . 5 1 1 A 77 77 ARG C C 77 169.998 174.242 -4.244 1
1 846 . 5 1 1 A 77 77 ARG CA C 77 52.414 54.659 -2.245 1
1 847 . 5 1 1 A 77 77 ARG CB C 77 30.794 33.734 -2.940 1
1 850 . 5 1 1 A 77 77 ARG N N 77 115.738 119.219 -3.481 1
1 852 . 5 1 1 A 78 78 VAL H H 78 8.135 8.895 -0.760 1
1 853 . 5 1 1 A 78 78 VAL HA H 78 4.884 4.585 0.299 1
1 861 . 5 1 1 A 78 78 VAL C C 78 171.098 174.683 -3.585 1
1 862 . 5 1 1 A 78 78 VAL CA C 78 57.566 60.831 -3.265 1
1 863 . 5 1 1 A 78 78 VAL CB C 78 33.146 32.671 0.475 1
1 866 . 5 1 1 A 78 78 VAL N N 78 117.942 124.933 -6.991 1
1 867 . 5 1 1 A 79 79 LEU H H 79 9.167 8.313 0.854 1
1 868 . 5 1 1 A 79 79 LEU HA H 79 4.575 4.977 -0.402 1
1 878 . 5 1 1 A 79 79 LEU C C 79 171.447 175.090 -3.643 1
1 879 . 5 1 1 A 79 79 LEU CA C 79 51.642 53.464 -1.822 1
1 880 . 5 1 1 A 79 79 LEU CB C 79 42.776 45.356 -2.580 1
1 884 . 5 1 1 A 79 79 LEU N N 79 123.913 119.100 4.813 1
1 885 . 5 1 1 A 80 80 ALA H H 80 9.325 8.699 0.626 1
1 886 . 5 1 1 A 80 80 ALA HA H 80 4.654 3.404 1.250 1
1 890 . 5 1 1 A 80 80 ALA C C 80 172.070 177.345 -5.275 1
1 891 . 5 1 1 A 80 80 ALA CA C 80 48.169 52.035 -3.866 1
1 892 . 5 1 1 A 80 80 ALA CB C 80 20.366 18.872 1.494 1
1 893 . 5 1 1 A 80 80 ALA N N 80 124.135 126.114 -1.979 1
1 894 . 5 1 1 A 81 81 VAL H H 81 7.953 8.137 -0.184 1
1 895 . 5 1 1 A 81 81 VAL HA H 81 4.293 5.008 -0.715 1
1 903 . 5 1 1 A 81 81 VAL C C 81 172.873 174.188 -1.315 1
1 904 . 5 1 1 A 81 81 VAL CA C 81 58.959 60.169 -1.210 1
1 905 . 5 1 1 A 81 81 VAL CB C 81 31.412 35.266 -3.854 1
1 908 . 5 1 1 A 81 81 VAL N N 81 118.503 120.711 -2.208 1
1 909 . 5 1 1 A 82 82 ASN H H 82 8.262 8.414 -0.152 1
1 910 . 5 1 1 A 82 82 ASN HA H 82 4.945 4.934 0.011 1
1 915 . 5 1 1 A 82 82 ASN C C 82 173.273 175.129 -1.856 1
1 916 . 5 1 1 A 82 82 ASN CA C 82 48.714 51.948 -3.234 1
1 917 . 5 1 1 A 82 82 ASN CB C 82 36.796 39.933 -3.137 1
1 918 . 5 1 1 A 82 82 ASN N N 82 125.425 123.249 2.176 1
1 920 . 5 1 1 A 83 83 SER HA H 83 3.966 4.057 -0.091 1
1 923 . 5 1 1 A 83 83 SER C C 83 172.812 176.731 -3.919 1
1 924 . 5 1 1 A 83 83 SER CA C 83 59.047 62.486 -3.439 1
1 925 . 5 1 1 A 83 83 SER CB C 83 60.406 62.925 -2.519 1
1 926 . 5 1 1 A 84 84 ILE H H 84 7.803 7.943 -0.140 1
1 927 . 5 1 1 A 84 84 ILE HA H 84 3.862 3.726 0.136 1
1 937 . 5 1 1 A 84 84 ILE C C 84 174.481 176.195 -1.714 1
1 938 . 5 1 1 A 84 84 ILE CA C 84 59.188 64.179 -4.991 1
1 939 . 5 1 1 A 84 84 ILE CB C 84 34.677 38.203 -3.526 1
1 943 . 5 1 1 A 84 84 ILE N N 84 121.222 119.421 1.801 1
1 944 . 5 1 1 A 85 85 GLY H H 85 7.435 7.281 0.154 1
1 945 . 5 1 1 A 85 85 GLY HA2 H 85 4.149 4.025 0.124 1
1 946 . 5 1 1 A 85 85 GLY HA3 H 85 3.747 4.031 -0.284 1
1 947 . 5 1 1 A 85 85 GLY C C 85 168.589 172.162 -3.573 1
1 948 . 5 1 1 A 85 85 GLY CA C 85 42.931 45.384 -2.453 1
1 949 . 5 1 1 A 85 85 GLY N N 85 106.320 105.809 0.511 1
1 950 . 5 1 1 A 86 86 ARG H H 86 8.190 8.360 -0.170 1
1 951 . 5 1 1 A 86 86 ARG HA H 86 4.452 4.873 -0.421 1
1 958 . 5 1 1 A 86 86 ARG C C 86 175.286 176.202 -0.916 1
1 959 . 5 1 1 A 86 86 ARG CA C 86 53.223 55.215 -1.992 1
1 960 . 5 1 1 A 86 86 ARG CB C 86 29.517 30.822 -1.305 1
1 963 . 5 1 1 A 86 86 ARG N N 86 118.339 117.372 0.967 1
1 964 . 5 1 1 A 87 87 GLY H H 87 8.900 8.648 0.252 1
1 965 . 5 1 1 A 87 87 GLY HA2 H 87 4.211 4.008 0.203 1
1 966 . 5 1 1 A 87 87 GLY HA3 H 87 3.967 4.018 -0.051 1
1 967 . 5 1 1 A 87 87 GLY C C 87 168.101 172.822 -4.721 1
1 968 . 5 1 1 A 87 87 GLY CA C 87 42.281 44.222 -1.941 1
1 969 . 5 1 1 A 87 87 GLY N N 87 113.482 109.443 4.039 1
1 970 . 5 1 1 A 88 88 PRO HA H 88 4.563 4.573 -0.010 1
1 977 . 5 1 1 A 88 88 PRO CA C 88 60.994 62.076 -1.082 1
1 978 . 5 1 1 A 88 88 PRO CB C 88 29.873 31.585 -1.712 1
1 981 . 5 1 1 A 89 89 PRO HA H 89 4.490 4.492 -0.002 1
1 987 . 5 1 1 A 89 89 PRO C C 89 174.543 176.337 -1.794 1
1 988 . 5 1 1 A 89 89 PRO CA C 89 59.435 62.618 -3.183 1
1 989 . 5 1 1 A 89 89 PRO CB C 89 29.805 31.950 -2.145 1
1 992 . 5 1 1 A 90 90 SER H H 90 8.808 8.389 0.419 1
1 993 . 5 1 1 A 90 90 SER HA H 90 4.202 4.504 -0.302 1
1 996 . 5 1 1 A 90 90 SER C C 90 171.870 173.969 -2.099 1
1 997 . 5 1 1 A 90 90 SER CA C 90 55.868 57.721 -1.853 1
1 998 . 5 1 1 A 90 90 SER CB C 90 64.504 64.117 0.387 1
1 999 . 5 1 1 A 90 90 SER N N 90 113.781 116.787 -3.006 1
1 1000 . 5 1 1 A 91 91 GLU H H 91 8.291 8.488 -0.197 1
1 1001 . 5 1 1 A 91 91 GLU HA H 91 4.131 4.093 0.038 1
1 1006 . 5 1 1 A 91 91 GLU C C 91 174.882 176.988 -2.106 1
1 1007 . 5 1 1 A 91 91 GLU CA C 91 54.984 57.268 -2.284 1
1 1008 . 5 1 1 A 91 91 GLU CB C 91 27.643 29.552 -1.909 1
1 1010 . 5 1 1 A 91 91 GLU N N 91 117.930 123.306 -5.376 1
1 1011 . 5 1 1 A 92 92 ALA H H 92 8.605 8.301 0.304 1
1 1012 . 5 1 1 A 92 92 ALA HA H 92 5.068 4.285 0.783 1
1 1016 . 5 1 1 A 92 92 ALA C C 92 176.227 178.057 -1.830 1
1 1017 . 5 1 1 A 92 92 ALA CA C 92 48.997 53.025 -4.028 1
1 1018 . 5 1 1 A 92 92 ALA CB C 92 17.756 19.178 -1.422 1
1 1019 . 5 1 1 A 92 92 ALA N N 92 126.421 127.572 -1.151 1
1 1020 . 5 1 1 A 93 93 VAL H H 93 9.051 9.048 0.003 1
1 1021 . 5 1 1 A 93 93 VAL HA H 93 4.642 5.054 -0.412 1
1 1029 . 5 1 1 A 93 93 VAL C C 93 172.010 174.474 -2.464 1
1 1030 . 5 1 1 A 93 93 VAL CA C 93 57.495 59.272 -1.777 1
1 1031 . 5 1 1 A 93 93 VAL CB C 93 32.774 34.869 -2.095 1
1 1034 . 5 1 1 A 93 93 VAL N N 93 117.322 117.642 -0.320 1
1 1035 . 5 1 1 A 94 94 ARG H H 94 8.470 8.793 -0.323 1
1 1036 . 5 1 1 A 94 94 ARG HA H 94 5.692 5.170 0.522 1
1 1043 . 5 1 1 A 94 94 ARG C C 94 173.635 174.874 -1.239 1
1 1044 . 5 1 1 A 94 94 ARG CA C 94 52.038 54.435 -2.397 1
1 1045 . 5 1 1 A 94 94 ARG CB C 94 30.966 33.176 -2.210 1
1 1048 . 5 1 1 A 94 94 ARG N N 94 122.258 121.958 0.300 1
1 1049 . 5 1 1 A 95 95 ALA H H 95 9.051 9.033 0.018 1
1 1050 . 5 1 1 A 95 95 ALA HA H 95 4.642 5.246 -0.604 1
1 1054 . 5 1 1 A 95 95 ALA C C 95 172.285 175.192 -2.907 1
1 1055 . 5 1 1 A 95 95 ALA CA C 95 49.191 50.903 -1.712 1
1 1056 . 5 1 1 A 95 95 ALA CB C 95 22.562 22.232 0.330 1
1 1057 . 5 1 1 A 95 95 ALA N N 95 121.931 124.353 -2.422 1
1 1058 . 5 1 1 A 96 96 ARG H H 96 8.550 8.596 -0.046 1
1 1059 . 5 1 1 A 96 96 ARG HA H 96 5.407 5.100 0.307 1
1 1066 . 5 1 1 A 96 96 ARG C C 96 174.547 176.147 -1.600 1
1 1067 . 5 1 1 A 96 96 ARG CA C 96 51.439 55.248 -3.809 1
1 1068 . 5 1 1 A 96 96 ARG CB C 96 30.708 31.688 -0.980 1
1 1071 . 5 1 1 A 96 96 ARG N N 96 121.155 124.714 -3.559 1
1 1072 . 5 1 1 A 97 97 THR H H 97 8.797 8.951 -0.154 1
1 1073 . 5 1 1 A 97 97 THR HA H 97 4.116 4.596 -0.480 1
1 1078 . 5 1 1 A 97 97 THR C C 97 173.577 175.016 -1.439 1
1 1079 . 5 1 1 A 97 97 THR CA C 97 58.800 61.079 -2.279 1
1 1080 . 5 1 1 A 97 97 THR CB C 97 67.461 69.499 -2.038 1
1 1082 . 5 1 1 A 97 97 THR N N 97 114.657 117.100 -2.443 1
1 1083 . 5 1 1 A 98 98 GLY H H 98 7.505 8.373 -0.868 1
1 1084 . 5 1 1 A 98 98 GLY HA2 H 98 3.866 4.174 -0.308 1
1 1085 . 5 1 1 A 98 98 GLY HA3 H 98 3.743 4.233 -0.490 1
1 1086 . 5 1 1 A 98 98 GLY C C 98 170.637 174.874 -4.237 1
1 1087 . 5 1 1 A 98 98 GLY CA C 98 42.332 44.782 -2.450 1
1 1088 . 5 1 1 A 98 98 GLY N N 98 106.172 108.131 -1.959 1
1 1089 . 5 1 1 A 99 99 GLU H H 99 8.145 8.641 -0.496 1
1 1090 . 5 1 1 A 99 99 GLU HA H 99 4.210 4.601 -0.391 1
1 1095 . 5 1 1 A 99 99 GLU C C 99 174.134 176.606 -2.472 1
1 1096 . 5 1 1 A 99 99 GLU CA C 99 53.828 55.616 -1.788 1
1 1097 . 5 1 1 A 99 99 GLU CB C 99 28.774 28.852 -0.078 1
1 1099 . 5 1 1 A 99 99 GLU N N 99 117.634 117.827 -0.193 1
1 1100 . 5 1 1 A 100 100 GLN H H 100 8.647 7.718 0.929 1
1 1101 . 5 1 1 A 100 100 GLN HA H 100 4.247 4.036 0.211 1
1 1108 . 5 1 1 A 100 100 GLN C C 100 173.348 176.794 -3.446 1
1 1109 . 5 1 1 A 100 100 GLN CA C 100 53.634 57.076 -3.442 1
1 1110 . 5 1 1 A 100 100 GLN CB C 100 27.392 28.691 -1.299 1
1 1112 . 5 1 1 A 100 100 GLN N N 100 121.960 121.928 0.032 1
1 1114 . 5 1 1 A 101 101 SER H H 101 8.416 8.765 -0.349 1
1 1115 . 5 1 1 A 101 101 SER HA H 101 4.418 4.198 0.220 1
1 1117 . 5 1 1 A 101 101 SER C C 101 172.148 174.662 -2.514 1
1 1118 . 5 1 1 A 101 101 SER CA C 101 55.926 59.036 -3.110 1
1 1119 . 5 1 1 A 101 101 SER CB C 101 61.617 61.231 0.386 1
1 1120 . 5 1 1 A 101 101 SER N N 101 118.609 122.087 -3.478 1
1 1121 . 5 1 1 A 102 102 GLY H H 102 8.233 7.692 0.541 1
1 1122 . 5 1 1 A 102 102 GLY HA2 H 102 4.080 3.818 0.262 1
1 1123 . 5 1 1 A 102 102 GLY HA3 H 102 3.981 3.825 0.156 1
1 1124 . 5 1 1 A 102 102 GLY C C 102 169.461 174.496 -5.035 1
1 1125 . 5 1 1 A 102 102 GLY CA C 102 42.332 47.277 -4.945 1
1 1126 . 5 1 1 A 102 102 GLY N N 102 110.483 109.999 0.484 1
1 1127 . 5 1 1 A 103 103 PRO HA H 103 4.618 4.604 0.014 1
1 1134 . 5 1 1 A 103 103 PRO CA C 103 57.843 62.807 -4.964 1
1 1135 . 5 1 1 A 103 103 PRO CB C 103 28.671 32.594 -3.923 1
1 1 . 6 1 1 A 6 6 SER HA H 6 4.492 4.379 0.113 1
1 4 . 6 1 1 A 6 6 SER CA C 6 55.621 60.141 -4.520 1
1 5 . 6 1 1 A 6 6 SER CB C 6 62.104 62.766 -0.662 1
1 6 . 6 1 1 A 7 7 GLY H H 7 8.244 8.487 -0.243 1
1 7 . 6 1 1 A 7 7 GLY HA2 H 7 3.873 4.072 -0.199 1
1 8 . 6 1 1 A 7 7 GLY HA3 H 7 3.737 4.078 -0.341 1
1 9 . 6 1 1 A 7 7 GLY CA C 7 41.743 44.380 -2.637 1
1 10 . 6 1 1 A 7 7 GLY N N 7 109.193 112.233 -3.040 1
1 11 . 6 1 1 A 8 8 PRO HA H 8 4.286 4.553 -0.267 1
1 18 . 6 1 1 A 8 8 PRO C C 8 173.841 175.168 -1.327 1
1 19 . 6 1 1 A 8 8 PRO CA C 8 60.528 62.365 -1.837 1
1 20 . 6 1 1 A 8 8 PRO CB C 8 30.299 32.963 -2.664 1
1 23 . 6 1 1 A 9 9 LYS H H 9 8.877 8.234 0.643 1
1 24 . 6 1 1 A 9 9 LYS HA H 9 4.360 4.811 -0.451 1
1 33 . 6 1 1 A 9 9 LYS C C 9 173.492 174.030 -0.538 1
1 34 . 6 1 1 A 9 9 LYS CA C 9 52.135 52.583 -0.448 1
1 35 . 6 1 1 A 9 9 LYS CB C 9 28.798 33.853 -5.055 1
1 39 . 6 1 1 A 9 9 LYS N N 9 120.404 120.216 0.188 1
1 40 . 6 1 1 A 10 10 PRO HA H 10 4.284 4.593 -0.309 1
1 47 . 6 1 1 A 10 10 PRO CA C 10 59.326 61.600 -2.274 1
1 48 . 6 1 1 A 10 10 PRO CB C 10 28.825 31.543 -2.718 1
1 51 . 6 1 1 A 11 11 PRO HA H 11 4.468 4.731 -0.263 1
1 58 . 6 1 1 A 11 11 PRO C C 11 171.993 176.391 -4.398 1
1 59 . 6 1 1 A 11 11 PRO CA C 11 60.422 62.861 -2.439 1
1 60 . 6 1 1 A 11 11 PRO CB C 11 30.418 32.564 -2.146 1
1 63 . 6 1 1 A 12 12 ILE H H 12 7.554 8.447 -0.893 1
1 64 . 6 1 1 A 12 12 ILE HA H 12 4.676 4.558 0.118 1
1 74 . 6 1 1 A 12 12 ILE C C 12 171.721 175.190 -3.469 1
1 75 . 6 1 1 A 12 12 ILE CA C 12 56.843 59.098 -2.255 1
1 76 . 6 1 1 A 12 12 ILE CB C 12 40.560 40.629 -0.069 1
1 80 . 6 1 1 A 12 12 ILE N N 12 109.695 117.380 -7.685 1
1 81 . 6 1 1 A 13 13 ASP H H 13 8.435 9.024 -0.589 1
1 82 . 6 1 1 A 13 13 ASP HA H 13 4.094 4.263 -0.169 1
1 85 . 6 1 1 A 13 13 ASP C C 13 171.803 176.152 -4.349 1
1 86 . 6 1 1 A 13 13 ASP CA C 13 52.610 55.171 -2.561 1
1 87 . 6 1 1 A 13 13 ASP CB C 13 36.357 40.178 -3.821 1
1 88 . 6 1 1 A 13 13 ASP N N 13 116.219 122.140 -5.921 1
1 89 . 6 1 1 A 14 14 LEU H H 14 7.483 7.999 -0.516 1
1 90 . 6 1 1 A 14 14 LEU HA H 14 4.990 4.835 0.155 1
1 100 . 6 1 1 A 14 14 LEU C C 14 174.702 175.384 -0.682 1
1 101 . 6 1 1 A 14 14 LEU CA C 14 53.811 55.265 -1.454 1
1 102 . 6 1 1 A 14 14 LEU CB C 14 40.148 42.405 -2.257 1
1 106 . 6 1 1 A 14 14 LEU N N 14 118.463 121.365 -2.902 1
1 107 . 6 1 1 A 15 15 VAL H H 15 9.209 8.428 0.781 1
1 108 . 6 1 1 A 15 15 VAL HA H 15 4.250 4.747 -0.497 1
1 116 . 6 1 1 A 15 15 VAL C C 15 172.080 173.868 -1.788 1
1 117 . 6 1 1 A 15 15 VAL CA C 15 58.570 60.730 -2.160 1
1 118 . 6 1 1 A 15 15 VAL CB C 15 34.146 36.124 -1.978 1
1 121 . 6 1 1 A 15 15 VAL N N 15 124.833 127.156 -2.323 1
1 122 . 6 1 1 A 16 16 VAL H H 16 8.390 8.985 -0.595 1
1 123 . 6 1 1 A 16 16 VAL HA H 16 4.343 4.587 -0.244 1
1 131 . 6 1 1 A 16 16 VAL C C 16 174.672 175.873 -1.201 1
1 132 . 6 1 1 A 16 16 VAL CA C 16 59.188 60.558 -1.370 1
1 133 . 6 1 1 A 16 16 VAL CB C 16 29.187 33.587 -4.400 1
1 136 . 6 1 1 A 16 16 VAL N N 16 124.654 126.708 -2.054 1
1 137 . 6 1 1 A 17 17 THR H H 17 8.638 8.628 0.010 1
1 138 . 6 1 1 A 17 17 THR HA H 17 4.195 4.372 -0.177 1
1 143 . 6 1 1 A 17 17 THR C C 17 172.661 173.439 -0.778 1
1 144 . 6 1 1 A 17 17 THR CA C 17 60.318 64.416 -4.098 1
1 145 . 6 1 1 A 17 17 THR CB C 17 66.420 70.394 -3.974 1
1 147 . 6 1 1 A 17 17 THR N N 17 120.942 122.720 -1.778 1
1 148 . 6 1 1 A 18 18 GLU H H 18 7.361 7.674 -0.313 1
1 149 . 6 1 1 A 18 18 GLU HA H 18 4.497 4.802 -0.305 1
1 154 . 6 1 1 A 18 18 GLU C C 18 171.691 175.287 -3.596 1
1 155 . 6 1 1 A 18 18 GLU CA C 18 53.687 54.670 -0.983 1
1 156 . 6 1 1 A 18 18 GLU CB C 18 30.802 32.862 -2.060 1
1 158 . 6 1 1 A 18 18 GLU N N 18 119.088 119.224 -0.136 1
1 159 . 6 1 1 A 19 19 THR H H 19 8.164 8.742 -0.578 1
1 160 . 6 1 1 A 19 19 THR HA H 19 4.912 5.052 -0.140 1
1 165 . 6 1 1 A 19 19 THR C C 19 171.606 172.864 -1.258 1
1 166 . 6 1 1 A 19 19 THR CA C 19 58.473 60.688 -2.215 1
1 167 . 6 1 1 A 19 19 THR CB C 19 70.103 71.198 -1.095 1
1 169 . 6 1 1 A 19 19 THR N N 19 112.424 113.401 -0.977 1
1 170 . 6 1 1 A 20 20 THR H H 20 8.750 9.071 -0.321 1
1 171 . 6 1 1 A 20 20 THR HA H 20 4.710 4.802 -0.092 1
1 176 . 6 1 1 A 20 20 THR C C 20 172.785 175.970 -3.185 1
1 177 . 6 1 1 A 20 20 THR CA C 20 58.059 61.101 -3.042 1
1 178 . 6 1 1 A 20 20 THR CB C 20 68.782 71.171 -2.389 1
1 180 . 6 1 1 A 20 20 THR N N 20 113.438 121.168 -7.730 1
1 181 . 6 1 1 A 21 21 ALA H H 21 8.453 9.017 -0.564 1
1 182 . 6 1 1 A 21 21 ALA HA H 21 4.079 4.264 -0.185 1
1 186 . 6 1 1 A 21 21 ALA C C 21 174.130 177.919 -3.789 1
1 187 . 6 1 1 A 21 21 ALA CA C 21 52.680 55.232 -2.552 1
1 188 . 6 1 1 A 21 21 ALA CB C 21 16.893 18.544 -1.651 1
1 189 . 6 1 1 A 21 21 ALA N N 21 120.078 125.730 -5.652 1
1 190 . 6 1 1 A 22 22 THR H H 22 7.132 7.500 -0.368 1
1 191 . 6 1 1 A 22 22 THR HA H 22 4.433 4.748 -0.315 1
1 196 . 6 1 1 A 22 22 THR C C 22 171.434 173.427 -1.993 1
1 197 . 6 1 1 A 22 22 THR CA C 22 56.836 60.448 -3.612 1
1 198 . 6 1 1 A 22 22 THR CB C 22 68.772 69.168 -0.396 1
1 200 . 6 1 1 A 22 22 THR N N 22 95.772 104.255 -8.483 1
1 201 . 6 1 1 A 23 23 SER H H 23 7.326 7.714 -0.388 1
1 202 . 6 1 1 A 23 23 SER HA H 23 5.562 5.164 0.398 1
1 205 . 6 1 1 A 23 23 SER C C 23 169.267 172.371 -3.104 1
1 206 . 6 1 1 A 23 23 SER CA C 23 54.445 57.778 -3.333 1
1 207 . 6 1 1 A 23 23 SER CB C 23 65.905 66.651 -0.746 1
1 208 . 6 1 1 A 23 23 SER N N 23 115.757 115.725 0.032 1
1 209 . 6 1 1 A 24 24 VAL H H 24 7.983 8.453 -0.470 1
1 210 . 6 1 1 A 24 24 VAL HA H 24 4.334 4.593 -0.259 1
1 218 . 6 1 1 A 24 24 VAL C C 24 171.917 174.698 -2.781 1
1 219 . 6 1 1 A 24 24 VAL CA C 24 58.642 60.399 -1.757 1
1 220 . 6 1 1 A 24 24 VAL CB C 24 34.254 35.857 -1.603 1
1 223 . 6 1 1 A 24 24 VAL N N 24 116.595 121.340 -4.745 1
1 224 . 6 1 1 A 25 25 THR H H 25 8.636 8.922 -0.286 1
1 225 . 6 1 1 A 25 25 THR HA H 25 4.833 4.779 0.054 1
1 230 . 6 1 1 A 25 25 THR C C 25 169.721 172.666 -2.945 1
1 231 . 6 1 1 A 25 25 THR CA C 25 59.699 62.027 -2.328 1
1 232 . 6 1 1 A 25 25 THR CB C 25 67.303 69.807 -2.504 1
1 234 . 6 1 1 A 25 25 THR N N 25 121.690 120.759 0.931 1
1 235 . 6 1 1 A 26 26 LEU H H 26 8.629 9.056 -0.427 1
1 236 . 6 1 1 A 26 26 LEU HA H 26 5.315 5.241 0.074 1
1 246 . 6 1 1 A 26 26 LEU C C 26 173.182 175.670 -2.488 1
1 247 . 6 1 1 A 26 26 LEU CA C 26 50.643 53.348 -2.705 1
1 248 . 6 1 1 A 26 26 LEU CB C 26 43.976 45.057 -1.081 1
1 252 . 6 1 1 A 26 26 LEU N N 26 126.843 129.767 -2.924 1
1 253 . 6 1 1 A 27 27 THR H H 27 8.704 9.137 -0.433 1
1 254 . 6 1 1 A 27 27 THR HA H 27 4.822 5.168 -0.346 1
1 259 . 6 1 1 A 27 27 THR C C 27 169.840 173.372 -3.532 1
1 260 . 6 1 1 A 27 27 THR CA C 27 58.077 59.248 -1.171 1
1 261 . 6 1 1 A 27 27 THR CB C 27 69.666 72.078 -2.412 1
1 263 . 6 1 1 A 27 27 THR N N 27 111.513 116.159 -4.646 1
1 264 . 6 1 1 A 28 28 TRP H H 28 7.339 8.326 -0.987 1
1 265 . 6 1 1 A 28 28 TRP HA H 28 4.963 5.434 -0.471 1
1 274 . 6 1 1 A 28 28 TRP C C 28 170.637 172.732 -2.095 1
1 275 . 6 1 1 A 28 28 TRP CA C 28 54.438 55.809 -1.371 1
1 276 . 6 1 1 A 28 28 TRP CB C 28 27.497 30.884 -3.387 1
1 282 . 6 1 1 A 28 28 TRP N N 28 117.895 118.078 -0.183 1
1 284 . 6 1 1 A 29 29 ASP H H 29 8.696 9.263 -0.567 1
1 285 . 6 1 1 A 29 29 ASP HA H 29 4.971 5.049 -0.078 1
1 288 . 6 1 1 A 29 29 ASP C C 29 174.901 177.215 -2.314 1
1 289 . 6 1 1 A 29 29 ASP CA C 29 50.178 52.663 -2.485 1
1 290 . 6 1 1 A 29 29 ASP CB C 29 42.291 43.329 -1.038 1
1 291 . 6 1 1 A 29 29 ASP N N 29 117.477 120.474 -2.997 1
1 292 . 6 1 1 A 30 30 SER H H 30 8.800 9.060 -0.260 1
1 293 . 6 1 1 A 30 30 SER HA H 30 4.389 4.255 0.134 1
1 296 . 6 1 1 A 30 30 SER C C 30 174.032 175.087 -1.055 1
1 297 . 6 1 1 A 30 30 SER CA C 30 58.694 62.093 -3.399 1
1 298 . 6 1 1 A 30 30 SER CB C 30 62.428 63.344 -0.916 1
1 299 . 6 1 1 A 30 30 SER N N 30 118.275 118.013 0.262 1
1 300 . 6 1 1 A 31 31 GLY H H 31 8.759 8.590 0.169 1
1 301 . 6 1 1 A 31 31 GLY HA2 H 31 4.239 4.018 0.221 1
1 302 . 6 1 1 A 31 31 GLY HA3 H 31 3.555 4.046 -0.491 1
1 303 . 6 1 1 A 31 31 GLY C C 31 171.325 173.969 -2.644 1
1 304 . 6 1 1 A 31 31 GLY CA C 31 43.637 45.561 -1.924 1
1 305 . 6 1 1 A 31 31 GLY N N 31 107.961 109.499 -1.538 1
1 306 . 6 1 1 A 32 32 ASN H H 32 8.173 7.934 0.239 1
1 307 . 6 1 1 A 32 32 ASN HA H 32 4.749 5.213 -0.464 1
1 312 . 6 1 1 A 32 32 ASN C C 32 171.355 175.062 -3.707 1
1 313 . 6 1 1 A 32 32 ASN CA C 32 50.795 52.242 -1.447 1
1 314 . 6 1 1 A 32 32 ASN CB C 32 41.508 41.169 0.339 1
1 315 . 6 1 1 A 32 32 ASN N N 32 117.781 119.462 -1.681 1
1 317 . 6 1 1 A 33 33 SER HA H 33 4.291 4.663 -0.372 1
1 320 . 6 1 1 A 33 33 SER C C 33 172.449 174.173 -1.724 1
1 321 . 6 1 1 A 33 33 SER CA C 33 56.733 58.738 -2.005 1
1 322 . 6 1 1 A 33 33 SER CB C 33 60.884 64.758 -3.874 1
1 323 . 6 1 1 A 34 34 GLU H H 34 7.731 7.461 0.270 1
1 324 . 6 1 1 A 34 34 GLU HA H 34 4.556 4.616 -0.060 1
1 329 . 6 1 1 A 34 34 GLU C C 34 171.792 175.357 -3.565 1
1 330 . 6 1 1 A 34 34 GLU CA C 34 51.818 54.818 -3.000 1
1 331 . 6 1 1 A 34 34 GLU CB C 34 26.891 30.240 -3.349 1
1 333 . 6 1 1 A 34 34 GLU N N 34 122.319 119.824 2.495 1
1 334 . 6 1 1 A 35 35 PRO HA H 35 4.165 4.761 -0.596 1
1 341 . 6 1 1 A 35 35 PRO C C 35 174.288 176.602 -2.314 1
1 342 . 6 1 1 A 35 35 PRO CA C 35 61.374 62.378 -1.004 1
1 343 . 6 1 1 A 35 35 PRO CB C 35 29.887 29.616 0.271 1
1 346 . 6 1 1 A 36 36 VAL H H 36 8.348 8.117 0.231 1
1 347 . 6 1 1 A 36 36 VAL HA H 36 3.899 4.040 -0.141 1
1 355 . 6 1 1 A 36 36 VAL C C 36 173.344 176.455 -3.111 1
1 356 . 6 1 1 A 36 36 VAL CA C 36 59.014 62.700 -3.686 1
1 357 . 6 1 1 A 36 36 VAL CB C 36 31.865 31.880 -0.015 1
1 360 . 6 1 1 A 36 36 VAL N N 36 122.051 123.734 -1.683 1
1 361 . 6 1 1 A 37 37 THR H H 37 8.780 8.832 -0.052 1
1 362 . 6 1 1 A 37 37 THR HA H 37 3.923 4.214 -0.291 1
1 367 . 6 1 1 A 37 37 THR C C 37 172.171 174.568 -2.397 1
1 368 . 6 1 1 A 37 37 THR CA C 37 63.155 64.662 -1.507 1
1 369 . 6 1 1 A 37 37 THR CB C 37 65.941 69.265 -3.324 1
1 371 . 6 1 1 A 37 37 THR N N 37 122.351 120.879 1.472 1
1 372 . 6 1 1 A 38 38 TYR H H 38 7.304 7.880 -0.576 1
1 373 . 6 1 1 A 38 38 TYR HA H 38 4.439 5.117 -0.678 1
1 380 . 6 1 1 A 38 38 TYR C C 38 168.385 172.838 -4.453 1
1 381 . 6 1 1 A 38 38 TYR CA C 38 54.101 56.462 -2.361 1
1 382 . 6 1 1 A 38 38 TYR CB C 38 35.874 40.165 -4.291 1
1 387 . 6 1 1 A 38 38 TYR N N 38 113.984 115.113 -1.129 1
1 388 . 6 1 1 A 39 39 TYR H H 39 9.445 9.152 0.293 1
1 389 . 6 1 1 A 39 39 TYR HA H 39 5.293 5.392 -0.099 1
1 396 . 6 1 1 A 39 39 TYR C C 39 172.781 175.419 -2.638 1
1 397 . 6 1 1 A 39 39 TYR CA C 39 54.322 55.810 -1.488 1
1 398 . 6 1 1 A 39 39 TYR CB C 39 39.035 41.235 -2.200 1
1 401 . 6 1 1 A 39 39 TYR N N 39 115.092 118.899 -3.807 1
1 402 . 6 1 1 A 40 40 GLY H H 40 8.870 9.045 -0.175 1
1 403 . 6 1 1 A 40 40 GLY HA2 H 40 5.137 4.351 0.786 1
1 404 . 6 1 1 A 40 40 GLY HA3 H 40 3.285 4.401 -1.116 1
1 405 . 6 1 1 A 40 40 GLY C C 40 169.688 172.332 -2.644 1
1 406 . 6 1 1 A 40 40 GLY CA C 40 41.415 44.045 -2.630 1
1 407 . 6 1 1 A 40 40 GLY N N 40 106.573 110.952 -4.379 1
1 408 . 6 1 1 A 41 41 ILE H H 41 8.917 8.387 0.530 1
1 409 . 6 1 1 A 41 41 ILE HA H 41 4.527 4.878 -0.351 1
1 419 . 6 1 1 A 41 41 ILE C C 41 172.692 174.932 -2.240 1
1 420 . 6 1 1 A 41 41 ILE CA C 41 57.597 59.910 -2.313 1
1 421 . 6 1 1 A 41 41 ILE CB C 41 37.840 42.206 -4.366 1
1 425 . 6 1 1 A 41 41 ILE N N 41 121.746 121.410 0.336 1
1 426 . 6 1 1 A 42 42 GLN H H 42 9.063 8.876 0.187 1
1 427 . 6 1 1 A 42 42 GLN HA H 42 5.655 5.584 0.071 1
1 434 . 6 1 1 A 42 42 GLN C C 42 172.841 174.413 -1.572 1
1 435 . 6 1 1 A 42 42 GLN CA C 42 50.789 54.475 -3.686 1
1 436 . 6 1 1 A 42 42 GLN CB C 42 28.898 32.161 -3.263 1
1 438 . 6 1 1 A 42 42 GLN N N 42 125.141 125.546 -0.405 1
1 440 . 6 1 1 A 43 43 TYR H H 43 9.066 8.830 0.236 1
1 441 . 6 1 1 A 43 43 TYR HA H 43 5.922 5.997 -0.075 1
1 448 . 6 1 1 A 43 43 TYR C C 43 171.219 173.207 -1.988 1
1 449 . 6 1 1 A 43 43 TYR CA C 43 53.349 56.059 -2.710 1
1 450 . 6 1 1 A 43 43 TYR CB C 43 41.074 42.422 -1.348 1
1 455 . 6 1 1 A 43 43 TYR N N 43 118.018 119.981 -1.963 1
1 456 . 6 1 1 A 44 44 ARG H H 44 8.400 8.333 0.067 1
1 457 . 6 1 1 A 44 44 ARG HA H 44 4.542 4.436 0.106 1
1 464 . 6 1 1 A 44 44 ARG C C 44 171.974 173.794 -1.820 1
1 465 . 6 1 1 A 44 44 ARG CA C 44 52.453 55.075 -2.622 1
1 466 . 6 1 1 A 44 44 ARG CB C 44 31.125 33.228 -2.103 1
1 469 . 6 1 1 A 44 44 ARG N N 44 115.214 119.635 -4.421 1
1 470 . 6 1 1 A 45 45 ALA H H 45 8.846 8.013 0.833 1
1 471 . 6 1 1 A 45 45 ALA HA H 45 3.894 2.726 1.168 1
1 475 . 6 1 1 A 45 45 ALA C C 45 175.721 176.921 -1.200 1
1 476 . 6 1 1 A 45 45 ALA CA C 45 50.372 52.318 -1.946 1
1 477 . 6 1 1 A 45 45 ALA CB C 45 15.732 18.878 -3.146 1
1 478 . 6 1 1 A 45 45 ALA N N 45 126.463 126.873 -0.410 1
1 479 . 6 1 1 A 46 46 ALA H H 46 8.282 8.321 -0.039 1
1 480 . 6 1 1 A 46 46 ALA HA H 46 3.922 4.125 -0.203 1
1 484 . 6 1 1 A 46 46 ALA C C 46 176.236 177.830 -1.594 1
1 485 . 6 1 1 A 46 46 ALA CA C 46 50.773 52.939 -2.166 1
1 486 . 6 1 1 A 46 46 ALA CB C 46 16.244 18.483 -2.239 1
1 487 . 6 1 1 A 46 46 ALA N N 46 126.301 125.743 0.558 1
1 488 . 6 1 1 A 47 47 GLY HA2 H 47 3.882 3.955 -0.073 1
1 489 . 6 1 1 A 47 47 GLY HA3 H 47 3.695 3.980 -0.285 1
1 490 . 6 1 1 A 47 47 GLY C C 47 171.795 174.827 -3.032 1
1 491 . 6 1 1 A 47 47 GLY CA C 47 43.327 45.406 -2.079 1
1 492 . 6 1 1 A 48 48 THR H H 48 7.145 7.711 -0.566 1
1 493 . 6 1 1 A 48 48 THR HA H 48 4.417 4.242 0.175 1
1 498 . 6 1 1 A 48 48 THR C C 48 171.325 174.375 -3.050 1
1 499 . 6 1 1 A 48 48 THR CA C 48 58.271 62.987 -4.716 1
1 500 . 6 1 1 A 48 48 THR CB C 48 68.846 69.620 -0.774 1
1 502 . 6 1 1 A 48 48 THR N N 48 110.190 115.236 -5.046 1
1 503 . 6 1 1 A 49 49 GLU H H 49 8.346 8.540 -0.194 1
1 504 . 6 1 1 A 49 49 GLU HA H 49 4.277 4.633 -0.356 1
1 509 . 6 1 1 A 49 49 GLU C C 49 174.109 175.641 -1.532 1
1 510 . 6 1 1 A 49 49 GLU CA C 49 52.909 56.070 -3.161 1
1 511 . 6 1 1 A 49 49 GLU CB C 49 27.845 28.385 -0.540 1
1 513 . 6 1 1 A 49 49 GLU N N 49 119.985 124.938 -4.953 1
1 514 . 6 1 1 A 50 50 GLY H H 50 7.617 8.573 -0.956 1
1 515 . 6 1 1 A 50 50 GLY HA2 H 50 3.935 4.167 -0.232 1
1 516 . 6 1 1 A 50 50 GLY HA3 H 50 3.935 4.193 -0.258 1
1 517 . 6 1 1 A 50 50 GLY C C 50 168.223 172.191 -3.968 1
1 518 . 6 1 1 A 50 50 GLY CA C 50 42.121 44.536 -2.415 1
1 519 . 6 1 1 A 50 50 GLY N N 50 108.670 110.949 -2.279 1
1 520 . 6 1 1 A 51 51 PRO HA H 51 4.298 4.676 -0.378 1
1 527 . 6 1 1 A 51 51 PRO C C 51 175.067 176.679 -1.612 1
1 528 . 6 1 1 A 51 51 PRO CA C 51 60.175 62.925 -2.750 1
1 529 . 6 1 1 A 51 51 PRO CB C 51 30.052 32.415 -2.363 1
1 532 . 6 1 1 A 52 52 PHE H H 52 8.442 8.517 -0.075 1
1 533 . 6 1 1 A 52 52 PHE HA H 52 3.981 4.649 -0.668 1
1 541 . 6 1 1 A 52 52 PHE C C 52 175.141 175.613 -0.472 1
1 542 . 6 1 1 A 52 52 PHE CA C 52 56.808 57.462 -0.654 1
1 543 . 6 1 1 A 52 52 PHE CB C 52 36.830 40.990 -4.160 1
1 549 . 6 1 1 A 52 52 PHE N N 52 118.707 121.662 -2.955 1
1 550 . 6 1 1 A 53 53 GLN H H 53 8.778 8.192 0.586 1
1 551 . 6 1 1 A 53 53 GLN HA H 53 4.149 4.180 -0.031 1
1 558 . 6 1 1 A 53 53 GLN C C 53 172.773 175.316 -2.543 1
1 559 . 6 1 1 A 53 53 GLN CA C 53 52.999 56.586 -3.587 1
1 560 . 6 1 1 A 53 53 GLN CB C 53 26.962 29.233 -2.271 1
1 562 . 6 1 1 A 53 53 GLN N N 53 122.164 121.704 0.460 1
1 564 . 6 1 1 A 54 54 GLU H H 54 8.432 8.589 -0.157 1
1 565 . 6 1 1 A 54 54 GLU HA H 54 5.533 5.118 0.415 1
1 570 . 6 1 1 A 54 54 GLU C C 54 173.930 174.819 -0.889 1
1 571 . 6 1 1 A 54 54 GLU CA C 54 52.981 55.179 -2.198 1
1 572 . 6 1 1 A 54 54 GLU CB C 54 31.712 32.827 -1.115 1
1 574 . 6 1 1 A 54 54 GLU N N 54 119.688 121.184 -1.496 1
1 575 . 6 1 1 A 55 55 VAL H H 55 9.077 8.842 0.235 1
1 576 . 6 1 1 A 55 55 VAL HA H 55 4.180 4.837 -0.657 1
1 584 . 6 1 1 A 55 55 VAL C C 55 171.811 174.280 -2.469 1
1 585 . 6 1 1 A 55 55 VAL CA C 55 59.664 61.231 -1.567 1
1 586 . 6 1 1 A 55 55 VAL CB C 55 31.827 34.693 -2.866 1
1 589 . 6 1 1 A 55 55 VAL N N 55 125.328 126.029 -0.701 1
1 590 . 6 1 1 A 56 56 ASP H H 56 8.639 8.798 -0.159 1
1 591 . 6 1 1 A 56 56 ASP HA H 56 5.250 5.684 -0.434 1
1 594 . 6 1 1 A 56 56 ASP C C 56 174.252 176.063 -1.811 1
1 595 . 6 1 1 A 56 56 ASP CA C 56 50.108 52.284 -2.176 1
1 596 . 6 1 1 A 56 56 ASP CB C 56 41.407 43.986 -2.579 1
1 597 . 6 1 1 A 56 56 ASP N N 56 125.773 125.243 0.530 1
1 598 . 6 1 1 A 57 57 GLY H H 57 7.222 8.758 -1.536 1
1 599 . 6 1 1 A 57 57 GLY HA2 H 57 3.479 3.927 -0.448 1
1 600 . 6 1 1 A 57 57 GLY HA3 H 57 2.719 3.968 -1.249 1
1 601 . 6 1 1 A 57 57 GLY C C 57 172.281 174.469 -2.188 1
1 602 . 6 1 1 A 57 57 GLY CA C 57 43.919 45.555 -1.636 1
1 603 . 6 1 1 A 57 57 GLY N N 57 105.564 111.122 -5.558 1
1 604 . 6 1 1 A 58 58 VAL H H 58 8.338 8.073 0.265 1
1 605 . 6 1 1 A 58 58 VAL HA H 58 3.860 4.332 -0.472 1
1 613 . 6 1 1 A 58 58 VAL C C 58 173.981 175.317 -1.336 1
1 614 . 6 1 1 A 58 58 VAL CA C 58 61.233 61.550 -0.317 1
1 615 . 6 1 1 A 58 58 VAL CB C 58 29.708 31.428 -1.720 1
1 618 . 6 1 1 A 58 58 VAL N N 58 121.466 120.962 0.504 1
1 619 . 6 1 1 A 59 59 ALA H H 59 9.038 8.725 0.313 1
1 620 . 6 1 1 A 59 59 ALA HA H 59 4.676 4.583 0.093 1
1 624 . 6 1 1 A 59 59 ALA C C 59 175.105 176.833 -1.728 1
1 625 . 6 1 1 A 59 59 ALA CA C 59 50.866 52.205 -1.339 1
1 626 . 6 1 1 A 59 59 ALA CB C 59 17.647 19.158 -1.511 1
1 627 . 6 1 1 A 59 59 ALA N N 59 130.928 130.062 0.866 1
1 628 . 6 1 1 A 60 60 THR H H 60 7.445 7.708 -0.263 1
1 629 . 6 1 1 A 60 60 THR HA H 60 4.642 4.624 0.018 1
1 634 . 6 1 1 A 60 60 THR C C 60 169.528 174.283 -4.755 1
1 635 . 6 1 1 A 60 60 THR CA C 60 57.101 59.575 -2.474 1
1 636 . 6 1 1 A 60 60 THR CB C 60 67.982 72.337 -4.355 1
1 638 . 6 1 1 A 60 60 THR N N 60 109.256 109.042 0.214 1
1 639 . 6 1 1 A 61 61 THR H H 61 7.325 8.326 -1.001 1
1 640 . 6 1 1 A 61 61 THR HA H 61 2.896 3.643 -0.747 1
1 645 . 6 1 1 A 61 61 THR C C 61 169.678 172.781 -3.103 1
1 646 . 6 1 1 A 61 61 THR CA C 61 57.246 62.011 -4.765 1
1 647 . 6 1 1 A 61 61 THR CB C 61 63.794 68.740 -4.946 1
1 649 . 6 1 1 A 61 61 THR N N 61 105.670 111.154 -5.484 1
1 650 . 6 1 1 A 62 62 ARG H H 62 6.490 7.175 -0.685 1
1 651 . 6 1 1 A 62 62 ARG HA H 62 4.698 4.329 0.369 1
1 658 . 6 1 1 A 62 62 ARG C C 62 172.881 173.835 -0.954 1
1 659 . 6 1 1 A 62 62 ARG CA C 62 52.276 53.995 -1.719 1
1 660 . 6 1 1 A 62 62 ARG CB C 62 30.774 33.116 -2.342 1
1 663 . 6 1 1 A 62 62 ARG N N 62 117.485 121.271 -3.786 1
1 664 . 6 1 1 A 63 63 TYR H H 63 8.891 8.999 -0.108 1
1 665 . 6 1 1 A 63 63 TYR HA H 63 4.356 5.336 -0.980 1
1 672 . 6 1 1 A 63 63 TYR C C 63 170.393 173.752 -3.359 1
1 673 . 6 1 1 A 63 63 TYR CA C 63 57.284 56.968 0.316 1
1 674 . 6 1 1 A 63 63 TYR CB C 63 41.467 42.805 -1.338 1
1 679 . 6 1 1 A 63 63 TYR N N 63 124.712 127.439 -2.727 1
1 680 . 6 1 1 A 64 64 SER H H 64 7.244 8.009 -0.765 1
1 681 . 6 1 1 A 64 64 SER HA H 64 5.077 5.196 -0.119 1
1 684 . 6 1 1 A 64 64 SER C C 64 169.712 173.408 -3.696 1
1 685 . 6 1 1 A 64 64 SER CA C 64 54.181 57.271 -3.090 1
1 686 . 6 1 1 A 64 64 SER CB C 64 61.122 64.310 -3.188 1
1 687 . 6 1 1 A 64 64 SER N N 64 120.593 122.781 -2.188 1
1 688 . 6 1 1 A 65 65 ILE H H 65 8.686 8.778 -0.092 1
1 689 . 6 1 1 A 65 65 ILE HA H 65 3.937 4.779 -0.842 1
1 699 . 6 1 1 A 65 65 ILE C C 65 172.217 175.356 -3.139 1
1 700 . 6 1 1 A 65 65 ILE CA C 65 58.288 59.652 -1.364 1
1 701 . 6 1 1 A 65 65 ILE CB C 65 36.110 39.246 -3.136 1
1 705 . 6 1 1 A 65 65 ILE N N 65 127.792 127.045 0.747 1
1 706 . 6 1 1 A 66 66 GLY H H 66 7.883 8.548 -0.665 1
1 707 . 6 1 1 A 66 66 GLY HA2 H 66 4.799 4.255 0.544 1
1 708 . 6 1 1 A 66 66 GLY HA3 H 66 3.468 4.281 -0.813 1
1 709 . 6 1 1 A 66 66 GLY C C 66 171.983 173.867 -1.884 1
1 710 . 6 1 1 A 66 66 GLY CA C 66 40.534 45.033 -4.499 1
1 711 . 6 1 1 A 66 66 GLY N N 66 112.632 112.209 0.423 1
1 712 . 6 1 1 A 67 67 GLY H H 67 8.483 8.423 0.060 1
1 713 . 6 1 1 A 67 67 GLY HA2 H 67 3.836 3.945 -0.109 1
1 714 . 6 1 1 A 67 67 GLY HA3 H 67 3.682 3.972 -0.290 1
1 715 . 6 1 1 A 67 67 GLY C C 67 172.954 174.204 -1.250 1
1 716 . 6 1 1 A 67 67 GLY CA C 67 43.568 46.216 -2.648 1
1 717 . 6 1 1 A 67 67 GLY N N 67 104.625 109.422 -4.797 1
1 718 . 6 1 1 A 68 68 LEU H H 68 8.236 7.830 0.406 1
1 719 . 6 1 1 A 68 68 LEU HA H 68 4.154 4.657 -0.503 1
1 729 . 6 1 1 A 68 68 LEU C C 68 173.838 175.361 -1.523 1
1 730 . 6 1 1 A 68 68 LEU CA C 68 51.025 53.312 -2.287 1
1 731 . 6 1 1 A 68 68 LEU CB C 68 38.837 42.901 -4.064 1
1 735 . 6 1 1 A 68 68 LEU N N 68 118.919 121.469 -2.550 1
1 736 . 6 1 1 A 69 69 SER H H 69 8.284 8.815 -0.531 1
1 737 . 6 1 1 A 69 69 SER HA H 69 4.765 5.110 -0.345 1
1 740 . 6 1 1 A 69 69 SER C C 69 170.044 172.657 -2.613 1
1 741 . 6 1 1 A 69 69 SER CA C 69 54.639 54.585 0.054 1
1 742 . 6 1 1 A 69 69 SER CB C 69 61.216 64.452 -3.236 1
1 743 . 6 1 1 A 69 69 SER N N 69 116.361 116.564 -0.203 1
1 744 . 6 1 1 A 70 70 PRO HA H 70 5.141 4.571 0.570 1
1 751 . 6 1 1 A 70 70 PRO C C 70 174.858 177.514 -2.656 1
1 752 . 6 1 1 A 70 70 PRO CA C 70 60.810 63.949 -3.139 1
1 753 . 6 1 1 A 70 70 PRO CB C 70 30.657 31.685 -1.028 1
1 756 . 6 1 1 A 71 71 PHE H H 71 8.139 8.946 -0.807 1
1 757 . 6 1 1 A 71 71 PHE HA H 71 4.202 4.319 -0.117 1
1 765 . 6 1 1 A 71 71 PHE C C 71 172.870 174.348 -1.478 1
1 766 . 6 1 1 A 71 71 PHE CA C 71 55.410 59.004 -3.594 1
1 767 . 6 1 1 A 71 71 PHE CB C 71 36.027 37.597 -1.570 1
1 773 . 6 1 1 A 71 71 PHE N N 71 125.409 123.239 2.170 1
1 774 . 6 1 1 A 72 72 SER H H 72 8.182 7.793 0.389 1
1 775 . 6 1 1 A 72 72 SER HA H 72 4.755 4.996 -0.241 1
1 778 . 6 1 1 A 72 72 SER C C 72 168.850 172.571 -3.721 1
1 779 . 6 1 1 A 72 72 SER CA C 72 55.926 56.526 -0.600 1
1 780 . 6 1 1 A 72 72 SER CB C 72 64.208 66.964 -2.756 1
1 781 . 6 1 1 A 72 72 SER N N 72 113.509 110.335 3.174 1
1 782 . 6 1 1 A 73 73 GLU H H 73 8.422 8.768 -0.346 1
1 783 . 6 1 1 A 73 73 GLU HA H 73 4.966 5.136 -0.170 1
1 788 . 6 1 1 A 73 73 GLU C C 73 173.192 174.615 -1.423 1
1 789 . 6 1 1 A 73 73 GLU CA C 73 52.815 54.881 -2.066 1
1 790 . 6 1 1 A 73 73 GLU CB C 73 29.416 32.336 -2.920 1
1 792 . 6 1 1 A 73 73 GLU N N 73 123.046 123.337 -0.291 1
1 793 . 6 1 1 A 74 74 TYR H H 74 9.205 8.713 0.492 1
1 794 . 6 1 1 A 74 74 TYR HA H 74 4.799 4.811 -0.012 1
1 801 . 6 1 1 A 74 74 TYR C C 74 170.775 174.119 -3.344 1
1 802 . 6 1 1 A 74 74 TYR CA C 74 55.291 56.683 -1.392 1
1 803 . 6 1 1 A 74 74 TYR CB C 74 42.943 42.585 0.358 1
1 808 . 6 1 1 A 74 74 TYR N N 74 125.351 124.333 1.018 1
1 809 . 6 1 1 A 75 75 ALA H H 75 8.639 8.051 0.588 1
1 810 . 6 1 1 A 75 75 ALA HA H 75 5.271 5.221 0.050 1
1 814 . 6 1 1 A 75 75 ALA C C 75 173.698 175.920 -2.222 1
1 815 . 6 1 1 A 75 75 ALA CA C 75 47.904 50.292 -2.388 1
1 816 . 6 1 1 A 75 75 ALA CB C 75 19.634 20.513 -0.879 1
1 817 . 6 1 1 A 75 75 ALA N N 75 121.555 125.519 -3.964 1
1 818 . 6 1 1 A 76 76 PHE H H 76 9.066 9.387 -0.321 1
1 819 . 6 1 1 A 76 76 PHE HA H 76 5.496 5.195 0.301 1
1 827 . 6 1 1 A 76 76 PHE C C 76 172.268 175.549 -3.281 1
1 828 . 6 1 1 A 76 76 PHE CA C 76 54.216 56.879 -2.663 1
1 829 . 6 1 1 A 76 76 PHE CB C 76 41.901 41.014 0.887 1
1 835 . 6 1 1 A 76 76 PHE N N 76 116.545 123.333 -6.788 1
1 836 . 6 1 1 A 77 77 ARG H H 77 9.216 8.904 0.312 1
1 837 . 6 1 1 A 77 77 ARG HA H 77 4.357 5.151 -0.794 1
1 845 . 6 1 1 A 77 77 ARG C C 77 169.998 174.207 -4.209 1
1 846 . 6 1 1 A 77 77 ARG CA C 77 52.414 54.532 -2.118 1
1 847 . 6 1 1 A 77 77 ARG CB C 77 30.794 33.736 -2.942 1
1 850 . 6 1 1 A 77 77 ARG N N 77 115.738 120.127 -4.389 1
1 852 . 6 1 1 A 78 78 VAL H H 78 8.135 8.849 -0.714 1
1 853 . 6 1 1 A 78 78 VAL HA H 78 4.884 4.987 -0.103 1
1 861 . 6 1 1 A 78 78 VAL C C 78 171.098 174.572 -3.474 1
1 862 . 6 1 1 A 78 78 VAL CA C 78 57.566 60.573 -3.007 1
1 863 . 6 1 1 A 78 78 VAL CB C 78 33.146 33.602 -0.456 1
1 866 . 6 1 1 A 78 78 VAL N N 78 117.942 123.914 -5.972 1
1 867 . 6 1 1 A 79 79 LEU H H 79 9.167 8.432 0.735 1
1 868 . 6 1 1 A 79 79 LEU HA H 79 4.575 4.904 -0.329 1
1 878 . 6 1 1 A 79 79 LEU C C 79 171.447 174.966 -3.519 1
1 879 . 6 1 1 A 79 79 LEU CA C 79 51.642 53.537 -1.895 1
1 880 . 6 1 1 A 79 79 LEU CB C 79 42.776 45.746 -2.970 1
1 884 . 6 1 1 A 79 79 LEU N N 79 123.913 119.612 4.301 1
1 885 . 6 1 1 A 80 80 ALA H H 80 9.325 8.477 0.848 1
1 886 . 6 1 1 A 80 80 ALA HA H 80 4.654 3.596 1.058 1
1 890 . 6 1 1 A 80 80 ALA C C 80 172.070 177.204 -5.134 1
1 891 . 6 1 1 A 80 80 ALA CA C 80 48.169 51.640 -3.471 1
1 892 . 6 1 1 A 80 80 ALA CB C 80 20.366 19.365 1.001 1
1 893 . 6 1 1 A 80 80 ALA N N 80 124.135 123.611 0.524 1
1 894 . 6 1 1 A 81 81 VAL H H 81 7.953 7.900 0.053 1
1 895 . 6 1 1 A 81 81 VAL HA H 81 4.293 4.763 -0.470 1
1 903 . 6 1 1 A 81 81 VAL C C 81 172.873 174.328 -1.455 1
1 904 . 6 1 1 A 81 81 VAL CA C 81 58.959 60.663 -1.704 1
1 905 . 6 1 1 A 81 81 VAL CB C 81 31.412 34.716 -3.304 1
1 908 . 6 1 1 A 81 81 VAL N N 81 118.503 120.634 -2.131 1
1 909 . 6 1 1 A 82 82 ASN H H 82 8.262 8.295 -0.033 1
1 910 . 6 1 1 A 82 82 ASN HA H 82 4.945 4.955 -0.010 1
1 915 . 6 1 1 A 82 82 ASN C C 82 173.273 175.404 -2.131 1
1 916 . 6 1 1 A 82 82 ASN CA C 82 48.714 51.496 -2.782 1
1 917 . 6 1 1 A 82 82 ASN CB C 82 36.796 40.235 -3.439 1
1 918 . 6 1 1 A 82 82 ASN N N 82 125.425 124.281 1.144 1
1 920 . 6 1 1 A 83 83 SER HA H 83 3.966 4.100 -0.134 1
1 923 . 6 1 1 A 83 83 SER C C 83 172.812 176.852 -4.040 1
1 924 . 6 1 1 A 83 83 SER CA C 83 59.047 62.387 -3.340 1
1 925 . 6 1 1 A 83 83 SER CB C 83 60.406 62.888 -2.482 1
1 926 . 6 1 1 A 84 84 ILE H H 84 7.803 7.892 -0.089 1
1 927 . 6 1 1 A 84 84 ILE HA H 84 3.862 3.763 0.099 1
1 937 . 6 1 1 A 84 84 ILE C C 84 174.481 176.182 -1.701 1
1 938 . 6 1 1 A 84 84 ILE CA C 84 59.188 64.165 -4.977 1
1 939 . 6 1 1 A 84 84 ILE CB C 84 34.677 38.253 -3.576 1
1 943 . 6 1 1 A 84 84 ILE N N 84 121.222 119.298 1.924 1
1 944 . 6 1 1 A 85 85 GLY H H 85 7.435 7.277 0.158 1
1 945 . 6 1 1 A 85 85 GLY HA2 H 85 4.149 4.045 0.104 1
1 946 . 6 1 1 A 85 85 GLY HA3 H 85 3.747 4.046 -0.299 1
1 947 . 6 1 1 A 85 85 GLY C C 85 168.589 172.193 -3.604 1
1 948 . 6 1 1 A 85 85 GLY CA C 85 42.931 45.330 -2.399 1
1 949 . 6 1 1 A 85 85 GLY N N 85 106.320 105.623 0.697 1
1 950 . 6 1 1 A 86 86 ARG H H 86 8.190 8.423 -0.233 1
1 951 . 6 1 1 A 86 86 ARG HA H 86 4.452 4.758 -0.306 1
1 958 . 6 1 1 A 86 86 ARG C C 86 175.286 176.175 -0.889 1
1 959 . 6 1 1 A 86 86 ARG CA C 86 53.223 55.291 -2.068 1
1 960 . 6 1 1 A 86 86 ARG CB C 86 29.517 30.715 -1.198 1
1 963 . 6 1 1 A 86 86 ARG N N 86 118.339 117.462 0.877 1
1 964 . 6 1 1 A 87 87 GLY H H 87 8.900 8.594 0.306 1
1 965 . 6 1 1 A 87 87 GLY HA2 H 87 4.211 3.991 0.220 1
1 966 . 6 1 1 A 87 87 GLY HA3 H 87 3.967 4.007 -0.040 1
1 967 . 6 1 1 A 87 87 GLY C C 87 168.101 172.782 -4.681 1
1 968 . 6 1 1 A 87 87 GLY CA C 87 42.281 44.182 -1.901 1
1 969 . 6 1 1 A 87 87 GLY N N 87 113.482 109.225 4.257 1
1 970 . 6 1 1 A 88 88 PRO HA H 88 4.563 4.579 -0.016 1
1 977 . 6 1 1 A 88 88 PRO CA C 88 60.994 62.116 -1.122 1
1 978 . 6 1 1 A 88 88 PRO CB C 88 29.873 31.584 -1.711 1
1 981 . 6 1 1 A 89 89 PRO HA H 89 4.490 4.412 0.078 1
1 987 . 6 1 1 A 89 89 PRO C C 89 174.543 176.506 -1.963 1
1 988 . 6 1 1 A 89 89 PRO CA C 89 59.435 62.596 -3.161 1
1 989 . 6 1 1 A 89 89 PRO CB C 89 29.805 32.322 -2.517 1
1 992 . 6 1 1 A 90 90 SER H H 90 8.808 8.441 0.367 1
1 993 . 6 1 1 A 90 90 SER HA H 90 4.202 4.557 -0.355 1
1 996 . 6 1 1 A 90 90 SER C C 90 171.870 174.149 -2.279 1
1 997 . 6 1 1 A 90 90 SER CA C 90 55.868 58.053 -2.185 1
1 998 . 6 1 1 A 90 90 SER CB C 90 64.504 63.795 0.709 1
1 999 . 6 1 1 A 90 90 SER N N 90 113.781 117.258 -3.477 1
1 1000 . 6 1 1 A 91 91 GLU H H 91 8.291 8.553 -0.262 1
1 1001 . 6 1 1 A 91 91 GLU HA H 91 4.131 4.131 0.000 1
1 1006 . 6 1 1 A 91 91 GLU C C 91 174.882 176.804 -1.922 1
1 1007 . 6 1 1 A 91 91 GLU CA C 91 54.984 57.012 -2.028 1
1 1008 . 6 1 1 A 91 91 GLU CB C 91 27.643 29.314 -1.671 1
1 1010 . 6 1 1 A 91 91 GLU N N 91 117.930 123.225 -5.295 1
1 1011 . 6 1 1 A 92 92 ALA H H 92 8.605 8.274 0.331 1
1 1012 . 6 1 1 A 92 92 ALA HA H 92 5.068 4.390 0.678 1
1 1016 . 6 1 1 A 92 92 ALA C C 92 176.227 177.840 -1.613 1
1 1017 . 6 1 1 A 92 92 ALA CA C 92 48.997 52.949 -3.952 1
1 1018 . 6 1 1 A 92 92 ALA CB C 92 17.756 19.213 -1.457 1
1 1019 . 6 1 1 A 92 92 ALA N N 92 126.421 127.335 -0.914 1
1 1020 . 6 1 1 A 93 93 VAL H H 93 9.051 9.093 -0.042 1
1 1021 . 6 1 1 A 93 93 VAL HA H 93 4.642 4.951 -0.309 1
1 1029 . 6 1 1 A 93 93 VAL C C 93 172.010 174.460 -2.450 1
1 1030 . 6 1 1 A 93 93 VAL CA C 93 57.495 59.478 -1.983 1
1 1031 . 6 1 1 A 93 93 VAL CB C 93 32.774 33.992 -1.218 1
1 1034 . 6 1 1 A 93 93 VAL N N 93 117.322 118.563 -1.241 1
1 1035 . 6 1 1 A 94 94 ARG H H 94 8.470 8.891 -0.421 1
1 1036 . 6 1 1 A 94 94 ARG HA H 94 5.692 5.222 0.470 1
1 1043 . 6 1 1 A 94 94 ARG C C 94 173.635 175.105 -1.470 1
1 1044 . 6 1 1 A 94 94 ARG CA C 94 52.038 54.574 -2.536 1
1 1045 . 6 1 1 A 94 94 ARG CB C 94 30.966 32.007 -1.041 1
1 1048 . 6 1 1 A 94 94 ARG N N 94 122.258 122.549 -0.291 1
1 1049 . 6 1 1 A 95 95 ALA H H 95 9.051 9.004 0.047 1
1 1050 . 6 1 1 A 95 95 ALA HA H 95 4.642 5.295 -0.653 1
1 1054 . 6 1 1 A 95 95 ALA C C 95 172.285 175.147 -2.862 1
1 1055 . 6 1 1 A 95 95 ALA CA C 95 49.191 50.666 -1.475 1
1 1056 . 6 1 1 A 95 95 ALA CB C 95 22.562 22.490 0.072 1
1 1057 . 6 1 1 A 95 95 ALA N N 95 121.931 126.365 -4.434 1
1 1058 . 6 1 1 A 96 96 ARG H H 96 8.550 8.707 -0.157 1
1 1059 . 6 1 1 A 96 96 ARG HA H 96 5.407 5.157 0.250 1
1 1066 . 6 1 1 A 96 96 ARG C C 96 174.547 176.117 -1.570 1
1 1067 . 6 1 1 A 96 96 ARG CA C 96 51.439 55.115 -3.676 1
1 1068 . 6 1 1 A 96 96 ARG CB C 96 30.708 31.732 -1.024 1
1 1071 . 6 1 1 A 96 96 ARG N N 96 121.155 124.513 -3.358 1
1 1072 . 6 1 1 A 97 97 THR H H 97 8.797 9.139 -0.342 1
1 1073 . 6 1 1 A 97 97 THR HA H 97 4.116 4.445 -0.329 1
1 1078 . 6 1 1 A 97 97 THR C C 97 173.577 174.968 -1.391 1
1 1079 . 6 1 1 A 97 97 THR CA C 97 58.800 61.689 -2.889 1
1 1080 . 6 1 1 A 97 97 THR CB C 97 67.461 69.849 -2.388 1
1 1082 . 6 1 1 A 97 97 THR N N 97 114.657 117.791 -3.134 1
1 1083 . 6 1 1 A 98 98 GLY H H 98 7.505 8.406 -0.901 1
1 1084 . 6 1 1 A 98 98 GLY HA2 H 98 3.866 4.125 -0.259 1
1 1085 . 6 1 1 A 98 98 GLY HA3 H 98 3.743 4.176 -0.433 1
1 1086 . 6 1 1 A 98 98 GLY C C 98 170.637 174.958 -4.321 1
1 1087 . 6 1 1 A 98 98 GLY CA C 98 42.332 45.111 -2.779 1
1 1088 . 6 1 1 A 98 98 GLY N N 98 106.172 108.110 -1.938 1
1 1089 . 6 1 1 A 99 99 GLU H H 99 8.145 8.562 -0.417 1
1 1090 . 6 1 1 A 99 99 GLU HA H 99 4.210 4.494 -0.284 1
1 1095 . 6 1 1 A 99 99 GLU C C 99 174.134 175.738 -1.604 1
1 1096 . 6 1 1 A 99 99 GLU CA C 99 53.828 55.898 -2.070 1
1 1097 . 6 1 1 A 99 99 GLU CB C 99 28.774 28.882 -0.108 1
1 1099 . 6 1 1 A 99 99 GLU N N 99 117.634 117.764 -0.130 1
1 1100 . 6 1 1 A 100 100 GLN H H 100 8.647 7.890 0.757 1
1 1101 . 6 1 1 A 100 100 GLN HA H 100 4.247 4.591 -0.344 1
1 1108 . 6 1 1 A 100 100 GLN C C 100 173.348 175.839 -2.491 1
1 1109 . 6 1 1 A 100 100 GLN CA C 100 53.634 54.836 -1.202 1
1 1110 . 6 1 1 A 100 100 GLN CB C 100 27.392 30.690 -3.298 1
1 1112 . 6 1 1 A 100 100 GLN N N 100 121.960 121.760 0.200 1
1 1114 . 6 1 1 A 101 101 SER H H 101 8.416 8.979 -0.563 1
1 1115 . 6 1 1 A 101 101 SER HA H 101 4.418 4.092 0.326 1
1 1117 . 6 1 1 A 101 101 SER C C 101 172.148 173.410 -1.262 1
1 1118 . 6 1 1 A 101 101 SER CA C 101 55.926 59.161 -3.235 1
1 1119 . 6 1 1 A 101 101 SER CB C 101 61.617 61.875 -0.258 1
1 1120 . 6 1 1 A 101 101 SER N N 101 118.609 120.856 -2.247 1
1 1121 . 6 1 1 A 102 102 GLY H H 102 8.233 8.029 0.204 1
1 1122 . 6 1 1 A 102 102 GLY HA2 H 102 4.080 4.147 -0.067 1
1 1123 . 6 1 1 A 102 102 GLY HA3 H 102 3.981 4.150 -0.169 1
1 1124 . 6 1 1 A 102 102 GLY C C 102 169.461 174.579 -5.118 1
1 1125 . 6 1 1 A 102 102 GLY CA C 102 42.332 44.637 -2.305 1
1 1126 . 6 1 1 A 102 102 GLY N N 102 110.483 107.570 2.913 1
1 1127 . 6 1 1 A 103 103 PRO HA H 103 4.618 4.527 0.091 1
1 1134 . 6 1 1 A 103 103 PRO CA C 103 57.843 64.051 -6.208 1
1 1135 . 6 1 1 A 103 103 PRO CB C 103 28.671 31.564 -2.893 1
1 1 . 7 1 1 A 6 6 SER HA H 6 4.492 4.912 -0.420 1
1 4 . 7 1 1 A 6 6 SER CA C 6 55.621 56.914 -1.293 1
1 5 . 7 1 1 A 6 6 SER CB C 6 62.104 64.941 -2.837 1
1 6 . 7 1 1 A 7 7 GLY H H 7 8.244 8.251 -0.007 1
1 7 . 7 1 1 A 7 7 GLY HA2 H 7 3.873 4.026 -0.153 1
1 8 . 7 1 1 A 7 7 GLY HA3 H 7 3.737 4.034 -0.297 1
1 9 . 7 1 1 A 7 7 GLY CA C 7 41.743 44.084 -2.341 1
1 10 . 7 1 1 A 7 7 GLY N N 7 109.193 114.621 -5.428 1
1 11 . 7 1 1 A 8 8 PRO HA H 8 4.286 4.591 -0.305 1
1 18 . 7 1 1 A 8 8 PRO C C 8 173.841 175.490 -1.649 1
1 19 . 7 1 1 A 8 8 PRO CA C 8 60.528 62.502 -1.974 1
1 20 . 7 1 1 A 8 8 PRO CB C 8 30.299 33.020 -2.721 1
1 23 . 7 1 1 A 9 9 LYS H H 9 8.877 8.209 0.668 1
1 24 . 7 1 1 A 9 9 LYS HA H 9 4.360 4.801 -0.441 1
1 33 . 7 1 1 A 9 9 LYS C C 9 173.492 174.223 -0.731 1
1 34 . 7 1 1 A 9 9 LYS CA C 9 52.135 53.158 -1.023 1
1 35 . 7 1 1 A 9 9 LYS CB C 9 28.798 32.939 -4.141 1
1 39 . 7 1 1 A 9 9 LYS N N 9 120.404 120.462 -0.058 1
1 40 . 7 1 1 A 10 10 PRO HA H 10 4.284 4.612 -0.328 1
1 47 . 7 1 1 A 10 10 PRO CA C 10 59.326 61.614 -2.288 1
1 48 . 7 1 1 A 10 10 PRO CB C 10 28.825 31.592 -2.767 1
1 51 . 7 1 1 A 11 11 PRO HA H 11 4.468 4.785 -0.317 1
1 58 . 7 1 1 A 11 11 PRO C C 11 171.993 176.466 -4.473 1
1 59 . 7 1 1 A 11 11 PRO CA C 11 60.422 62.703 -2.281 1
1 60 . 7 1 1 A 11 11 PRO CB C 11 30.418 32.694 -2.276 1
1 63 . 7 1 1 A 12 12 ILE H H 12 7.554 8.533 -0.979 1
1 64 . 7 1 1 A 12 12 ILE HA H 12 4.676 4.664 0.012 1
1 74 . 7 1 1 A 12 12 ILE C C 12 171.721 175.132 -3.411 1
1 75 . 7 1 1 A 12 12 ILE CA C 12 56.843 59.015 -2.172 1
1 76 . 7 1 1 A 12 12 ILE CB C 12 40.560 40.968 -0.408 1
1 80 . 7 1 1 A 12 12 ILE N N 12 109.695 116.748 -7.053 1
1 81 . 7 1 1 A 13 13 ASP H H 13 8.435 9.054 -0.619 1
1 82 . 7 1 1 A 13 13 ASP HA H 13 4.094 4.256 -0.162 1
1 85 . 7 1 1 A 13 13 ASP C C 13 171.803 176.149 -4.346 1
1 86 . 7 1 1 A 13 13 ASP CA C 13 52.610 55.135 -2.525 1
1 87 . 7 1 1 A 13 13 ASP CB C 13 36.357 40.190 -3.833 1
1 88 . 7 1 1 A 13 13 ASP N N 13 116.219 122.046 -5.827 1
1 89 . 7 1 1 A 14 14 LEU H H 14 7.483 7.999 -0.516 1
1 90 . 7 1 1 A 14 14 LEU HA H 14 4.990 4.782 0.208 1
1 100 . 7 1 1 A 14 14 LEU C C 14 174.702 175.385 -0.683 1
1 101 . 7 1 1 A 14 14 LEU CA C 14 53.811 55.197 -1.386 1
1 102 . 7 1 1 A 14 14 LEU CB C 14 40.148 42.379 -2.231 1
1 106 . 7 1 1 A 14 14 LEU N N 14 118.463 121.317 -2.854 1
1 107 . 7 1 1 A 15 15 VAL H H 15 9.209 8.691 0.518 1
1 108 . 7 1 1 A 15 15 VAL HA H 15 4.250 4.717 -0.467 1
1 116 . 7 1 1 A 15 15 VAL C C 15 172.080 174.674 -2.594 1
1 117 . 7 1 1 A 15 15 VAL CA C 15 58.570 60.515 -1.945 1
1 118 . 7 1 1 A 15 15 VAL CB C 15 34.146 36.096 -1.950 1
1 121 . 7 1 1 A 15 15 VAL N N 15 124.833 127.510 -2.677 1
1 122 . 7 1 1 A 16 16 VAL H H 16 8.390 8.989 -0.599 1
1 123 . 7 1 1 A 16 16 VAL HA H 16 4.343 4.520 -0.177 1
1 131 . 7 1 1 A 16 16 VAL C C 16 174.672 175.778 -1.106 1
1 132 . 7 1 1 A 16 16 VAL CA C 16 59.188 61.458 -2.270 1
1 133 . 7 1 1 A 16 16 VAL CB C 16 29.187 33.172 -3.985 1
1 136 . 7 1 1 A 16 16 VAL N N 16 124.654 125.773 -1.119 1
1 137 . 7 1 1 A 17 17 THR H H 17 8.638 8.390 0.248 1
1 138 . 7 1 1 A 17 17 THR HA H 17 4.195 4.431 -0.236 1
1 143 . 7 1 1 A 17 17 THR C C 17 172.661 173.678 -1.017 1
1 144 . 7 1 1 A 17 17 THR CA C 17 60.318 63.443 -3.125 1
1 145 . 7 1 1 A 17 17 THR CB C 17 66.420 70.663 -4.243 1
1 147 . 7 1 1 A 17 17 THR N N 17 120.942 122.099 -1.157 1
1 148 . 7 1 1 A 18 18 GLU H H 18 7.361 7.658 -0.297 1
1 149 . 7 1 1 A 18 18 GLU HA H 18 4.497 4.749 -0.252 1
1 154 . 7 1 1 A 18 18 GLU C C 18 171.691 174.801 -3.110 1
1 155 . 7 1 1 A 18 18 GLU CA C 18 53.687 55.000 -1.313 1
1 156 . 7 1 1 A 18 18 GLU CB C 18 30.802 34.227 -3.425 1
1 158 . 7 1 1 A 18 18 GLU N N 18 119.088 118.148 0.940 1
1 159 . 7 1 1 A 19 19 THR H H 19 8.164 8.597 -0.433 1
1 160 . 7 1 1 A 19 19 THR HA H 19 4.912 5.118 -0.206 1
1 165 . 7 1 1 A 19 19 THR C C 19 171.606 172.803 -1.197 1
1 166 . 7 1 1 A 19 19 THR CA C 19 58.473 60.694 -2.221 1
1 167 . 7 1 1 A 19 19 THR CB C 19 70.103 71.212 -1.109 1
1 169 . 7 1 1 A 19 19 THR N N 19 112.424 113.515 -1.091 1
1 170 . 7 1 1 A 20 20 THR H H 20 8.750 9.070 -0.320 1
1 171 . 7 1 1 A 20 20 THR HA H 20 4.710 4.781 -0.071 1
1 176 . 7 1 1 A 20 20 THR C C 20 172.785 176.029 -3.244 1
1 177 . 7 1 1 A 20 20 THR CA C 20 58.059 61.136 -3.077 1
1 178 . 7 1 1 A 20 20 THR CB C 20 68.782 71.043 -2.261 1
1 180 . 7 1 1 A 20 20 THR N N 20 113.438 121.004 -7.566 1
1 181 . 7 1 1 A 21 21 ALA H H 21 8.453 9.002 -0.549 1
1 182 . 7 1 1 A 21 21 ALA HA H 21 4.079 4.336 -0.257 1
1 186 . 7 1 1 A 21 21 ALA C C 21 174.130 177.970 -3.840 1
1 187 . 7 1 1 A 21 21 ALA CA C 21 52.680 55.033 -2.353 1
1 188 . 7 1 1 A 21 21 ALA CB C 21 16.893 18.507 -1.614 1
1 189 . 7 1 1 A 21 21 ALA N N 21 120.078 125.528 -5.450 1
1 190 . 7 1 1 A 22 22 THR H H 22 7.132 7.543 -0.411 1
1 191 . 7 1 1 A 22 22 THR HA H 22 4.433 4.700 -0.267 1
1 196 . 7 1 1 A 22 22 THR C C 22 171.434 173.444 -2.010 1
1 197 . 7 1 1 A 22 22 THR CA C 22 56.836 60.509 -3.673 1
1 198 . 7 1 1 A 22 22 THR CB C 22 68.772 69.474 -0.702 1
1 200 . 7 1 1 A 22 22 THR N N 22 95.772 104.084 -8.312 1
1 201 . 7 1 1 A 23 23 SER H H 23 7.326 7.751 -0.425 1
1 202 . 7 1 1 A 23 23 SER HA H 23 5.562 5.255 0.307 1
1 205 . 7 1 1 A 23 23 SER C C 23 169.267 172.592 -3.325 1
1 206 . 7 1 1 A 23 23 SER CA C 23 54.445 57.642 -3.197 1
1 207 . 7 1 1 A 23 23 SER CB C 23 65.905 67.541 -1.636 1
1 208 . 7 1 1 A 23 23 SER N N 23 115.757 115.910 -0.153 1
1 209 . 7 1 1 A 24 24 VAL H H 24 7.983 8.357 -0.374 1
1 210 . 7 1 1 A 24 24 VAL HA H 24 4.334 4.619 -0.285 1
1 218 . 7 1 1 A 24 24 VAL C C 24 171.917 174.599 -2.682 1
1 219 . 7 1 1 A 24 24 VAL CA C 24 58.642 60.543 -1.901 1
1 220 . 7 1 1 A 24 24 VAL CB C 24 34.254 35.844 -1.590 1
1 223 . 7 1 1 A 24 24 VAL N N 24 116.595 121.404 -4.809 1
1 224 . 7 1 1 A 25 25 THR H H 25 8.636 8.825 -0.189 1
1 225 . 7 1 1 A 25 25 THR HA H 25 4.833 4.931 -0.098 1
1 230 . 7 1 1 A 25 25 THR C C 25 169.721 172.855 -3.134 1
1 231 . 7 1 1 A 25 25 THR CA C 25 59.699 61.686 -1.987 1
1 232 . 7 1 1 A 25 25 THR CB C 25 67.303 70.194 -2.891 1
1 234 . 7 1 1 A 25 25 THR N N 25 121.690 120.580 1.110 1
1 235 . 7 1 1 A 26 26 LEU H H 26 8.629 9.451 -0.822 1
1 236 . 7 1 1 A 26 26 LEU HA H 26 5.315 5.380 -0.065 1
1 246 . 7 1 1 A 26 26 LEU C C 26 173.182 175.483 -2.301 1
1 247 . 7 1 1 A 26 26 LEU CA C 26 50.643 53.241 -2.598 1
1 248 . 7 1 1 A 26 26 LEU CB C 26 43.976 45.540 -1.564 1
1 252 . 7 1 1 A 26 26 LEU N N 26 126.843 130.693 -3.850 1
1 253 . 7 1 1 A 27 27 THR H H 27 8.704 9.023 -0.319 1
1 254 . 7 1 1 A 27 27 THR HA H 27 4.822 5.187 -0.365 1
1 259 . 7 1 1 A 27 27 THR C C 27 169.840 173.559 -3.719 1
1 260 . 7 1 1 A 27 27 THR CA C 27 58.077 59.823 -1.746 1
1 261 . 7 1 1 A 27 27 THR CB C 27 69.666 71.463 -1.797 1
1 263 . 7 1 1 A 27 27 THR N N 27 111.513 115.833 -4.320 1
1 264 . 7 1 1 A 28 28 TRP H H 28 7.339 8.121 -0.782 1
1 265 . 7 1 1 A 28 28 TRP HA H 28 4.963 5.495 -0.532 1
1 274 . 7 1 1 A 28 28 TRP C C 28 170.637 172.642 -2.005 1
1 275 . 7 1 1 A 28 28 TRP CA C 28 54.438 55.439 -1.001 1
1 276 . 7 1 1 A 28 28 TRP CB C 28 27.497 31.399 -3.902 1
1 282 . 7 1 1 A 28 28 TRP N N 28 117.895 119.420 -1.525 1
1 284 . 7 1 1 A 29 29 ASP H H 29 8.696 9.268 -0.572 1
1 285 . 7 1 1 A 29 29 ASP HA H 29 4.971 5.013 -0.042 1
1 288 . 7 1 1 A 29 29 ASP C C 29 174.901 177.203 -2.302 1
1 289 . 7 1 1 A 29 29 ASP CA C 29 50.178 52.618 -2.440 1
1 290 . 7 1 1 A 29 29 ASP CB C 29 42.291 43.379 -1.088 1
1 291 . 7 1 1 A 29 29 ASP N N 29 117.477 120.477 -3.000 1
1 292 . 7 1 1 A 30 30 SER H H 30 8.800 8.801 -0.001 1
1 293 . 7 1 1 A 30 30 SER HA H 30 4.389 4.244 0.145 1
1 296 . 7 1 1 A 30 30 SER C C 30 174.032 175.795 -1.763 1
1 297 . 7 1 1 A 30 30 SER CA C 30 58.694 60.651 -1.957 1
1 298 . 7 1 1 A 30 30 SER CB C 30 62.428 63.509 -1.081 1
1 299 . 7 1 1 A 30 30 SER N N 30 118.275 118.113 0.162 1
1 300 . 7 1 1 A 31 31 GLY H H 31 8.759 8.539 0.220 1
1 301 . 7 1 1 A 31 31 GLY HA2 H 31 4.239 4.035 0.204 1
1 302 . 7 1 1 A 31 31 GLY HA3 H 31 3.555 4.069 -0.514 1
1 303 . 7 1 1 A 31 31 GLY C C 31 171.325 173.537 -2.212 1
1 304 . 7 1 1 A 31 31 GLY CA C 31 43.637 45.532 -1.895 1
1 305 . 7 1 1 A 31 31 GLY N N 31 107.961 110.858 -2.897 1
1 306 . 7 1 1 A 32 32 ASN H H 32 8.173 8.076 0.097 1
1 307 . 7 1 1 A 32 32 ASN HA H 32 4.749 4.913 -0.164 1
1 312 . 7 1 1 A 32 32 ASN C C 32 171.355 175.646 -4.291 1
1 313 . 7 1 1 A 32 32 ASN CA C 32 50.795 52.418 -1.623 1
1 314 . 7 1 1 A 32 32 ASN CB C 32 41.508 39.256 2.252 1
1 315 . 7 1 1 A 32 32 ASN N N 32 117.781 119.840 -2.059 1
1 317 . 7 1 1 A 33 33 SER HA H 33 4.291 4.453 -0.162 1
1 320 . 7 1 1 A 33 33 SER C C 33 172.449 174.828 -2.379 1
1 321 . 7 1 1 A 33 33 SER CA C 33 56.733 60.361 -3.628 1
1 322 . 7 1 1 A 33 33 SER CB C 33 60.884 63.336 -2.452 1
1 323 . 7 1 1 A 34 34 GLU H H 34 7.731 7.819 -0.088 1
1 324 . 7 1 1 A 34 34 GLU HA H 34 4.556 4.595 -0.039 1
1 329 . 7 1 1 A 34 34 GLU C C 34 171.792 174.230 -2.438 1
1 330 . 7 1 1 A 34 34 GLU CA C 34 51.818 54.066 -2.248 1
1 331 . 7 1 1 A 34 34 GLU CB C 34 26.891 29.139 -2.248 1
1 333 . 7 1 1 A 34 34 GLU N N 34 122.319 120.021 2.298 1
1 334 . 7 1 1 A 35 35 PRO HA H 35 4.165 4.763 -0.598 1
1 341 . 7 1 1 A 35 35 PRO C C 35 174.288 176.247 -1.959 1
1 342 . 7 1 1 A 35 35 PRO CA C 35 61.374 62.746 -1.372 1
1 343 . 7 1 1 A 35 35 PRO CB C 35 29.887 31.797 -1.910 1
1 346 . 7 1 1 A 36 36 VAL H H 36 8.348 8.525 -0.177 1
1 347 . 7 1 1 A 36 36 VAL HA H 36 3.899 4.257 -0.358 1
1 355 . 7 1 1 A 36 36 VAL C C 36 173.344 176.377 -3.033 1
1 356 . 7 1 1 A 36 36 VAL CA C 36 59.014 61.857 -2.843 1
1 357 . 7 1 1 A 36 36 VAL CB C 36 31.865 32.889 -1.024 1
1 360 . 7 1 1 A 36 36 VAL N N 36 122.051 124.382 -2.331 1
1 361 . 7 1 1 A 37 37 THR H H 37 8.780 8.300 0.480 1
1 362 . 7 1 1 A 37 37 THR HA H 37 3.923 4.173 -0.250 1
1 367 . 7 1 1 A 37 37 THR C C 37 172.171 174.497 -2.326 1
1 368 . 7 1 1 A 37 37 THR CA C 37 63.155 65.278 -2.123 1
1 369 . 7 1 1 A 37 37 THR CB C 37 65.941 69.320 -3.379 1
1 371 . 7 1 1 A 37 37 THR N N 37 122.351 120.545 1.806 1
1 372 . 7 1 1 A 38 38 TYR H H 38 7.304 7.222 0.082 1
1 373 . 7 1 1 A 38 38 TYR HA H 38 4.439 5.269 -0.830 1
1 380 . 7 1 1 A 38 38 TYR C C 38 168.385 172.592 -4.207 1
1 381 . 7 1 1 A 38 38 TYR CA C 38 54.101 56.051 -1.950 1
1 382 . 7 1 1 A 38 38 TYR CB C 38 35.874 41.249 -5.375 1
1 387 . 7 1 1 A 38 38 TYR N N 38 113.984 115.004 -1.020 1
1 388 . 7 1 1 A 39 39 TYR H H 39 9.445 9.199 0.246 1
1 389 . 7 1 1 A 39 39 TYR HA H 39 5.293 5.531 -0.238 1
1 396 . 7 1 1 A 39 39 TYR C C 39 172.781 175.818 -3.037 1
1 397 . 7 1 1 A 39 39 TYR CA C 39 54.322 55.867 -1.545 1
1 398 . 7 1 1 A 39 39 TYR CB C 39 39.035 40.638 -1.603 1
1 401 . 7 1 1 A 39 39 TYR N N 39 115.092 119.348 -4.256 1
1 402 . 7 1 1 A 40 40 GLY H H 40 8.870 8.851 0.019 1
1 403 . 7 1 1 A 40 40 GLY HA2 H 40 5.137 4.127 1.010 1
1 404 . 7 1 1 A 40 40 GLY HA3 H 40 3.285 4.185 -0.900 1
1 405 . 7 1 1 A 40 40 GLY C C 40 169.688 172.800 -3.112 1
1 406 . 7 1 1 A 40 40 GLY CA C 40 41.415 44.780 -3.365 1
1 407 . 7 1 1 A 40 40 GLY N N 40 106.573 111.944 -5.371 1
1 408 . 7 1 1 A 41 41 ILE H H 41 8.917 8.405 0.512 1
1 409 . 7 1 1 A 41 41 ILE HA H 41 4.527 4.796 -0.269 1
1 419 . 7 1 1 A 41 41 ILE C C 41 172.692 174.901 -2.209 1
1 420 . 7 1 1 A 41 41 ILE CA C 41 57.597 60.078 -2.481 1
1 421 . 7 1 1 A 41 41 ILE CB C 41 37.840 41.426 -3.586 1
1 425 . 7 1 1 A 41 41 ILE N N 41 121.746 121.755 -0.009 1
1 426 . 7 1 1 A 42 42 GLN H H 42 9.063 8.933 0.130 1
1 427 . 7 1 1 A 42 42 GLN HA H 42 5.655 5.557 0.098 1
1 434 . 7 1 1 A 42 42 GLN C C 42 172.841 174.299 -1.458 1
1 435 . 7 1 1 A 42 42 GLN CA C 42 50.789 54.588 -3.799 1
1 436 . 7 1 1 A 42 42 GLN CB C 42 28.898 31.830 -2.932 1
1 438 . 7 1 1 A 42 42 GLN N N 42 125.141 125.986 -0.845 1
1 440 . 7 1 1 A 43 43 TYR H H 43 9.066 8.771 0.295 1
1 441 . 7 1 1 A 43 43 TYR HA H 43 5.922 6.030 -0.108 1
1 448 . 7 1 1 A 43 43 TYR C C 43 171.219 172.761 -1.542 1
1 449 . 7 1 1 A 43 43 TYR CA C 43 53.349 55.837 -2.488 1
1 450 . 7 1 1 A 43 43 TYR CB C 43 41.074 42.909 -1.835 1
1 455 . 7 1 1 A 43 43 TYR N N 43 118.018 120.059 -2.041 1
1 456 . 7 1 1 A 44 44 ARG H H 44 8.400 8.555 -0.155 1
1 457 . 7 1 1 A 44 44 ARG HA H 44 4.542 4.476 0.066 1
1 464 . 7 1 1 A 44 44 ARG C C 44 171.974 174.347 -2.373 1
1 465 . 7 1 1 A 44 44 ARG CA C 44 52.453 54.476 -2.023 1
1 466 . 7 1 1 A 44 44 ARG CB C 44 31.125 32.926 -1.801 1
1 469 . 7 1 1 A 44 44 ARG N N 44 115.214 120.213 -4.999 1
1 470 . 7 1 1 A 45 45 ALA H H 45 8.846 8.318 0.528 1
1 471 . 7 1 1 A 45 45 ALA HA H 45 3.894 2.715 1.179 1
1 475 . 7 1 1 A 45 45 ALA C C 45 175.721 177.166 -1.445 1
1 476 . 7 1 1 A 45 45 ALA CA C 45 50.372 52.238 -1.866 1
1 477 . 7 1 1 A 45 45 ALA CB C 45 15.732 18.503 -2.771 1
1 478 . 7 1 1 A 45 45 ALA N N 45 126.463 127.351 -0.888 1
1 479 . 7 1 1 A 46 46 ALA H H 46 8.282 8.115 0.167 1
1 480 . 7 1 1 A 46 46 ALA HA H 46 3.922 3.758 0.164 1
1 484 . 7 1 1 A 46 46 ALA C C 46 176.236 178.237 -2.001 1
1 485 . 7 1 1 A 46 46 ALA CA C 46 50.773 53.390 -2.617 1
1 486 . 7 1 1 A 46 46 ALA CB C 46 16.244 18.442 -2.198 1
1 487 . 7 1 1 A 46 46 ALA N N 46 126.301 124.528 1.773 1
1 488 . 7 1 1 A 47 47 GLY HA2 H 47 3.882 3.953 -0.071 1
1 489 . 7 1 1 A 47 47 GLY HA3 H 47 3.695 3.978 -0.283 1
1 490 . 7 1 1 A 47 47 GLY C C 47 171.795 173.994 -2.199 1
1 491 . 7 1 1 A 47 47 GLY CA C 47 43.327 45.671 -2.344 1
1 492 . 7 1 1 A 48 48 THR H H 48 7.145 7.621 -0.476 1
1 493 . 7 1 1 A 48 48 THR HA H 48 4.417 4.308 0.109 1
1 498 . 7 1 1 A 48 48 THR C C 48 171.325 174.512 -3.187 1
1 499 . 7 1 1 A 48 48 THR CA C 48 58.271 61.973 -3.702 1
1 500 . 7 1 1 A 48 48 THR CB C 48 68.846 69.613 -0.767 1
1 502 . 7 1 1 A 48 48 THR N N 48 110.190 117.334 -7.144 1
1 503 . 7 1 1 A 49 49 GLU H H 49 8.346 8.575 -0.229 1
1 504 . 7 1 1 A 49 49 GLU HA H 49 4.277 4.790 -0.513 1
1 509 . 7 1 1 A 49 49 GLU C C 49 174.109 177.029 -2.920 1
1 510 . 7 1 1 A 49 49 GLU CA C 49 52.909 55.339 -2.430 1
1 511 . 7 1 1 A 49 49 GLU CB C 49 27.845 29.433 -1.588 1
1 513 . 7 1 1 A 49 49 GLU N N 49 119.985 122.842 -2.857 1
1 514 . 7 1 1 A 50 50 GLY H H 50 7.617 8.231 -0.614 1
1 515 . 7 1 1 A 50 50 GLY HA2 H 50 3.935 4.053 -0.118 1
1 516 . 7 1 1 A 50 50 GLY HA3 H 50 3.935 4.087 -0.152 1
1 517 . 7 1 1 A 50 50 GLY C C 50 168.223 172.974 -4.751 1
1 518 . 7 1 1 A 50 50 GLY CA C 50 42.121 44.000 -1.879 1
1 519 . 7 1 1 A 50 50 GLY N N 50 108.670 109.604 -0.934 1
1 520 . 7 1 1 A 51 51 PRO HA H 51 4.298 4.679 -0.381 1
1 527 . 7 1 1 A 51 51 PRO C C 51 175.067 176.977 -1.910 1
1 528 . 7 1 1 A 51 51 PRO CA C 51 60.175 62.967 -2.792 1
1 529 . 7 1 1 A 51 51 PRO CB C 51 30.052 32.504 -2.452 1
1 532 . 7 1 1 A 52 52 PHE H H 52 8.442 8.722 -0.280 1
1 533 . 7 1 1 A 52 52 PHE HA H 52 3.981 4.615 -0.634 1
1 541 . 7 1 1 A 52 52 PHE C C 52 175.141 175.718 -0.577 1
1 542 . 7 1 1 A 52 52 PHE CA C 52 56.808 57.786 -0.978 1
1 543 . 7 1 1 A 52 52 PHE CB C 52 36.830 39.551 -2.721 1
1 549 . 7 1 1 A 52 52 PHE N N 52 118.707 121.680 -2.973 1
1 550 . 7 1 1 A 53 53 GLN H H 53 8.778 8.239 0.539 1
1 551 . 7 1 1 A 53 53 GLN HA H 53 4.149 4.288 -0.139 1
1 558 . 7 1 1 A 53 53 GLN C C 53 172.773 174.881 -2.108 1
1 559 . 7 1 1 A 53 53 GLN CA C 53 52.999 56.452 -3.453 1
1 560 . 7 1 1 A 53 53 GLN CB C 53 26.962 29.062 -2.100 1
1 562 . 7 1 1 A 53 53 GLN N N 53 122.164 121.768 0.396 1
1 564 . 7 1 1 A 54 54 GLU H H 54 8.432 8.599 -0.167 1
1 565 . 7 1 1 A 54 54 GLU HA H 54 5.533 5.116 0.417 1
1 570 . 7 1 1 A 54 54 GLU C C 54 173.930 174.581 -0.651 1
1 571 . 7 1 1 A 54 54 GLU CA C 54 52.981 55.199 -2.218 1
1 572 . 7 1 1 A 54 54 GLU CB C 54 31.712 33.009 -1.297 1
1 574 . 7 1 1 A 54 54 GLU N N 54 119.688 122.630 -2.942 1
1 575 . 7 1 1 A 55 55 VAL H H 55 9.077 9.067 0.010 1
1 576 . 7 1 1 A 55 55 VAL HA H 55 4.180 4.861 -0.681 1
1 584 . 7 1 1 A 55 55 VAL C C 55 171.811 174.455 -2.644 1
1 585 . 7 1 1 A 55 55 VAL CA C 55 59.664 61.389 -1.725 1
1 586 . 7 1 1 A 55 55 VAL CB C 55 31.827 33.360 -1.533 1
1 589 . 7 1 1 A 55 55 VAL N N 55 125.328 126.908 -1.580 1
1 590 . 7 1 1 A 56 56 ASP H H 56 8.639 8.818 -0.179 1
1 591 . 7 1 1 A 56 56 ASP HA H 56 5.250 5.610 -0.360 1
1 594 . 7 1 1 A 56 56 ASP C C 56 174.252 176.016 -1.764 1
1 595 . 7 1 1 A 56 56 ASP CA C 56 50.108 52.216 -2.108 1
1 596 . 7 1 1 A 56 56 ASP CB C 56 41.407 44.042 -2.635 1
1 597 . 7 1 1 A 56 56 ASP N N 56 125.773 125.334 0.439 1
1 598 . 7 1 1 A 57 57 GLY H H 57 7.222 8.682 -1.460 1
1 599 . 7 1 1 A 57 57 GLY HA2 H 57 3.479 3.839 -0.360 1
1 600 . 7 1 1 A 57 57 GLY HA3 H 57 2.719 3.926 -1.207 1
1 601 . 7 1 1 A 57 57 GLY C C 57 172.281 174.465 -2.184 1
1 602 . 7 1 1 A 57 57 GLY CA C 57 43.919 44.931 -1.012 1
1 603 . 7 1 1 A 57 57 GLY N N 57 105.564 111.039 -5.475 1
1 604 . 7 1 1 A 58 58 VAL H H 58 8.338 7.954 0.384 1
1 605 . 7 1 1 A 58 58 VAL HA H 58 3.860 4.329 -0.469 1
1 613 . 7 1 1 A 58 58 VAL C C 58 173.981 175.442 -1.461 1
1 614 . 7 1 1 A 58 58 VAL CA C 58 61.233 61.847 -0.614 1
1 615 . 7 1 1 A 58 58 VAL CB C 58 29.708 30.251 -0.543 1
1 618 . 7 1 1 A 58 58 VAL N N 58 121.466 122.327 -0.861 1
1 619 . 7 1 1 A 59 59 ALA H H 59 9.038 8.710 0.328 1
1 620 . 7 1 1 A 59 59 ALA HA H 59 4.676 4.573 0.103 1
1 624 . 7 1 1 A 59 59 ALA C C 59 175.105 176.777 -1.672 1
1 625 . 7 1 1 A 59 59 ALA CA C 59 50.866 52.099 -1.233 1
1 626 . 7 1 1 A 59 59 ALA CB C 59 17.647 19.202 -1.555 1
1 627 . 7 1 1 A 59 59 ALA N N 59 130.928 130.379 0.549 1
1 628 . 7 1 1 A 60 60 THR H H 60 7.445 7.734 -0.289 1
1 629 . 7 1 1 A 60 60 THR HA H 60 4.642 4.589 0.053 1
1 634 . 7 1 1 A 60 60 THR C C 60 169.528 174.404 -4.876 1
1 635 . 7 1 1 A 60 60 THR CA C 60 57.101 59.483 -2.382 1
1 636 . 7 1 1 A 60 60 THR CB C 60 67.982 72.338 -4.356 1
1 638 . 7 1 1 A 60 60 THR N N 60 109.256 109.131 0.125 1
1 639 . 7 1 1 A 61 61 THR H H 61 7.325 8.385 -1.060 1
1 640 . 7 1 1 A 61 61 THR HA H 61 2.896 3.474 -0.578 1
1 645 . 7 1 1 A 61 61 THR C C 61 169.678 172.966 -3.288 1
1 646 . 7 1 1 A 61 61 THR CA C 61 57.246 62.062 -4.816 1
1 647 . 7 1 1 A 61 61 THR CB C 61 63.794 68.652 -4.858 1
1 649 . 7 1 1 A 61 61 THR N N 61 105.670 111.344 -5.674 1
1 650 . 7 1 1 A 62 62 ARG H H 62 6.490 7.228 -0.738 1
1 651 . 7 1 1 A 62 62 ARG HA H 62 4.698 4.609 0.089 1
1 658 . 7 1 1 A 62 62 ARG C C 62 172.881 173.869 -0.988 1
1 659 . 7 1 1 A 62 62 ARG CA C 62 52.276 54.038 -1.762 1
1 660 . 7 1 1 A 62 62 ARG CB C 62 30.774 33.387 -2.613 1
1 663 . 7 1 1 A 62 62 ARG N N 62 117.485 122.025 -4.540 1
1 664 . 7 1 1 A 63 63 TYR H H 63 8.891 8.844 0.047 1
1 665 . 7 1 1 A 63 63 TYR HA H 63 4.356 5.092 -0.736 1
1 672 . 7 1 1 A 63 63 TYR C C 63 170.393 173.771 -3.378 1
1 673 . 7 1 1 A 63 63 TYR CA C 63 57.284 57.754 -0.470 1
1 674 . 7 1 1 A 63 63 TYR CB C 63 41.467 42.337 -0.870 1
1 679 . 7 1 1 A 63 63 TYR N N 63 124.712 127.146 -2.434 1
1 680 . 7 1 1 A 64 64 SER H H 64 7.244 8.420 -1.176 1
1 681 . 7 1 1 A 64 64 SER HA H 64 5.077 5.537 -0.460 1
1 684 . 7 1 1 A 64 64 SER C C 64 169.712 173.534 -3.822 1
1 685 . 7 1 1 A 64 64 SER CA C 64 54.181 55.623 -1.442 1
1 686 . 7 1 1 A 64 64 SER CB C 64 61.122 65.805 -4.683 1
1 687 . 7 1 1 A 64 64 SER N N 64 120.593 119.648 0.945 1
1 688 . 7 1 1 A 65 65 ILE H H 65 8.686 8.924 -0.238 1
1 689 . 7 1 1 A 65 65 ILE HA H 65 3.937 4.913 -0.976 1
1 699 . 7 1 1 A 65 65 ILE C C 65 172.217 175.399 -3.182 1
1 700 . 7 1 1 A 65 65 ILE CA C 65 58.288 59.536 -1.248 1
1 701 . 7 1 1 A 65 65 ILE CB C 65 36.110 40.469 -4.359 1
1 705 . 7 1 1 A 65 65 ILE N N 65 127.792 124.137 3.655 1
1 706 . 7 1 1 A 66 66 GLY H H 66 7.883 8.556 -0.673 1
1 707 . 7 1 1 A 66 66 GLY HA2 H 66 4.799 4.342 0.457 1
1 708 . 7 1 1 A 66 66 GLY HA3 H 66 3.468 4.364 -0.896 1
1 709 . 7 1 1 A 66 66 GLY C C 66 171.983 173.974 -1.991 1
1 710 . 7 1 1 A 66 66 GLY CA C 66 40.534 45.091 -4.557 1
1 711 . 7 1 1 A 66 66 GLY N N 66 112.632 112.087 0.545 1
1 712 . 7 1 1 A 67 67 GLY H H 67 8.483 8.398 0.085 1
1 713 . 7 1 1 A 67 67 GLY HA2 H 67 3.836 3.940 -0.104 1
1 714 . 7 1 1 A 67 67 GLY HA3 H 67 3.682 3.958 -0.276 1
1 715 . 7 1 1 A 67 67 GLY C C 67 172.954 174.160 -1.206 1
1 716 . 7 1 1 A 67 67 GLY CA C 67 43.568 46.319 -2.751 1
1 717 . 7 1 1 A 67 67 GLY N N 67 104.625 110.363 -5.738 1
1 718 . 7 1 1 A 68 68 LEU H H 68 8.236 7.446 0.790 1
1 719 . 7 1 1 A 68 68 LEU HA H 68 4.154 4.764 -0.610 1
1 729 . 7 1 1 A 68 68 LEU C C 68 173.838 175.182 -1.344 1
1 730 . 7 1 1 A 68 68 LEU CA C 68 51.025 53.036 -2.011 1
1 731 . 7 1 1 A 68 68 LEU CB C 68 38.837 44.183 -5.346 1
1 735 . 7 1 1 A 68 68 LEU N N 68 118.919 120.413 -1.494 1
1 736 . 7 1 1 A 69 69 SER H H 69 8.284 8.888 -0.604 1
1 737 . 7 1 1 A 69 69 SER HA H 69 4.765 5.190 -0.425 1
1 740 . 7 1 1 A 69 69 SER C C 69 170.044 172.742 -2.698 1
1 741 . 7 1 1 A 69 69 SER CA C 69 54.639 54.500 0.139 1
1 742 . 7 1 1 A 69 69 SER CB C 69 61.216 64.731 -3.515 1
1 743 . 7 1 1 A 69 69 SER N N 69 116.361 116.464 -0.103 1
1 744 . 7 1 1 A 70 70 PRO HA H 70 5.141 4.766 0.375 1
1 751 . 7 1 1 A 70 70 PRO C C 70 174.858 177.430 -2.572 1
1 752 . 7 1 1 A 70 70 PRO CA C 70 60.810 63.969 -3.159 1
1 753 . 7 1 1 A 70 70 PRO CB C 70 30.657 32.063 -1.406 1
1 756 . 7 1 1 A 71 71 PHE H H 71 8.139 9.246 -1.107 1
1 757 . 7 1 1 A 71 71 PHE HA H 71 4.202 4.307 -0.105 1
1 765 . 7 1 1 A 71 71 PHE C C 71 172.870 174.443 -1.573 1
1 766 . 7 1 1 A 71 71 PHE CA C 71 55.410 59.050 -3.640 1
1 767 . 7 1 1 A 71 71 PHE CB C 71 36.027 37.739 -1.712 1
1 773 . 7 1 1 A 71 71 PHE N N 71 125.409 122.833 2.576 1
1 774 . 7 1 1 A 72 72 SER H H 72 8.182 7.699 0.483 1
1 775 . 7 1 1 A 72 72 SER HA H 72 4.755 4.970 -0.215 1
1 778 . 7 1 1 A 72 72 SER C C 72 168.850 172.961 -4.111 1
1 779 . 7 1 1 A 72 72 SER CA C 72 55.926 56.358 -0.432 1
1 780 . 7 1 1 A 72 72 SER CB C 72 64.208 66.136 -1.928 1
1 781 . 7 1 1 A 72 72 SER N N 72 113.509 110.721 2.788 1
1 782 . 7 1 1 A 73 73 GLU H H 73 8.422 8.458 -0.036 1
1 783 . 7 1 1 A 73 73 GLU HA H 73 4.966 5.392 -0.426 1
1 788 . 7 1 1 A 73 73 GLU C C 73 173.192 174.738 -1.546 1
1 789 . 7 1 1 A 73 73 GLU CA C 73 52.815 54.901 -2.086 1
1 790 . 7 1 1 A 73 73 GLU CB C 73 29.416 33.549 -4.133 1
1 792 . 7 1 1 A 73 73 GLU N N 73 123.046 121.429 1.617 1
1 793 . 7 1 1 A 74 74 TYR H H 74 9.205 8.669 0.536 1
1 794 . 7 1 1 A 74 74 TYR HA H 74 4.799 4.936 -0.137 1
1 801 . 7 1 1 A 74 74 TYR C C 74 170.775 174.164 -3.389 1
1 802 . 7 1 1 A 74 74 TYR CA C 74 55.291 56.751 -1.460 1
1 803 . 7 1 1 A 74 74 TYR CB C 74 42.943 42.507 0.436 1
1 808 . 7 1 1 A 74 74 TYR N N 74 125.351 124.410 0.941 1
1 809 . 7 1 1 A 75 75 ALA H H 75 8.639 8.272 0.367 1
1 810 . 7 1 1 A 75 75 ALA HA H 75 5.271 5.118 0.153 1
1 814 . 7 1 1 A 75 75 ALA C C 75 173.698 176.319 -2.621 1
1 815 . 7 1 1 A 75 75 ALA CA C 75 47.904 50.282 -2.378 1
1 816 . 7 1 1 A 75 75 ALA CB C 75 19.634 20.669 -1.035 1
1 817 . 7 1 1 A 75 75 ALA N N 75 121.555 124.743 -3.188 1
1 818 . 7 1 1 A 76 76 PHE H H 76 9.066 9.382 -0.316 1
1 819 . 7 1 1 A 76 76 PHE HA H 76 5.496 5.273 0.223 1
1 827 . 7 1 1 A 76 76 PHE C C 76 172.268 175.095 -2.827 1
1 828 . 7 1 1 A 76 76 PHE CA C 76 54.216 57.418 -3.202 1
1 829 . 7 1 1 A 76 76 PHE CB C 76 41.901 41.420 0.481 1
1 835 . 7 1 1 A 76 76 PHE N N 76 116.545 122.865 -6.320 1
1 836 . 7 1 1 A 77 77 ARG H H 77 9.216 9.123 0.093 1
1 837 . 7 1 1 A 77 77 ARG HA H 77 4.357 5.147 -0.790 1
1 845 . 7 1 1 A 77 77 ARG C C 77 169.998 174.273 -4.275 1
1 846 . 7 1 1 A 77 77 ARG CA C 77 52.414 54.847 -2.433 1
1 847 . 7 1 1 A 77 77 ARG CB C 77 30.794 33.883 -3.089 1
1 850 . 7 1 1 A 77 77 ARG N N 77 115.738 118.873 -3.135 1
1 852 . 7 1 1 A 78 78 VAL H H 78 8.135 8.759 -0.624 1
1 853 . 7 1 1 A 78 78 VAL HA H 78 4.884 4.667 0.217 1
1 861 . 7 1 1 A 78 78 VAL C C 78 171.098 175.213 -4.115 1
1 862 . 7 1 1 A 78 78 VAL CA C 78 57.566 61.246 -3.680 1
1 863 . 7 1 1 A 78 78 VAL CB C 78 33.146 32.301 0.845 1
1 866 . 7 1 1 A 78 78 VAL N N 78 117.942 125.027 -7.085 1
1 867 . 7 1 1 A 79 79 LEU H H 79 9.167 8.767 0.400 1
1 868 . 7 1 1 A 79 79 LEU HA H 79 4.575 4.983 -0.408 1
1 878 . 7 1 1 A 79 79 LEU C C 79 171.447 174.855 -3.408 1
1 879 . 7 1 1 A 79 79 LEU CA C 79 51.642 53.490 -1.848 1
1 880 . 7 1 1 A 79 79 LEU CB C 79 42.776 45.774 -2.998 1
1 884 . 7 1 1 A 79 79 LEU N N 79 123.913 119.967 3.946 1
1 885 . 7 1 1 A 80 80 ALA H H 80 9.325 8.619 0.706 1
1 886 . 7 1 1 A 80 80 ALA HA H 80 4.654 3.840 0.814 1
1 890 . 7 1 1 A 80 80 ALA C C 80 172.070 176.889 -4.819 1
1 891 . 7 1 1 A 80 80 ALA CA C 80 48.169 51.343 -3.174 1
1 892 . 7 1 1 A 80 80 ALA CB C 80 20.366 19.331 1.035 1
1 893 . 7 1 1 A 80 80 ALA N N 80 124.135 123.103 1.032 1
1 894 . 7 1 1 A 81 81 VAL H H 81 7.953 8.076 -0.123 1
1 895 . 7 1 1 A 81 81 VAL HA H 81 4.293 4.632 -0.339 1
1 903 . 7 1 1 A 81 81 VAL C C 81 172.873 174.096 -1.223 1
1 904 . 7 1 1 A 81 81 VAL CA C 81 58.959 60.086 -1.127 1
1 905 . 7 1 1 A 81 81 VAL CB C 81 31.412 34.589 -3.177 1
1 908 . 7 1 1 A 81 81 VAL N N 81 118.503 120.460 -1.957 1
1 909 . 7 1 1 A 82 82 ASN H H 82 8.262 8.565 -0.303 1
1 910 . 7 1 1 A 82 82 ASN HA H 82 4.945 5.296 -0.351 1
1 915 . 7 1 1 A 82 82 ASN C C 82 173.273 175.136 -1.863 1
1 916 . 7 1 1 A 82 82 ASN CA C 82 48.714 51.816 -3.102 1
1 917 . 7 1 1 A 82 82 ASN CB C 82 36.796 40.149 -3.353 1
1 918 . 7 1 1 A 82 82 ASN N N 82 125.425 123.280 2.145 1
1 920 . 7 1 1 A 83 83 SER HA H 83 3.966 4.136 -0.170 1
1 923 . 7 1 1 A 83 83 SER C C 83 172.812 176.927 -4.115 1
1 924 . 7 1 1 A 83 83 SER CA C 83 59.047 61.947 -2.900 1
1 925 . 7 1 1 A 83 83 SER CB C 83 60.406 62.928 -2.522 1
1 926 . 7 1 1 A 84 84 ILE H H 84 7.803 7.902 -0.099 1
1 927 . 7 1 1 A 84 84 ILE HA H 84 3.862 3.850 0.012 1
1 937 . 7 1 1 A 84 84 ILE C C 84 174.481 176.199 -1.718 1
1 938 . 7 1 1 A 84 84 ILE CA C 84 59.188 64.173 -4.985 1
1 939 . 7 1 1 A 84 84 ILE CB C 84 34.677 38.419 -3.742 1
1 943 . 7 1 1 A 84 84 ILE N N 84 121.222 118.610 2.612 1
1 944 . 7 1 1 A 85 85 GLY H H 85 7.435 7.631 -0.196 1
1 945 . 7 1 1 A 85 85 GLY HA2 H 85 4.149 4.028 0.121 1
1 946 . 7 1 1 A 85 85 GLY HA3 H 85 3.747 4.029 -0.282 1
1 947 . 7 1 1 A 85 85 GLY C C 85 168.589 172.299 -3.710 1
1 948 . 7 1 1 A 85 85 GLY CA C 85 42.931 45.333 -2.402 1
1 949 . 7 1 1 A 85 85 GLY N N 85 106.320 105.356 0.964 1
1 950 . 7 1 1 A 86 86 ARG H H 86 8.190 8.423 -0.233 1
1 951 . 7 1 1 A 86 86 ARG HA H 86 4.452 4.638 -0.186 1
1 958 . 7 1 1 A 86 86 ARG C C 86 175.286 176.280 -0.994 1
1 959 . 7 1 1 A 86 86 ARG CA C 86 53.223 55.462 -2.239 1
1 960 . 7 1 1 A 86 86 ARG CB C 86 29.517 30.607 -1.090 1
1 963 . 7 1 1 A 86 86 ARG N N 86 118.339 116.910 1.429 1
1 964 . 7 1 1 A 87 87 GLY H H 87 8.900 8.884 0.016 1
1 965 . 7 1 1 A 87 87 GLY HA2 H 87 4.211 3.982 0.229 1
1 966 . 7 1 1 A 87 87 GLY HA3 H 87 3.967 3.995 -0.028 1
1 967 . 7 1 1 A 87 87 GLY C C 87 168.101 172.857 -4.756 1
1 968 . 7 1 1 A 87 87 GLY CA C 87 42.281 44.096 -1.815 1
1 969 . 7 1 1 A 87 87 GLY N N 87 113.482 109.139 4.343 1
1 970 . 7 1 1 A 88 88 PRO HA H 88 4.563 4.572 -0.009 1
1 977 . 7 1 1 A 88 88 PRO CA C 88 60.994 62.119 -1.125 1
1 978 . 7 1 1 A 88 88 PRO CB C 88 29.873 31.557 -1.684 1
1 981 . 7 1 1 A 89 89 PRO HA H 89 4.490 4.627 -0.137 1
1 987 . 7 1 1 A 89 89 PRO C C 89 174.543 176.468 -1.925 1
1 988 . 7 1 1 A 89 89 PRO CA C 89 59.435 62.560 -3.125 1
1 989 . 7 1 1 A 89 89 PRO CB C 89 29.805 31.831 -2.026 1
1 992 . 7 1 1 A 90 90 SER H H 90 8.808 8.836 -0.028 1
1 993 . 7 1 1 A 90 90 SER HA H 90 4.202 4.562 -0.360 1
1 996 . 7 1 1 A 90 90 SER C C 90 171.870 174.172 -2.302 1
1 997 . 7 1 1 A 90 90 SER CA C 90 55.868 57.862 -1.994 1
1 998 . 7 1 1 A 90 90 SER CB C 90 64.504 63.904 0.600 1
1 999 . 7 1 1 A 90 90 SER N N 90 113.781 117.113 -3.332 1
1 1000 . 7 1 1 A 91 91 GLU H H 91 8.291 8.542 -0.251 1
1 1001 . 7 1 1 A 91 91 GLU HA H 91 4.131 4.145 -0.014 1
1 1006 . 7 1 1 A 91 91 GLU C C 91 174.882 176.777 -1.895 1
1 1007 . 7 1 1 A 91 91 GLU CA C 91 54.984 57.072 -2.088 1
1 1008 . 7 1 1 A 91 91 GLU CB C 91 27.643 29.353 -1.710 1
1 1010 . 7 1 1 A 91 91 GLU N N 91 117.930 123.356 -5.426 1
1 1011 . 7 1 1 A 92 92 ALA H H 92 8.605 8.264 0.341 1
1 1012 . 7 1 1 A 92 92 ALA HA H 92 5.068 4.759 0.309 1
1 1016 . 7 1 1 A 92 92 ALA C C 92 176.227 177.711 -1.484 1
1 1017 . 7 1 1 A 92 92 ALA CA C 92 48.997 52.984 -3.987 1
1 1018 . 7 1 1 A 92 92 ALA CB C 92 17.756 18.882 -1.126 1
1 1019 . 7 1 1 A 92 92 ALA N N 92 126.421 127.240 -0.819 1
1 1020 . 7 1 1 A 93 93 VAL H H 93 9.051 9.110 -0.059 1
1 1021 . 7 1 1 A 93 93 VAL HA H 93 4.642 4.924 -0.282 1
1 1029 . 7 1 1 A 93 93 VAL C C 93 172.010 174.840 -2.830 1
1 1030 . 7 1 1 A 93 93 VAL CA C 93 57.495 60.281 -2.786 1
1 1031 . 7 1 1 A 93 93 VAL CB C 93 32.774 34.050 -1.276 1
1 1034 . 7 1 1 A 93 93 VAL N N 93 117.322 118.813 -1.491 1
1 1035 . 7 1 1 A 94 94 ARG H H 94 8.470 8.902 -0.432 1
1 1036 . 7 1 1 A 94 94 ARG HA H 94 5.692 5.168 0.524 1
1 1043 . 7 1 1 A 94 94 ARG C C 94 173.635 175.486 -1.851 1
1 1044 . 7 1 1 A 94 94 ARG CA C 94 52.038 55.236 -3.198 1
1 1045 . 7 1 1 A 94 94 ARG CB C 94 30.966 31.725 -0.759 1
1 1048 . 7 1 1 A 94 94 ARG N N 94 122.258 124.719 -2.461 1
1 1049 . 7 1 1 A 95 95 ALA H H 95 9.051 9.063 -0.012 1
1 1050 . 7 1 1 A 95 95 ALA HA H 95 4.642 5.264 -0.622 1
1 1054 . 7 1 1 A 95 95 ALA C C 95 172.285 175.178 -2.893 1
1 1055 . 7 1 1 A 95 95 ALA CA C 95 49.191 50.634 -1.443 1
1 1056 . 7 1 1 A 95 95 ALA CB C 95 22.562 22.280 0.282 1
1 1057 . 7 1 1 A 95 95 ALA N N 95 121.931 127.282 -5.351 1
1 1058 . 7 1 1 A 96 96 ARG H H 96 8.550 8.602 -0.052 1
1 1059 . 7 1 1 A 96 96 ARG HA H 96 5.407 5.137 0.270 1
1 1066 . 7 1 1 A 96 96 ARG C C 96 174.547 176.066 -1.519 1
1 1067 . 7 1 1 A 96 96 ARG CA C 96 51.439 55.231 -3.792 1
1 1068 . 7 1 1 A 96 96 ARG CB C 96 30.708 31.551 -0.843 1
1 1071 . 7 1 1 A 96 96 ARG N N 96 121.155 124.522 -3.367 1
1 1072 . 7 1 1 A 97 97 THR H H 97 8.797 8.775 0.022 1
1 1073 . 7 1 1 A 97 97 THR HA H 97 4.116 4.550 -0.434 1
1 1078 . 7 1 1 A 97 97 THR C C 97 173.577 175.052 -1.475 1
1 1079 . 7 1 1 A 97 97 THR CA C 97 58.800 61.381 -2.581 1
1 1080 . 7 1 1 A 97 97 THR CB C 97 67.461 69.681 -2.220 1
1 1082 . 7 1 1 A 97 97 THR N N 97 114.657 117.103 -2.446 1
1 1083 . 7 1 1 A 98 98 GLY H H 98 7.505 8.368 -0.863 1
1 1084 . 7 1 1 A 98 98 GLY HA2 H 98 3.866 4.147 -0.281 1
1 1085 . 7 1 1 A 98 98 GLY HA3 H 98 3.743 4.201 -0.458 1
1 1086 . 7 1 1 A 98 98 GLY C C 98 170.637 174.973 -4.336 1
1 1087 . 7 1 1 A 98 98 GLY CA C 98 42.332 44.914 -2.582 1
1 1088 . 7 1 1 A 98 98 GLY N N 98 106.172 108.292 -2.120 1
1 1089 . 7 1 1 A 99 99 GLU H H 99 8.145 8.543 -0.398 1
1 1090 . 7 1 1 A 99 99 GLU HA H 99 4.210 4.591 -0.381 1
1 1095 . 7 1 1 A 99 99 GLU C C 99 174.134 176.865 -2.731 1
1 1096 . 7 1 1 A 99 99 GLU CA C 99 53.828 55.568 -1.740 1
1 1097 . 7 1 1 A 99 99 GLU CB C 99 28.774 28.853 -0.079 1
1 1099 . 7 1 1 A 99 99 GLU N N 99 117.634 117.351 0.283 1
1 1100 . 7 1 1 A 100 100 GLN H H 100 8.647 7.566 1.081 1
1 1101 . 7 1 1 A 100 100 GLN HA H 100 4.247 4.325 -0.078 1
1 1108 . 7 1 1 A 100 100 GLN C C 100 173.348 176.155 -2.807 1
1 1109 . 7 1 1 A 100 100 GLN CA C 100 53.634 56.362 -2.728 1
1 1110 . 7 1 1 A 100 100 GLN CB C 100 27.392 28.703 -1.311 1
1 1112 . 7 1 1 A 100 100 GLN N N 100 121.960 121.255 0.705 1
1 1114 . 7 1 1 A 101 101 SER H H 101 8.416 8.885 -0.469 1
1 1115 . 7 1 1 A 101 101 SER HA H 101 4.418 4.074 0.344 1
1 1117 . 7 1 1 A 101 101 SER C C 101 172.148 173.862 -1.714 1
1 1118 . 7 1 1 A 101 101 SER CA C 101 55.926 59.364 -3.438 1
1 1119 . 7 1 1 A 101 101 SER CB C 101 61.617 61.876 -0.259 1
1 1120 . 7 1 1 A 101 101 SER N N 101 118.609 117.193 1.416 1
1 1121 . 7 1 1 A 102 102 GLY H H 102 8.233 7.681 0.552 1
1 1122 . 7 1 1 A 102 102 GLY HA2 H 102 4.080 4.044 0.036 1
1 1123 . 7 1 1 A 102 102 GLY HA3 H 102 3.981 4.049 -0.068 1
1 1124 . 7 1 1 A 102 102 GLY C C 102 169.461 174.100 -4.639 1
1 1125 . 7 1 1 A 102 102 GLY CA C 102 42.332 45.964 -3.632 1
1 1126 . 7 1 1 A 102 102 GLY N N 102 110.483 107.197 3.286 1
1 1127 . 7 1 1 A 103 103 PRO HA H 103 4.618 4.466 0.152 1
1 1134 . 7 1 1 A 103 103 PRO CA C 103 57.843 62.724 -4.881 1
1 1135 . 7 1 1 A 103 103 PRO CB C 103 28.671 31.683 -3.012 1
1 1 . 8 1 1 A 6 6 SER HA H 6 4.492 4.820 -0.328 1
1 4 . 8 1 1 A 6 6 SER CA C 6 55.621 57.678 -2.057 1
1 5 . 8 1 1 A 6 6 SER CB C 6 62.104 65.903 -3.799 1
1 6 . 8 1 1 A 7 7 GLY H H 7 8.244 8.748 -0.504 1
1 7 . 8 1 1 A 7 7 GLY HA2 H 7 3.873 4.150 -0.277 1
1 8 . 8 1 1 A 7 7 GLY HA3 H 7 3.737 4.158 -0.421 1
1 9 . 8 1 1 A 7 7 GLY CA C 7 41.743 43.948 -2.205 1
1 10 . 8 1 1 A 7 7 GLY N N 7 109.193 112.321 -3.128 1
1 11 . 8 1 1 A 8 8 PRO HA H 8 4.286 4.534 -0.248 1
1 18 . 8 1 1 A 8 8 PRO C C 8 173.841 175.519 -1.678 1
1 19 . 8 1 1 A 8 8 PRO CA C 8 60.528 62.478 -1.950 1
1 20 . 8 1 1 A 8 8 PRO CB C 8 30.299 32.852 -2.553 1
1 23 . 8 1 1 A 9 9 LYS H H 9 8.877 8.320 0.557 1
1 24 . 8 1 1 A 9 9 LYS HA H 9 4.360 4.806 -0.446 1
1 33 . 8 1 1 A 9 9 LYS C C 9 173.492 174.310 -0.818 1
1 34 . 8 1 1 A 9 9 LYS CA C 9 52.135 53.038 -0.903 1
1 35 . 8 1 1 A 9 9 LYS CB C 9 28.798 33.639 -4.841 1
1 39 . 8 1 1 A 9 9 LYS N N 9 120.404 120.430 -0.026 1
1 40 . 8 1 1 A 10 10 PRO HA H 10 4.284 4.630 -0.346 1
1 47 . 8 1 1 A 10 10 PRO CA C 10 59.326 61.609 -2.283 1
1 48 . 8 1 1 A 10 10 PRO CB C 10 28.825 31.539 -2.714 1
1 51 . 8 1 1 A 11 11 PRO HA H 11 4.468 4.794 -0.326 1
1 58 . 8 1 1 A 11 11 PRO C C 11 171.993 176.309 -4.316 1
1 59 . 8 1 1 A 11 11 PRO CA C 11 60.422 62.725 -2.303 1
1 60 . 8 1 1 A 11 11 PRO CB C 11 30.418 32.459 -2.041 1
1 63 . 8 1 1 A 12 12 ILE H H 12 7.554 8.125 -0.571 1
1 64 . 8 1 1 A 12 12 ILE HA H 12 4.676 4.624 0.052 1
1 74 . 8 1 1 A 12 12 ILE C C 12 171.721 175.152 -3.431 1
1 75 . 8 1 1 A 12 12 ILE CA C 12 56.843 59.064 -2.221 1
1 76 . 8 1 1 A 12 12 ILE CB C 12 40.560 40.629 -0.069 1
1 80 . 8 1 1 A 12 12 ILE N N 12 109.695 117.299 -7.604 1
1 81 . 8 1 1 A 13 13 ASP H H 13 8.435 9.065 -0.630 1
1 82 . 8 1 1 A 13 13 ASP HA H 13 4.094 4.260 -0.166 1
1 85 . 8 1 1 A 13 13 ASP C C 13 171.803 176.139 -4.336 1
1 86 . 8 1 1 A 13 13 ASP CA C 13 52.610 55.124 -2.514 1
1 87 . 8 1 1 A 13 13 ASP CB C 13 36.357 40.310 -3.953 1
1 88 . 8 1 1 A 13 13 ASP N N 13 116.219 122.071 -5.852 1
1 89 . 8 1 1 A 14 14 LEU H H 14 7.483 8.002 -0.519 1
1 90 . 8 1 1 A 14 14 LEU HA H 14 4.990 4.863 0.127 1
1 100 . 8 1 1 A 14 14 LEU C C 14 174.702 175.372 -0.670 1
1 101 . 8 1 1 A 14 14 LEU CA C 14 53.811 55.481 -1.670 1
1 102 . 8 1 1 A 14 14 LEU CB C 14 40.148 42.211 -2.063 1
1 106 . 8 1 1 A 14 14 LEU N N 14 118.463 121.241 -2.778 1
1 107 . 8 1 1 A 15 15 VAL H H 15 9.209 8.525 0.684 1
1 108 . 8 1 1 A 15 15 VAL HA H 15 4.250 4.706 -0.456 1
1 116 . 8 1 1 A 15 15 VAL C C 15 172.080 173.431 -1.351 1
1 117 . 8 1 1 A 15 15 VAL CA C 15 58.570 60.502 -1.932 1
1 118 . 8 1 1 A 15 15 VAL CB C 15 34.146 35.908 -1.762 1
1 121 . 8 1 1 A 15 15 VAL N N 15 124.833 127.426 -2.593 1
1 122 . 8 1 1 A 16 16 VAL H H 16 8.390 8.602 -0.212 1
1 123 . 8 1 1 A 16 16 VAL HA H 16 4.343 5.034 -0.691 1
1 131 . 8 1 1 A 16 16 VAL C C 16 174.672 176.260 -1.588 1
1 132 . 8 1 1 A 16 16 VAL CA C 16 59.188 59.700 -0.512 1
1 133 . 8 1 1 A 16 16 VAL CB C 16 29.187 34.213 -5.026 1
1 136 . 8 1 1 A 16 16 VAL N N 16 124.654 124.439 0.215 1
1 137 . 8 1 1 A 17 17 THR H H 17 8.638 8.539 0.099 1
1 138 . 8 1 1 A 17 17 THR HA H 17 4.195 4.348 -0.153 1
1 143 . 8 1 1 A 17 17 THR C C 17 172.661 173.506 -0.845 1
1 144 . 8 1 1 A 17 17 THR CA C 17 60.318 63.968 -3.650 1
1 145 . 8 1 1 A 17 17 THR CB C 17 66.420 70.433 -4.013 1
1 147 . 8 1 1 A 17 17 THR N N 17 120.942 122.726 -1.784 1
1 148 . 8 1 1 A 18 18 GLU H H 18 7.361 7.627 -0.266 1
1 149 . 8 1 1 A 18 18 GLU HA H 18 4.497 4.712 -0.215 1
1 154 . 8 1 1 A 18 18 GLU C C 18 171.691 174.958 -3.267 1
1 155 . 8 1 1 A 18 18 GLU CA C 18 53.687 54.759 -1.072 1
1 156 . 8 1 1 A 18 18 GLU CB C 18 30.802 33.685 -2.883 1
1 158 . 8 1 1 A 18 18 GLU N N 18 119.088 118.233 0.855 1
1 159 . 8 1 1 A 19 19 THR H H 19 8.164 8.682 -0.518 1
1 160 . 8 1 1 A 19 19 THR HA H 19 4.912 5.035 -0.123 1
1 165 . 8 1 1 A 19 19 THR C C 19 171.606 172.827 -1.221 1
1 166 . 8 1 1 A 19 19 THR CA C 19 58.473 60.635 -2.162 1
1 167 . 8 1 1 A 19 19 THR CB C 19 70.103 71.050 -0.947 1
1 169 . 8 1 1 A 19 19 THR N N 19 112.424 113.664 -1.240 1
1 170 . 8 1 1 A 20 20 THR H H 20 8.750 9.141 -0.391 1
1 171 . 8 1 1 A 20 20 THR HA H 20 4.710 4.771 -0.061 1
1 176 . 8 1 1 A 20 20 THR C C 20 172.785 176.104 -3.319 1
1 177 . 8 1 1 A 20 20 THR CA C 20 58.059 61.206 -3.147 1
1 178 . 8 1 1 A 20 20 THR CB C 20 68.782 71.018 -2.236 1
1 180 . 8 1 1 A 20 20 THR N N 20 113.438 121.459 -8.021 1
1 181 . 8 1 1 A 21 21 ALA H H 21 8.453 8.890 -0.437 1
1 182 . 8 1 1 A 21 21 ALA HA H 21 4.079 4.448 -0.369 1
1 186 . 8 1 1 A 21 21 ALA C C 21 174.130 177.868 -3.738 1
1 187 . 8 1 1 A 21 21 ALA CA C 21 52.680 54.868 -2.188 1
1 188 . 8 1 1 A 21 21 ALA CB C 21 16.893 18.467 -1.574 1
1 189 . 8 1 1 A 21 21 ALA N N 21 120.078 126.045 -5.967 1
1 190 . 8 1 1 A 22 22 THR H H 22 7.132 7.547 -0.415 1
1 191 . 8 1 1 A 22 22 THR HA H 22 4.433 4.813 -0.380 1
1 196 . 8 1 1 A 22 22 THR C C 22 171.434 173.475 -2.041 1
1 197 . 8 1 1 A 22 22 THR CA C 22 56.836 60.506 -3.670 1
1 198 . 8 1 1 A 22 22 THR CB C 22 68.772 69.575 -0.803 1
1 200 . 8 1 1 A 22 22 THR N N 22 95.772 104.085 -8.313 1
1 201 . 8 1 1 A 23 23 SER H H 23 7.326 7.729 -0.403 1
1 202 . 8 1 1 A 23 23 SER HA H 23 5.562 5.315 0.247 1
1 205 . 8 1 1 A 23 23 SER C C 23 169.267 172.166 -2.899 1
1 206 . 8 1 1 A 23 23 SER CA C 23 54.445 57.699 -3.254 1
1 207 . 8 1 1 A 23 23 SER CB C 23 65.905 67.356 -1.451 1
1 208 . 8 1 1 A 23 23 SER N N 23 115.757 115.939 -0.182 1
1 209 . 8 1 1 A 24 24 VAL H H 24 7.983 8.564 -0.581 1
1 210 . 8 1 1 A 24 24 VAL HA H 24 4.334 4.480 -0.146 1
1 218 . 8 1 1 A 24 24 VAL C C 24 171.917 173.519 -1.602 1
1 219 . 8 1 1 A 24 24 VAL CA C 24 58.642 60.275 -1.633 1
1 220 . 8 1 1 A 24 24 VAL CB C 24 34.254 34.830 -0.576 1
1 223 . 8 1 1 A 24 24 VAL N N 24 116.595 120.696 -4.101 1
1 224 . 8 1 1 A 25 25 THR H H 25 8.636 8.913 -0.277 1
1 225 . 8 1 1 A 25 25 THR HA H 25 4.833 4.827 0.006 1
1 230 . 8 1 1 A 25 25 THR C C 25 169.721 172.827 -3.106 1
1 231 . 8 1 1 A 25 25 THR CA C 25 59.699 61.954 -2.255 1
1 232 . 8 1 1 A 25 25 THR CB C 25 67.303 69.846 -2.543 1
1 234 . 8 1 1 A 25 25 THR N N 25 121.690 122.730 -1.040 1
1 235 . 8 1 1 A 26 26 LEU H H 26 8.629 9.120 -0.491 1
1 236 . 8 1 1 A 26 26 LEU HA H 26 5.315 5.234 0.081 1
1 246 . 8 1 1 A 26 26 LEU C C 26 173.182 175.330 -2.148 1
1 247 . 8 1 1 A 26 26 LEU CA C 26 50.643 53.221 -2.578 1
1 248 . 8 1 1 A 26 26 LEU CB C 26 43.976 46.154 -2.178 1
1 252 . 8 1 1 A 26 26 LEU N N 26 126.843 129.911 -3.068 1
1 253 . 8 1 1 A 27 27 THR H H 27 8.704 9.251 -0.547 1
1 254 . 8 1 1 A 27 27 THR HA H 27 4.822 5.156 -0.334 1
1 259 . 8 1 1 A 27 27 THR C C 27 169.840 172.819 -2.979 1
1 260 . 8 1 1 A 27 27 THR CA C 27 58.077 59.550 -1.473 1
1 261 . 8 1 1 A 27 27 THR CB C 27 69.666 72.512 -2.846 1
1 263 . 8 1 1 A 27 27 THR N N 27 111.513 112.624 -1.111 1
1 264 . 8 1 1 A 28 28 TRP H H 28 7.339 8.123 -0.784 1
1 265 . 8 1 1 A 28 28 TRP HA H 28 4.963 5.386 -0.423 1
1 274 . 8 1 1 A 28 28 TRP C C 28 170.637 172.847 -2.210 1
1 275 . 8 1 1 A 28 28 TRP CA C 28 54.438 55.812 -1.374 1
1 276 . 8 1 1 A 28 28 TRP CB C 28 27.497 31.103 -3.606 1
1 282 . 8 1 1 A 28 28 TRP N N 28 117.895 118.219 -0.324 1
1 284 . 8 1 1 A 29 29 ASP H H 29 8.696 9.331 -0.635 1
1 285 . 8 1 1 A 29 29 ASP HA H 29 4.971 5.143 -0.172 1
1 288 . 8 1 1 A 29 29 ASP C C 29 174.901 176.852 -1.951 1
1 289 . 8 1 1 A 29 29 ASP CA C 29 50.178 52.736 -2.558 1
1 290 . 8 1 1 A 29 29 ASP CB C 29 42.291 43.722 -1.431 1
1 291 . 8 1 1 A 29 29 ASP N N 29 117.477 120.484 -3.007 1
1 292 . 8 1 1 A 30 30 SER H H 30 8.800 8.907 -0.107 1
1 293 . 8 1 1 A 30 30 SER HA H 30 4.389 4.269 0.120 1
1 296 . 8 1 1 A 30 30 SER C C 30 174.032 175.118 -1.086 1
1 297 . 8 1 1 A 30 30 SER CA C 30 58.694 61.837 -3.143 1
1 298 . 8 1 1 A 30 30 SER CB C 30 62.428 63.589 -1.161 1
1 299 . 8 1 1 A 30 30 SER N N 30 118.275 117.776 0.499 1
1 300 . 8 1 1 A 31 31 GLY H H 31 8.759 8.438 0.321 1
1 301 . 8 1 1 A 31 31 GLY HA2 H 31 4.239 4.017 0.222 1
1 302 . 8 1 1 A 31 31 GLY HA3 H 31 3.555 4.045 -0.490 1
1 303 . 8 1 1 A 31 31 GLY C C 31 171.325 174.179 -2.854 1
1 304 . 8 1 1 A 31 31 GLY CA C 31 43.637 45.678 -2.041 1
1 305 . 8 1 1 A 31 31 GLY N N 31 107.961 109.825 -1.864 1
1 306 . 8 1 1 A 32 32 ASN H H 32 8.173 8.340 -0.167 1
1 307 . 8 1 1 A 32 32 ASN HA H 32 4.749 4.974 -0.225 1
1 312 . 8 1 1 A 32 32 ASN C C 32 171.355 175.393 -4.038 1
1 313 . 8 1 1 A 32 32 ASN CA C 32 50.795 52.361 -1.566 1
1 314 . 8 1 1 A 32 32 ASN CB C 32 41.508 39.861 1.647 1
1 315 . 8 1 1 A 32 32 ASN N N 32 117.781 118.663 -0.882 1
1 317 . 8 1 1 A 33 33 SER HA H 33 4.291 4.452 -0.161 1
1 320 . 8 1 1 A 33 33 SER C C 33 172.449 175.005 -2.556 1
1 321 . 8 1 1 A 33 33 SER CA C 33 56.733 59.953 -3.220 1
1 322 . 8 1 1 A 33 33 SER CB C 33 60.884 64.496 -3.612 1
1 323 . 8 1 1 A 34 34 GLU H H 34 7.731 7.768 -0.037 1
1 324 . 8 1 1 A 34 34 GLU HA H 34 4.556 4.503 0.053 1
1 329 . 8 1 1 A 34 34 GLU C C 34 171.792 174.821 -3.029 1
1 330 . 8 1 1 A 34 34 GLU CA C 34 51.818 55.305 -3.487 1
1 331 . 8 1 1 A 34 34 GLU CB C 34 26.891 28.962 -2.071 1
1 333 . 8 1 1 A 34 34 GLU N N 34 122.319 120.990 1.329 1
1 334 . 8 1 1 A 35 35 PRO HA H 35 4.165 4.746 -0.581 1
1 341 . 8 1 1 A 35 35 PRO C C 35 174.288 176.326 -2.038 1
1 342 . 8 1 1 A 35 35 PRO CA C 35 61.374 62.742 -1.368 1
1 343 . 8 1 1 A 35 35 PRO CB C 35 29.887 31.584 -1.697 1
1 346 . 8 1 1 A 36 36 VAL H H 36 8.348 8.562 -0.214 1
1 347 . 8 1 1 A 36 36 VAL HA H 36 3.899 4.208 -0.309 1
1 355 . 8 1 1 A 36 36 VAL C C 36 173.344 176.272 -2.928 1
1 356 . 8 1 1 A 36 36 VAL CA C 36 59.014 62.007 -2.993 1
1 357 . 8 1 1 A 36 36 VAL CB C 36 31.865 32.185 -0.320 1
1 360 . 8 1 1 A 36 36 VAL N N 36 122.051 124.105 -2.054 1
1 361 . 8 1 1 A 37 37 THR H H 37 8.780 8.671 0.109 1
1 362 . 8 1 1 A 37 37 THR HA H 37 3.923 4.294 -0.371 1
1 367 . 8 1 1 A 37 37 THR C C 37 172.171 174.620 -2.449 1
1 368 . 8 1 1 A 37 37 THR CA C 37 63.155 64.452 -1.297 1
1 369 . 8 1 1 A 37 37 THR CB C 37 65.941 69.296 -3.355 1
1 371 . 8 1 1 A 37 37 THR N N 37 122.351 119.531 2.820 1
1 372 . 8 1 1 A 38 38 TYR H H 38 7.304 7.788 -0.484 1
1 373 . 8 1 1 A 38 38 TYR HA H 38 4.439 5.152 -0.713 1
1 380 . 8 1 1 A 38 38 TYR C C 38 168.385 172.678 -4.293 1
1 381 . 8 1 1 A 38 38 TYR CA C 38 54.101 56.389 -2.288 1
1 382 . 8 1 1 A 38 38 TYR CB C 38 35.874 40.545 -4.671 1
1 387 . 8 1 1 A 38 38 TYR N N 38 113.984 115.272 -1.288 1
1 388 . 8 1 1 A 39 39 TYR H H 39 9.445 8.984 0.461 1
1 389 . 8 1 1 A 39 39 TYR HA H 39 5.293 5.417 -0.124 1
1 396 . 8 1 1 A 39 39 TYR C C 39 172.781 175.663 -2.882 1
1 397 . 8 1 1 A 39 39 TYR CA C 39 54.322 55.765 -1.443 1
1 398 . 8 1 1 A 39 39 TYR CB C 39 39.035 41.215 -2.180 1
1 401 . 8 1 1 A 39 39 TYR N N 39 115.092 118.253 -3.161 1
1 402 . 8 1 1 A 40 40 GLY H H 40 8.870 8.669 0.201 1
1 403 . 8 1 1 A 40 40 GLY HA2 H 40 5.137 4.153 0.984 1
1 404 . 8 1 1 A 40 40 GLY HA3 H 40 3.285 4.255 -0.970 1
1 405 . 8 1 1 A 40 40 GLY C C 40 169.688 172.710 -3.022 1
1 406 . 8 1 1 A 40 40 GLY CA C 40 41.415 44.827 -3.412 1
1 407 . 8 1 1 A 40 40 GLY N N 40 106.573 112.245 -5.672 1
1 408 . 8 1 1 A 41 41 ILE H H 41 8.917 8.661 0.256 1
1 409 . 8 1 1 A 41 41 ILE HA H 41 4.527 4.926 -0.399 1
1 419 . 8 1 1 A 41 41 ILE C C 41 172.692 175.156 -2.464 1
1 420 . 8 1 1 A 41 41 ILE CA C 41 57.597 59.973 -2.376 1
1 421 . 8 1 1 A 41 41 ILE CB C 41 37.840 41.386 -3.546 1
1 425 . 8 1 1 A 41 41 ILE N N 41 121.746 122.348 -0.602 1
1 426 . 8 1 1 A 42 42 GLN H H 42 9.063 8.982 0.081 1
1 427 . 8 1 1 A 42 42 GLN HA H 42 5.655 5.319 0.336 1
1 434 . 8 1 1 A 42 42 GLN C C 42 172.841 174.516 -1.675 1
1 435 . 8 1 1 A 42 42 GLN CA C 42 50.789 54.424 -3.635 1
1 436 . 8 1 1 A 42 42 GLN CB C 42 28.898 32.967 -4.069 1
1 438 . 8 1 1 A 42 42 GLN N N 42 125.141 125.353 -0.212 1
1 440 . 8 1 1 A 43 43 TYR H H 43 9.066 8.910 0.156 1
1 441 . 8 1 1 A 43 43 TYR HA H 43 5.922 5.876 0.046 1
1 448 . 8 1 1 A 43 43 TYR C C 43 171.219 172.470 -1.251 1
1 449 . 8 1 1 A 43 43 TYR CA C 43 53.349 56.121 -2.772 1
1 450 . 8 1 1 A 43 43 TYR CB C 43 41.074 41.962 -0.888 1
1 455 . 8 1 1 A 43 43 TYR N N 43 118.018 119.457 -1.439 1
1 456 . 8 1 1 A 44 44 ARG H H 44 8.400 8.510 -0.110 1
1 457 . 8 1 1 A 44 44 ARG HA H 44 4.542 4.477 0.065 1
1 464 . 8 1 1 A 44 44 ARG C C 44 171.974 174.397 -2.423 1
1 465 . 8 1 1 A 44 44 ARG CA C 44 52.453 54.222 -1.769 1
1 466 . 8 1 1 A 44 44 ARG CB C 44 31.125 32.873 -1.748 1
1 469 . 8 1 1 A 44 44 ARG N N 44 115.214 120.491 -5.277 1
1 470 . 8 1 1 A 45 45 ALA H H 45 8.846 8.272 0.574 1
1 471 . 8 1 1 A 45 45 ALA HA H 45 3.894 2.331 1.563 1
1 475 . 8 1 1 A 45 45 ALA C C 45 175.721 177.216 -1.495 1
1 476 . 8 1 1 A 45 45 ALA CA C 45 50.372 52.150 -1.778 1
1 477 . 8 1 1 A 45 45 ALA CB C 45 15.732 18.902 -3.170 1
1 478 . 8 1 1 A 45 45 ALA N N 45 126.463 127.364 -0.901 1
1 479 . 8 1 1 A 46 46 ALA H H 46 8.282 8.008 0.274 1
1 480 . 8 1 1 A 46 46 ALA HA H 46 3.922 3.879 0.043 1
1 484 . 8 1 1 A 46 46 ALA C C 46 176.236 178.096 -1.860 1
1 485 . 8 1 1 A 46 46 ALA CA C 46 50.773 53.755 -2.982 1
1 486 . 8 1 1 A 46 46 ALA CB C 46 16.244 18.398 -2.154 1
1 487 . 8 1 1 A 46 46 ALA N N 46 126.301 125.233 1.068 1
1 488 . 8 1 1 A 47 47 GLY HA2 H 47 3.882 3.936 -0.054 1
1 489 . 8 1 1 A 47 47 GLY HA3 H 47 3.695 3.969 -0.274 1
1 490 . 8 1 1 A 47 47 GLY C C 47 171.795 174.559 -2.764 1
1 491 . 8 1 1 A 47 47 GLY CA C 47 43.327 45.046 -1.719 1
1 492 . 8 1 1 A 48 48 THR H H 48 7.145 7.533 -0.388 1
1 493 . 8 1 1 A 48 48 THR HA H 48 4.417 4.172 0.245 1
1 498 . 8 1 1 A 48 48 THR C C 48 171.325 174.768 -3.443 1
1 499 . 8 1 1 A 48 48 THR CA C 48 58.271 63.501 -5.230 1
1 500 . 8 1 1 A 48 48 THR CB C 48 68.846 69.005 -0.159 1
1 502 . 8 1 1 A 48 48 THR N N 48 110.190 115.352 -5.162 1
1 503 . 8 1 1 A 49 49 GLU H H 49 8.346 8.928 -0.582 1
1 504 . 8 1 1 A 49 49 GLU HA H 49 4.277 4.678 -0.401 1
1 509 . 8 1 1 A 49 49 GLU C C 49 174.109 176.235 -2.126 1
1 510 . 8 1 1 A 49 49 GLU CA C 49 52.909 56.329 -3.420 1
1 511 . 8 1 1 A 49 49 GLU CB C 49 27.845 30.123 -2.278 1
1 513 . 8 1 1 A 49 49 GLU N N 49 119.985 125.872 -5.887 1
1 514 . 8 1 1 A 50 50 GLY H H 50 7.617 8.226 -0.609 1
1 515 . 8 1 1 A 50 50 GLY HA2 H 50 3.935 4.114 -0.179 1
1 516 . 8 1 1 A 50 50 GLY HA3 H 50 3.935 4.116 -0.181 1
1 517 . 8 1 1 A 50 50 GLY C C 50 168.223 173.001 -4.778 1
1 518 . 8 1 1 A 50 50 GLY CA C 50 42.121 44.019 -1.898 1
1 519 . 8 1 1 A 50 50 GLY N N 50 108.670 108.738 -0.068 1
1 520 . 8 1 1 A 51 51 PRO HA H 51 4.298 4.681 -0.383 1
1 527 . 8 1 1 A 51 51 PRO C C 51 175.067 177.097 -2.030 1
1 528 . 8 1 1 A 51 51 PRO CA C 51 60.175 63.149 -2.974 1
1 529 . 8 1 1 A 51 51 PRO CB C 51 30.052 32.008 -1.956 1
1 532 . 8 1 1 A 52 52 PHE H H 52 8.442 8.592 -0.150 1
1 533 . 8 1 1 A 52 52 PHE HA H 52 3.981 4.613 -0.632 1
1 541 . 8 1 1 A 52 52 PHE C C 52 175.141 175.600 -0.459 1
1 542 . 8 1 1 A 52 52 PHE CA C 52 56.808 57.772 -0.964 1
1 543 . 8 1 1 A 52 52 PHE CB C 52 36.830 39.705 -2.875 1
1 549 . 8 1 1 A 52 52 PHE N N 52 118.707 122.930 -4.223 1
1 550 . 8 1 1 A 53 53 GLN H H 53 8.778 7.838 0.940 1
1 551 . 8 1 1 A 53 53 GLN HA H 53 4.149 4.197 -0.048 1
1 558 . 8 1 1 A 53 53 GLN C C 53 172.773 175.373 -2.600 1
1 559 . 8 1 1 A 53 53 GLN CA C 53 52.999 56.608 -3.609 1
1 560 . 8 1 1 A 53 53 GLN CB C 53 26.962 29.381 -2.419 1
1 562 . 8 1 1 A 53 53 GLN N N 53 122.164 121.542 0.622 1
1 564 . 8 1 1 A 54 54 GLU H H 54 8.432 8.582 -0.150 1
1 565 . 8 1 1 A 54 54 GLU HA H 54 5.533 5.030 0.503 1
1 570 . 8 1 1 A 54 54 GLU C C 54 173.930 174.631 -0.701 1
1 571 . 8 1 1 A 54 54 GLU CA C 54 52.981 55.608 -2.627 1
1 572 . 8 1 1 A 54 54 GLU CB C 54 31.712 32.724 -1.012 1
1 574 . 8 1 1 A 54 54 GLU N N 54 119.688 121.210 -1.522 1
1 575 . 8 1 1 A 55 55 VAL H H 55 9.077 9.328 -0.251 1
1 576 . 8 1 1 A 55 55 VAL HA H 55 4.180 4.896 -0.716 1
1 584 . 8 1 1 A 55 55 VAL C C 55 171.811 174.501 -2.690 1
1 585 . 8 1 1 A 55 55 VAL CA C 55 59.664 61.277 -1.613 1
1 586 . 8 1 1 A 55 55 VAL CB C 55 31.827 33.817 -1.990 1
1 589 . 8 1 1 A 55 55 VAL N N 55 125.328 126.713 -1.385 1
1 590 . 8 1 1 A 56 56 ASP H H 56 8.639 8.779 -0.140 1
1 591 . 8 1 1 A 56 56 ASP HA H 56 5.250 5.682 -0.432 1
1 594 . 8 1 1 A 56 56 ASP C C 56 174.252 175.975 -1.723 1
1 595 . 8 1 1 A 56 56 ASP CA C 56 50.108 52.352 -2.244 1
1 596 . 8 1 1 A 56 56 ASP CB C 56 41.407 44.094 -2.687 1
1 597 . 8 1 1 A 56 56 ASP N N 56 125.773 125.175 0.598 1
1 598 . 8 1 1 A 57 57 GLY H H 57 7.222 8.760 -1.538 1
1 599 . 8 1 1 A 57 57 GLY HA2 H 57 3.479 3.889 -0.410 1
1 600 . 8 1 1 A 57 57 GLY HA3 H 57 2.719 3.939 -1.220 1
1 601 . 8 1 1 A 57 57 GLY C C 57 172.281 174.439 -2.158 1
1 602 . 8 1 1 A 57 57 GLY CA C 57 43.919 45.282 -1.363 1
1 603 . 8 1 1 A 57 57 GLY N N 57 105.564 110.911 -5.347 1
1 604 . 8 1 1 A 58 58 VAL H H 58 8.338 8.052 0.286 1
1 605 . 8 1 1 A 58 58 VAL HA H 58 3.860 4.240 -0.380 1
1 613 . 8 1 1 A 58 58 VAL C C 58 173.981 175.289 -1.308 1
1 614 . 8 1 1 A 58 58 VAL CA C 58 61.233 61.535 -0.302 1
1 615 . 8 1 1 A 58 58 VAL CB C 58 29.708 31.846 -2.138 1
1 618 . 8 1 1 A 58 58 VAL N N 58 121.466 120.988 0.478 1
1 619 . 8 1 1 A 59 59 ALA H H 59 9.038 8.712 0.326 1
1 620 . 8 1 1 A 59 59 ALA HA H 59 4.676 4.696 -0.020 1
1 624 . 8 1 1 A 59 59 ALA C C 59 175.105 176.801 -1.696 1
1 625 . 8 1 1 A 59 59 ALA CA C 59 50.866 51.968 -1.102 1
1 626 . 8 1 1 A 59 59 ALA CB C 59 17.647 19.279 -1.632 1
1 627 . 8 1 1 A 59 59 ALA N N 59 130.928 129.753 1.175 1
1 628 . 8 1 1 A 60 60 THR H H 60 7.445 7.701 -0.256 1
1 629 . 8 1 1 A 60 60 THR HA H 60 4.642 4.688 -0.046 1
1 634 . 8 1 1 A 60 60 THR C C 60 169.528 174.003 -4.475 1
1 635 . 8 1 1 A 60 60 THR CA C 60 57.101 59.237 -2.136 1
1 636 . 8 1 1 A 60 60 THR CB C 60 67.982 72.198 -4.216 1
1 638 . 8 1 1 A 60 60 THR N N 60 109.256 109.521 -0.265 1
1 639 . 8 1 1 A 61 61 THR H H 61 7.325 8.425 -1.100 1
1 640 . 8 1 1 A 61 61 THR HA H 61 2.896 3.582 -0.686 1
1 645 . 8 1 1 A 61 61 THR C C 61 169.678 173.201 -3.523 1
1 646 . 8 1 1 A 61 61 THR CA C 61 57.246 61.513 -4.267 1
1 647 . 8 1 1 A 61 61 THR CB C 61 63.794 68.528 -4.734 1
1 649 . 8 1 1 A 61 61 THR N N 61 105.670 110.793 -5.123 1
1 650 . 8 1 1 A 62 62 ARG H H 62 6.490 7.050 -0.560 1
1 651 . 8 1 1 A 62 62 ARG HA H 62 4.698 4.285 0.413 1
1 658 . 8 1 1 A 62 62 ARG C C 62 172.881 173.414 -0.533 1
1 659 . 8 1 1 A 62 62 ARG CA C 62 52.276 55.118 -2.842 1
1 660 . 8 1 1 A 62 62 ARG CB C 62 30.774 33.369 -2.595 1
1 663 . 8 1 1 A 62 62 ARG N N 62 117.485 122.157 -4.672 1
1 664 . 8 1 1 A 63 63 TYR H H 63 8.891 8.638 0.253 1
1 665 . 8 1 1 A 63 63 TYR HA H 63 4.356 5.223 -0.867 1
1 672 . 8 1 1 A 63 63 TYR C C 63 170.393 173.949 -3.556 1
1 673 . 8 1 1 A 63 63 TYR CA C 63 57.284 57.626 -0.342 1
1 674 . 8 1 1 A 63 63 TYR CB C 63 41.467 42.330 -0.863 1
1 679 . 8 1 1 A 63 63 TYR N N 63 124.712 126.849 -2.137 1
1 680 . 8 1 1 A 64 64 SER H H 64 7.244 8.297 -1.053 1
1 681 . 8 1 1 A 64 64 SER HA H 64 5.077 5.602 -0.525 1
1 684 . 8 1 1 A 64 64 SER C C 64 169.712 173.258 -3.546 1
1 685 . 8 1 1 A 64 64 SER CA C 64 54.181 55.318 -1.137 1
1 686 . 8 1 1 A 64 64 SER CB C 64 61.122 65.558 -4.436 1
1 687 . 8 1 1 A 64 64 SER N N 64 120.593 119.052 1.541 1
1 688 . 8 1 1 A 65 65 ILE H H 65 8.686 8.741 -0.055 1
1 689 . 8 1 1 A 65 65 ILE HA H 65 3.937 4.847 -0.910 1
1 699 . 8 1 1 A 65 65 ILE C C 65 172.217 175.036 -2.819 1
1 700 . 8 1 1 A 65 65 ILE CA C 65 58.288 59.439 -1.151 1
1 701 . 8 1 1 A 65 65 ILE CB C 65 36.110 40.261 -4.151 1
1 705 . 8 1 1 A 65 65 ILE N N 65 127.792 124.079 3.713 1
1 706 . 8 1 1 A 66 66 GLY H H 66 7.883 8.575 -0.692 1
1 707 . 8 1 1 A 66 66 GLY HA2 H 66 4.799 4.165 0.634 1
1 708 . 8 1 1 A 66 66 GLY HA3 H 66 3.468 4.194 -0.726 1
1 709 . 8 1 1 A 66 66 GLY C C 66 171.983 173.958 -1.975 1
1 710 . 8 1 1 A 66 66 GLY CA C 66 40.534 44.555 -4.021 1
1 711 . 8 1 1 A 66 66 GLY N N 66 112.632 114.048 -1.416 1
1 712 . 8 1 1 A 67 67 GLY H H 67 8.483 8.424 0.059 1
1 713 . 8 1 1 A 67 67 GLY HA2 H 67 3.836 3.949 -0.113 1
1 714 . 8 1 1 A 67 67 GLY HA3 H 67 3.682 3.975 -0.293 1
1 715 . 8 1 1 A 67 67 GLY C C 67 172.954 174.081 -1.127 1
1 716 . 8 1 1 A 67 67 GLY CA C 67 43.568 46.256 -2.688 1
1 717 . 8 1 1 A 67 67 GLY N N 67 104.625 108.951 -4.326 1
1 718 . 8 1 1 A 68 68 LEU H H 68 8.236 7.325 0.911 1
1 719 . 8 1 1 A 68 68 LEU HA H 68 4.154 4.700 -0.546 1
1 729 . 8 1 1 A 68 68 LEU C C 68 173.838 175.332 -1.494 1
1 730 . 8 1 1 A 68 68 LEU CA C 68 51.025 53.098 -2.073 1
1 731 . 8 1 1 A 68 68 LEU CB C 68 38.837 43.508 -4.671 1
1 735 . 8 1 1 A 68 68 LEU N N 68 118.919 121.166 -2.247 1
1 736 . 8 1 1 A 69 69 SER H H 69 8.284 8.821 -0.537 1
1 737 . 8 1 1 A 69 69 SER HA H 69 4.765 5.080 -0.315 1
1 740 . 8 1 1 A 69 69 SER C C 69 170.044 172.977 -2.933 1
1 741 . 8 1 1 A 69 69 SER CA C 69 54.639 54.937 -0.298 1
1 742 . 8 1 1 A 69 69 SER CB C 69 61.216 64.048 -2.832 1
1 743 . 8 1 1 A 69 69 SER N N 69 116.361 116.596 -0.235 1
1 744 . 8 1 1 A 70 70 PRO HA H 70 5.141 4.799 0.342 1
1 751 . 8 1 1 A 70 70 PRO C C 70 174.858 177.533 -2.675 1
1 752 . 8 1 1 A 70 70 PRO CA C 70 60.810 63.999 -3.189 1
1 753 . 8 1 1 A 70 70 PRO CB C 70 30.657 31.629 -0.972 1
1 756 . 8 1 1 A 71 71 PHE H H 71 8.139 9.154 -1.015 1
1 757 . 8 1 1 A 71 71 PHE HA H 71 4.202 4.282 -0.080 1
1 765 . 8 1 1 A 71 71 PHE C C 71 172.870 174.543 -1.673 1
1 766 . 8 1 1 A 71 71 PHE CA C 71 55.410 59.080 -3.670 1
1 767 . 8 1 1 A 71 71 PHE CB C 71 36.027 37.898 -1.871 1
1 773 . 8 1 1 A 71 71 PHE N N 71 125.409 123.138 2.271 1
1 774 . 8 1 1 A 72 72 SER H H 72 8.182 7.698 0.484 1
1 775 . 8 1 1 A 72 72 SER HA H 72 4.755 4.967 -0.212 1
1 778 . 8 1 1 A 72 72 SER C C 72 168.850 172.836 -3.986 1
1 779 . 8 1 1 A 72 72 SER CA C 72 55.926 56.341 -0.415 1
1 780 . 8 1 1 A 72 72 SER CB C 72 64.208 66.246 -2.038 1
1 781 . 8 1 1 A 72 72 SER N N 72 113.509 110.743 2.766 1
1 782 . 8 1 1 A 73 73 GLU H H 73 8.422 8.607 -0.185 1
1 783 . 8 1 1 A 73 73 GLU HA H 73 4.966 5.267 -0.301 1
1 788 . 8 1 1 A 73 73 GLU C C 73 173.192 174.577 -1.385 1
1 789 . 8 1 1 A 73 73 GLU CA C 73 52.815 54.813 -1.998 1
1 790 . 8 1 1 A 73 73 GLU CB C 73 29.416 33.506 -4.090 1
1 792 . 8 1 1 A 73 73 GLU N N 73 123.046 121.830 1.216 1
1 793 . 8 1 1 A 74 74 TYR H H 74 9.205 8.785 0.420 1
1 794 . 8 1 1 A 74 74 TYR HA H 74 4.799 4.817 -0.018 1
1 801 . 8 1 1 A 74 74 TYR C C 74 170.775 174.274 -3.499 1
1 802 . 8 1 1 A 74 74 TYR CA C 74 55.291 56.471 -1.180 1
1 803 . 8 1 1 A 74 74 TYR CB C 74 42.943 42.249 0.694 1
1 808 . 8 1 1 A 74 74 TYR N N 74 125.351 123.788 1.563 1
1 809 . 8 1 1 A 75 75 ALA H H 75 8.639 8.319 0.320 1
1 810 . 8 1 1 A 75 75 ALA HA H 75 5.271 5.072 0.199 1
1 814 . 8 1 1 A 75 75 ALA C C 75 173.698 176.251 -2.553 1
1 815 . 8 1 1 A 75 75 ALA CA C 75 47.904 50.262 -2.358 1
1 816 . 8 1 1 A 75 75 ALA CB C 75 19.634 20.652 -1.018 1
1 817 . 8 1 1 A 75 75 ALA N N 75 121.555 124.274 -2.719 1
1 818 . 8 1 1 A 76 76 PHE H H 76 9.066 9.422 -0.356 1
1 819 . 8 1 1 A 76 76 PHE HA H 76 5.496 5.247 0.249 1
1 827 . 8 1 1 A 76 76 PHE C C 76 172.268 175.317 -3.049 1
1 828 . 8 1 1 A 76 76 PHE CA C 76 54.216 57.292 -3.076 1
1 829 . 8 1 1 A 76 76 PHE CB C 76 41.901 41.503 0.398 1
1 835 . 8 1 1 A 76 76 PHE N N 76 116.545 122.884 -6.339 1
1 836 . 8 1 1 A 77 77 ARG H H 77 9.216 8.709 0.507 1
1 837 . 8 1 1 A 77 77 ARG HA H 77 4.357 5.203 -0.846 1
1 845 . 8 1 1 A 77 77 ARG C C 77 169.998 173.976 -3.978 1
1 846 . 8 1 1 A 77 77 ARG CA C 77 52.414 55.040 -2.626 1
1 847 . 8 1 1 A 77 77 ARG CB C 77 30.794 33.992 -3.198 1
1 850 . 8 1 1 A 77 77 ARG N N 77 115.738 119.058 -3.320 1
1 852 . 8 1 1 A 78 78 VAL H H 78 8.135 8.693 -0.558 1
1 853 . 8 1 1 A 78 78 VAL HA H 78 4.884 5.128 -0.244 1
1 861 . 8 1 1 A 78 78 VAL C C 78 171.098 174.275 -3.177 1
1 862 . 8 1 1 A 78 78 VAL CA C 78 57.566 60.510 -2.944 1
1 863 . 8 1 1 A 78 78 VAL CB C 78 33.146 33.639 -0.493 1
1 866 . 8 1 1 A 78 78 VAL N N 78 117.942 123.410 -5.468 1
1 867 . 8 1 1 A 79 79 LEU H H 79 9.167 8.574 0.593 1
1 868 . 8 1 1 A 79 79 LEU HA H 79 4.575 4.903 -0.328 1
1 878 . 8 1 1 A 79 79 LEU C C 79 171.447 175.241 -3.794 1
1 879 . 8 1 1 A 79 79 LEU CA C 79 51.642 53.671 -2.029 1
1 880 . 8 1 1 A 79 79 LEU CB C 79 42.776 45.578 -2.802 1
1 884 . 8 1 1 A 79 79 LEU N N 79 123.913 119.387 4.526 1
1 885 . 8 1 1 A 80 80 ALA H H 80 9.325 8.464 0.861 1
1 886 . 8 1 1 A 80 80 ALA HA H 80 4.654 3.881 0.773 1
1 890 . 8 1 1 A 80 80 ALA C C 80 172.070 176.820 -4.750 1
1 891 . 8 1 1 A 80 80 ALA CA C 80 48.169 51.064 -2.895 1
1 892 . 8 1 1 A 80 80 ALA CB C 80 20.366 19.691 0.675 1
1 893 . 8 1 1 A 80 80 ALA N N 80 124.135 122.430 1.705 1
1 894 . 8 1 1 A 81 81 VAL H H 81 7.953 8.137 -0.184 1
1 895 . 8 1 1 A 81 81 VAL HA H 81 4.293 4.740 -0.447 1
1 903 . 8 1 1 A 81 81 VAL C C 81 172.873 174.710 -1.837 1
1 904 . 8 1 1 A 81 81 VAL CA C 81 58.959 60.769 -1.810 1
1 905 . 8 1 1 A 81 81 VAL CB C 81 31.412 34.552 -3.140 1
1 908 . 8 1 1 A 81 81 VAL N N 81 118.503 120.392 -1.889 1
1 909 . 8 1 1 A 82 82 ASN H H 82 8.262 8.333 -0.071 1
1 910 . 8 1 1 A 82 82 ASN HA H 82 4.945 5.345 -0.400 1
1 915 . 8 1 1 A 82 82 ASN C C 82 173.273 175.533 -2.260 1
1 916 . 8 1 1 A 82 82 ASN CA C 82 48.714 51.340 -2.626 1
1 917 . 8 1 1 A 82 82 ASN CB C 82 36.796 40.407 -3.611 1
1 918 . 8 1 1 A 82 82 ASN N N 82 125.425 124.716 0.709 1
1 920 . 8 1 1 A 83 83 SER HA H 83 3.966 4.107 -0.141 1
1 923 . 8 1 1 A 83 83 SER C C 83 172.812 176.969 -4.157 1
1 924 . 8 1 1 A 83 83 SER CA C 83 59.047 62.317 -3.270 1
1 925 . 8 1 1 A 83 83 SER CB C 83 60.406 62.664 -2.258 1
1 926 . 8 1 1 A 84 84 ILE H H 84 7.803 8.000 -0.197 1
1 927 . 8 1 1 A 84 84 ILE HA H 84 3.862 3.763 0.099 1
1 937 . 8 1 1 A 84 84 ILE C C 84 174.481 176.070 -1.589 1
1 938 . 8 1 1 A 84 84 ILE CA C 84 59.188 63.812 -4.624 1
1 939 . 8 1 1 A 84 84 ILE CB C 84 34.677 38.344 -3.667 1
1 943 . 8 1 1 A 84 84 ILE N N 84 121.222 119.164 2.058 1
1 944 . 8 1 1 A 85 85 GLY H H 85 7.435 7.209 0.226 1
1 945 . 8 1 1 A 85 85 GLY HA2 H 85 4.149 4.031 0.118 1
1 946 . 8 1 1 A 85 85 GLY HA3 H 85 3.747 4.035 -0.288 1
1 947 . 8 1 1 A 85 85 GLY C C 85 168.589 172.675 -4.086 1
1 948 . 8 1 1 A 85 85 GLY CA C 85 42.931 44.986 -2.055 1
1 949 . 8 1 1 A 85 85 GLY N N 85 106.320 106.144 0.176 1
1 950 . 8 1 1 A 86 86 ARG H H 86 8.190 8.363 -0.173 1
1 951 . 8 1 1 A 86 86 ARG HA H 86 4.452 4.679 -0.227 1
1 958 . 8 1 1 A 86 86 ARG C C 86 175.286 176.219 -0.933 1
1 959 . 8 1 1 A 86 86 ARG CA C 86 53.223 55.462 -2.239 1
1 960 . 8 1 1 A 86 86 ARG CB C 86 29.517 30.466 -0.949 1
1 963 . 8 1 1 A 86 86 ARG N N 86 118.339 117.664 0.675 1
1 964 . 8 1 1 A 87 87 GLY H H 87 8.900 8.696 0.204 1
1 965 . 8 1 1 A 87 87 GLY HA2 H 87 4.211 3.991 0.220 1
1 966 . 8 1 1 A 87 87 GLY HA3 H 87 3.967 4.005 -0.038 1
1 967 . 8 1 1 A 87 87 GLY C C 87 168.101 172.771 -4.670 1
1 968 . 8 1 1 A 87 87 GLY CA C 87 42.281 44.095 -1.814 1
1 969 . 8 1 1 A 87 87 GLY N N 87 113.482 109.197 4.285 1
1 970 . 8 1 1 A 88 88 PRO HA H 88 4.563 4.580 -0.017 1
1 977 . 8 1 1 A 88 88 PRO CA C 88 60.994 62.131 -1.137 1
1 978 . 8 1 1 A 88 88 PRO CB C 88 29.873 31.614 -1.741 1
1 981 . 8 1 1 A 89 89 PRO HA H 89 4.490 4.406 0.084 1
1 987 . 8 1 1 A 89 89 PRO C C 89 174.543 176.514 -1.971 1
1 988 . 8 1 1 A 89 89 PRO CA C 89 59.435 62.663 -3.228 1
1 989 . 8 1 1 A 89 89 PRO CB C 89 29.805 32.351 -2.546 1
1 992 . 8 1 1 A 90 90 SER H H 90 8.808 8.381 0.427 1
1 993 . 8 1 1 A 90 90 SER HA H 90 4.202 4.570 -0.368 1
1 996 . 8 1 1 A 90 90 SER C C 90 171.870 174.009 -2.139 1
1 997 . 8 1 1 A 90 90 SER CA C 90 55.868 58.261 -2.393 1
1 998 . 8 1 1 A 90 90 SER CB C 90 64.504 63.848 0.656 1
1 999 . 8 1 1 A 90 90 SER N N 90 113.781 117.138 -3.357 1
1 1000 . 8 1 1 A 91 91 GLU H H 91 8.291 8.569 -0.278 1
1 1001 . 8 1 1 A 91 91 GLU HA H 91 4.131 4.181 -0.050 1
1 1006 . 8 1 1 A 91 91 GLU C C 91 174.882 176.443 -1.561 1
1 1007 . 8 1 1 A 91 91 GLU CA C 91 54.984 56.631 -1.647 1
1 1008 . 8 1 1 A 91 91 GLU CB C 91 27.643 29.297 -1.654 1
1 1010 . 8 1 1 A 91 91 GLU N N 91 117.930 123.827 -5.897 1
1 1011 . 8 1 1 A 92 92 ALA H H 92 8.605 8.343 0.262 1
1 1012 . 8 1 1 A 92 92 ALA HA H 92 5.068 4.452 0.616 1
1 1016 . 8 1 1 A 92 92 ALA C C 92 176.227 177.767 -1.540 1
1 1017 . 8 1 1 A 92 92 ALA CA C 92 48.997 53.017 -4.020 1
1 1018 . 8 1 1 A 92 92 ALA CB C 92 17.756 19.235 -1.479 1
1 1019 . 8 1 1 A 92 92 ALA N N 92 126.421 127.342 -0.921 1
1 1020 . 8 1 1 A 93 93 VAL H H 93 9.051 9.306 -0.255 1
1 1021 . 8 1 1 A 93 93 VAL HA H 93 4.642 4.980 -0.338 1
1 1029 . 8 1 1 A 93 93 VAL C C 93 172.010 174.472 -2.462 1
1 1030 . 8 1 1 A 93 93 VAL CA C 93 57.495 59.730 -2.235 1
1 1031 . 8 1 1 A 93 93 VAL CB C 93 32.774 34.717 -1.943 1
1 1034 . 8 1 1 A 93 93 VAL N N 93 117.322 117.673 -0.351 1
1 1035 . 8 1 1 A 94 94 ARG H H 94 8.470 8.953 -0.483 1
1 1036 . 8 1 1 A 94 94 ARG HA H 94 5.692 5.146 0.546 1
1 1043 . 8 1 1 A 94 94 ARG C C 94 173.635 175.477 -1.842 1
1 1044 . 8 1 1 A 94 94 ARG CA C 94 52.038 55.275 -3.237 1
1 1045 . 8 1 1 A 94 94 ARG CB C 94 30.966 31.551 -0.585 1
1 1048 . 8 1 1 A 94 94 ARG N N 94 122.258 124.776 -2.518 1
1 1049 . 8 1 1 A 95 95 ALA H H 95 9.051 9.211 -0.160 1
1 1050 . 8 1 1 A 95 95 ALA HA H 95 4.642 5.263 -0.621 1
1 1054 . 8 1 1 A 95 95 ALA C C 95 172.285 175.113 -2.828 1
1 1055 . 8 1 1 A 95 95 ALA CA C 95 49.191 50.708 -1.517 1
1 1056 . 8 1 1 A 95 95 ALA CB C 95 22.562 22.415 0.147 1
1 1057 . 8 1 1 A 95 95 ALA N N 95 121.931 127.040 -5.109 1
1 1058 . 8 1 1 A 96 96 ARG H H 96 8.550 8.813 -0.263 1
1 1059 . 8 1 1 A 96 96 ARG HA H 96 5.407 5.177 0.230 1
1 1066 . 8 1 1 A 96 96 ARG C C 96 174.547 176.106 -1.559 1
1 1067 . 8 1 1 A 96 96 ARG CA C 96 51.439 54.971 -3.532 1
1 1068 . 8 1 1 A 96 96 ARG CB C 96 30.708 31.885 -1.177 1
1 1071 . 8 1 1 A 96 96 ARG N N 96 121.155 124.195 -3.040 1
1 1072 . 8 1 1 A 97 97 THR H H 97 8.797 8.861 -0.064 1
1 1073 . 8 1 1 A 97 97 THR HA H 97 4.116 4.512 -0.396 1
1 1078 . 8 1 1 A 97 97 THR C C 97 173.577 174.944 -1.367 1
1 1079 . 8 1 1 A 97 97 THR CA C 97 58.800 61.435 -2.635 1
1 1080 . 8 1 1 A 97 97 THR CB C 97 67.461 69.855 -2.394 1
1 1082 . 8 1 1 A 97 97 THR N N 97 114.657 117.438 -2.781 1
1 1083 . 8 1 1 A 98 98 GLY H H 98 7.505 8.501 -0.996 1
1 1084 . 8 1 1 A 98 98 GLY HA2 H 98 3.866 4.075 -0.209 1
1 1085 . 8 1 1 A 98 98 GLY HA3 H 98 3.743 4.125 -0.382 1
1 1086 . 8 1 1 A 98 98 GLY C C 98 170.637 173.018 -2.381 1
1 1087 . 8 1 1 A 98 98 GLY CA C 98 42.332 44.749 -2.417 1
1 1088 . 8 1 1 A 98 98 GLY N N 98 106.172 107.967 -1.795 1
1 1089 . 8 1 1 A 99 99 GLU H H 99 8.145 8.458 -0.313 1
1 1090 . 8 1 1 A 99 99 GLU HA H 99 4.210 5.177 -0.967 1
1 1095 . 8 1 1 A 99 99 GLU C C 99 174.134 175.189 -1.055 1
1 1096 . 8 1 1 A 99 99 GLU CA C 99 53.828 55.480 -1.652 1
1 1097 . 8 1 1 A 99 99 GLU CB C 99 28.774 31.301 -2.527 1
1 1099 . 8 1 1 A 99 99 GLU N N 99 117.634 118.121 -0.487 1
1 1100 . 8 1 1 A 100 100 GLN H H 100 8.647 8.880 -0.233 1
1 1101 . 8 1 1 A 100 100 GLN HA H 100 4.247 4.493 -0.246 1
1 1108 . 8 1 1 A 100 100 GLN C C 100 173.348 175.210 -1.862 1
1 1109 . 8 1 1 A 100 100 GLN CA C 100 53.634 55.705 -2.071 1
1 1110 . 8 1 1 A 100 100 GLN CB C 100 27.392 31.288 -3.896 1
1 1112 . 8 1 1 A 100 100 GLN N N 100 121.960 122.668 -0.708 1
1 1114 . 8 1 1 A 101 101 SER H H 101 8.416 8.687 -0.271 1
1 1115 . 8 1 1 A 101 101 SER HA H 101 4.418 4.183 0.235 1
1 1117 . 8 1 1 A 101 101 SER C C 101 172.148 174.105 -1.957 1
1 1118 . 8 1 1 A 101 101 SER CA C 101 55.926 59.011 -3.085 1
1 1119 . 8 1 1 A 101 101 SER CB C 101 61.617 61.216 0.401 1
1 1120 . 8 1 1 A 101 101 SER N N 101 118.609 121.015 -2.406 1
1 1121 . 8 1 1 A 102 102 GLY H H 102 8.233 8.079 0.154 1
1 1122 . 8 1 1 A 102 102 GLY HA2 H 102 4.080 3.950 0.130 1
1 1123 . 8 1 1 A 102 102 GLY HA3 H 102 3.981 3.965 0.016 1
1 1124 . 8 1 1 A 102 102 GLY C C 102 169.461 173.178 -3.717 1
1 1125 . 8 1 1 A 102 102 GLY CA C 102 42.332 45.334 -3.002 1
1 1126 . 8 1 1 A 102 102 GLY N N 102 110.483 109.990 0.493 1
1 1127 . 8 1 1 A 103 103 PRO HA H 103 4.618 4.776 -0.158 1
1 1134 . 8 1 1 A 103 103 PRO CA C 103 57.843 62.922 -5.079 1
1 1135 . 8 1 1 A 103 103 PRO CB C 103 28.671 33.164 -4.493 1
1 1 . 9 1 1 A 6 6 SER HA H 6 4.492 4.759 -0.267 1
1 4 . 9 1 1 A 6 6 SER CA C 6 55.621 57.529 -1.908 1
1 5 . 9 1 1 A 6 6 SER CB C 6 62.104 64.992 -2.888 1
1 6 . 9 1 1 A 7 7 GLY H H 7 8.244 8.689 -0.445 1
1 7 . 9 1 1 A 7 7 GLY HA2 H 7 3.873 4.080 -0.207 1
1 8 . 9 1 1 A 7 7 GLY HA3 H 7 3.737 4.088 -0.351 1
1 9 . 9 1 1 A 7 7 GLY CA C 7 41.743 44.513 -2.770 1
1 10 . 9 1 1 A 7 7 GLY N N 7 109.193 113.401 -4.208 1
1 11 . 9 1 1 A 8 8 PRO HA H 8 4.286 4.557 -0.271 1
1 18 . 9 1 1 A 8 8 PRO C C 8 173.841 175.669 -1.828 1
1 19 . 9 1 1 A 8 8 PRO CA C 8 60.528 62.613 -2.085 1
1 20 . 9 1 1 A 8 8 PRO CB C 8 30.299 32.868 -2.569 1
1 23 . 9 1 1 A 9 9 LYS H H 9 8.877 8.518 0.359 1
1 24 . 9 1 1 A 9 9 LYS HA H 9 4.360 4.834 -0.474 1
1 33 . 9 1 1 A 9 9 LYS C C 9 173.492 174.250 -0.758 1
1 34 . 9 1 1 A 9 9 LYS CA C 9 52.135 53.118 -0.983 1
1 35 . 9 1 1 A 9 9 LYS CB C 9 28.798 33.214 -4.416 1
1 39 . 9 1 1 A 9 9 LYS N N 9 120.404 120.485 -0.081 1
1 40 . 9 1 1 A 10 10 PRO HA H 10 4.284 4.619 -0.335 1
1 47 . 9 1 1 A 10 10 PRO CA C 10 59.326 61.643 -2.317 1
1 48 . 9 1 1 A 10 10 PRO CB C 10 28.825 31.582 -2.757 1
1 51 . 9 1 1 A 11 11 PRO HA H 11 4.468 4.763 -0.295 1
1 58 . 9 1 1 A 11 11 PRO C C 11 171.993 176.458 -4.465 1
1 59 . 9 1 1 A 11 11 PRO CA C 11 60.422 62.714 -2.292 1
1 60 . 9 1 1 A 11 11 PRO CB C 11 30.418 32.601 -2.183 1
1 63 . 9 1 1 A 12 12 ILE H H 12 7.554 8.405 -0.851 1
1 64 . 9 1 1 A 12 12 ILE HA H 12 4.676 4.641 0.035 1
1 74 . 9 1 1 A 12 12 ILE C C 12 171.721 175.105 -3.384 1
1 75 . 9 1 1 A 12 12 ILE CA C 12 56.843 58.809 -1.966 1
1 76 . 9 1 1 A 12 12 ILE CB C 12 40.560 40.434 0.126 1
1 80 . 9 1 1 A 12 12 ILE N N 12 109.695 116.727 -7.032 1
1 81 . 9 1 1 A 13 13 ASP H H 13 8.435 9.071 -0.636 1
1 82 . 9 1 1 A 13 13 ASP HA H 13 4.094 4.271 -0.177 1
1 85 . 9 1 1 A 13 13 ASP C C 13 171.803 176.177 -4.374 1
1 86 . 9 1 1 A 13 13 ASP CA C 13 52.610 55.045 -2.435 1
1 87 . 9 1 1 A 13 13 ASP CB C 13 36.357 40.223 -3.866 1
1 88 . 9 1 1 A 13 13 ASP N N 13 116.219 122.054 -5.835 1
1 89 . 9 1 1 A 14 14 LEU H H 14 7.483 7.983 -0.500 1
1 90 . 9 1 1 A 14 14 LEU HA H 14 4.990 4.717 0.273 1
1 100 . 9 1 1 A 14 14 LEU C C 14 174.702 175.303 -0.601 1
1 101 . 9 1 1 A 14 14 LEU CA C 14 53.811 55.203 -1.392 1
1 102 . 9 1 1 A 14 14 LEU CB C 14 40.148 41.990 -1.842 1
1 106 . 9 1 1 A 14 14 LEU N N 14 118.463 121.077 -2.614 1
1 107 . 9 1 1 A 15 15 VAL H H 15 9.209 8.607 0.602 1
1 108 . 9 1 1 A 15 15 VAL HA H 15 4.250 4.774 -0.524 1
1 116 . 9 1 1 A 15 15 VAL C C 15 172.080 174.352 -2.272 1
1 117 . 9 1 1 A 15 15 VAL CA C 15 58.570 60.474 -1.904 1
1 118 . 9 1 1 A 15 15 VAL CB C 15 34.146 36.288 -2.142 1
1 121 . 9 1 1 A 15 15 VAL N N 15 124.833 126.965 -2.132 1
1 122 . 9 1 1 A 16 16 VAL H H 16 8.390 8.946 -0.556 1
1 123 . 9 1 1 A 16 16 VAL HA H 16 4.343 4.626 -0.283 1
1 131 . 9 1 1 A 16 16 VAL C C 16 174.672 175.760 -1.088 1
1 132 . 9 1 1 A 16 16 VAL CA C 16 59.188 61.221 -2.033 1
1 133 . 9 1 1 A 16 16 VAL CB C 16 29.187 33.079 -3.892 1
1 136 . 9 1 1 A 16 16 VAL N N 16 124.654 125.899 -1.245 1
1 137 . 9 1 1 A 17 17 THR H H 17 8.638 8.477 0.161 1
1 138 . 9 1 1 A 17 17 THR HA H 17 4.195 4.393 -0.198 1
1 143 . 9 1 1 A 17 17 THR C C 17 172.661 173.561 -0.900 1
1 144 . 9 1 1 A 17 17 THR CA C 17 60.318 63.607 -3.289 1
1 145 . 9 1 1 A 17 17 THR CB C 17 66.420 70.628 -4.208 1
1 147 . 9 1 1 A 17 17 THR N N 17 120.942 122.484 -1.542 1
1 148 . 9 1 1 A 18 18 GLU H H 18 7.361 7.614 -0.253 1
1 149 . 9 1 1 A 18 18 GLU HA H 18 4.497 4.726 -0.229 1
1 154 . 9 1 1 A 18 18 GLU C C 18 171.691 174.883 -3.192 1
1 155 . 9 1 1 A 18 18 GLU CA C 18 53.687 54.803 -1.116 1
1 156 . 9 1 1 A 18 18 GLU CB C 18 30.802 33.904 -3.102 1
1 158 . 9 1 1 A 18 18 GLU N N 18 119.088 118.194 0.894 1
1 159 . 9 1 1 A 19 19 THR H H 19 8.164 8.657 -0.493 1
1 160 . 9 1 1 A 19 19 THR HA H 19 4.912 5.068 -0.156 1
1 165 . 9 1 1 A 19 19 THR C C 19 171.606 172.893 -1.287 1
1 166 . 9 1 1 A 19 19 THR CA C 19 58.473 60.687 -2.214 1
1 167 . 9 1 1 A 19 19 THR CB C 19 70.103 71.057 -0.954 1
1 169 . 9 1 1 A 19 19 THR N N 19 112.424 113.891 -1.467 1
1 170 . 9 1 1 A 20 20 THR H H 20 8.750 9.025 -0.275 1
1 171 . 9 1 1 A 20 20 THR HA H 20 4.710 4.799 -0.089 1
1 176 . 9 1 1 A 20 20 THR C C 20 172.785 176.096 -3.311 1
1 177 . 9 1 1 A 20 20 THR CA C 20 58.059 61.159 -3.100 1
1 178 . 9 1 1 A 20 20 THR CB C 20 68.782 71.092 -2.310 1
1 180 . 9 1 1 A 20 20 THR N N 20 113.438 121.248 -7.810 1
1 181 . 9 1 1 A 21 21 ALA H H 21 8.453 8.895 -0.442 1
1 182 . 9 1 1 A 21 21 ALA HA H 21 4.079 4.437 -0.358 1
1 186 . 9 1 1 A 21 21 ALA C C 21 174.130 177.932 -3.802 1
1 187 . 9 1 1 A 21 21 ALA CA C 21 52.680 54.845 -2.165 1
1 188 . 9 1 1 A 21 21 ALA CB C 21 16.893 18.605 -1.712 1
1 189 . 9 1 1 A 21 21 ALA N N 21 120.078 124.637 -4.559 1
1 190 . 9 1 1 A 22 22 THR H H 22 7.132 7.589 -0.457 1
1 191 . 9 1 1 A 22 22 THR HA H 22 4.433 4.693 -0.260 1
1 196 . 9 1 1 A 22 22 THR C C 22 171.434 173.384 -1.950 1
1 197 . 9 1 1 A 22 22 THR CA C 22 56.836 60.454 -3.618 1
1 198 . 9 1 1 A 22 22 THR CB C 22 68.772 69.408 -0.636 1
1 200 . 9 1 1 A 22 22 THR N N 22 95.772 104.106 -8.334 1
1 201 . 9 1 1 A 23 23 SER H H 23 7.326 7.763 -0.437 1
1 202 . 9 1 1 A 23 23 SER HA H 23 5.562 5.332 0.230 1
1 205 . 9 1 1 A 23 23 SER C C 23 169.267 172.547 -3.280 1
1 206 . 9 1 1 A 23 23 SER CA C 23 54.445 57.719 -3.274 1
1 207 . 9 1 1 A 23 23 SER CB C 23 65.905 67.548 -1.643 1
1 208 . 9 1 1 A 23 23 SER N N 23 115.757 115.983 -0.226 1
1 209 . 9 1 1 A 24 24 VAL H H 24 7.983 8.408 -0.425 1
1 210 . 9 1 1 A 24 24 VAL HA H 24 4.334 4.611 -0.277 1
1 218 . 9 1 1 A 24 24 VAL C C 24 171.917 174.514 -2.597 1
1 219 . 9 1 1 A 24 24 VAL CA C 24 58.642 60.421 -1.779 1
1 220 . 9 1 1 A 24 24 VAL CB C 24 34.254 35.530 -1.276 1
1 223 . 9 1 1 A 24 24 VAL N N 24 116.595 121.418 -4.823 1
1 224 . 9 1 1 A 25 25 THR H H 25 8.636 8.841 -0.205 1
1 225 . 9 1 1 A 25 25 THR HA H 25 4.833 4.867 -0.034 1
1 230 . 9 1 1 A 25 25 THR C C 25 169.721 172.653 -2.932 1
1 231 . 9 1 1 A 25 25 THR CA C 25 59.699 61.860 -2.161 1
1 232 . 9 1 1 A 25 25 THR CB C 25 67.303 70.297 -2.994 1
1 234 . 9 1 1 A 25 25 THR N N 25 121.690 120.007 1.683 1
1 235 . 9 1 1 A 26 26 LEU H H 26 8.629 9.123 -0.494 1
1 236 . 9 1 1 A 26 26 LEU HA H 26 5.315 5.114 0.201 1
1 246 . 9 1 1 A 26 26 LEU C C 26 173.182 175.468 -2.286 1
1 247 . 9 1 1 A 26 26 LEU CA C 26 50.643 53.369 -2.726 1
1 248 . 9 1 1 A 26 26 LEU CB C 26 43.976 44.984 -1.008 1
1 252 . 9 1 1 A 26 26 LEU N N 26 126.843 130.617 -3.774 1
1 253 . 9 1 1 A 27 27 THR H H 27 8.704 9.351 -0.647 1
1 254 . 9 1 1 A 27 27 THR HA H 27 4.822 5.399 -0.577 1
1 259 . 9 1 1 A 27 27 THR C C 27 169.840 173.733 -3.893 1
1 260 . 9 1 1 A 27 27 THR CA C 27 58.077 59.603 -1.526 1
1 261 . 9 1 1 A 27 27 THR CB C 27 69.666 71.378 -1.712 1
1 263 . 9 1 1 A 27 27 THR N N 27 111.513 117.008 -5.495 1
1 264 . 9 1 1 A 28 28 TRP H H 28 7.339 8.247 -0.908 1
1 265 . 9 1 1 A 28 28 TRP HA H 28 4.963 5.444 -0.481 1
1 274 . 9 1 1 A 28 28 TRP C C 28 170.637 172.379 -1.742 1
1 275 . 9 1 1 A 28 28 TRP CA C 28 54.438 55.363 -0.925 1
1 276 . 9 1 1 A 28 28 TRP CB C 28 27.497 31.418 -3.921 1
1 282 . 9 1 1 A 28 28 TRP N N 28 117.895 119.686 -1.791 1
1 284 . 9 1 1 A 29 29 ASP H H 29 8.696 8.817 -0.121 1
1 285 . 9 1 1 A 29 29 ASP HA H 29 4.971 5.097 -0.126 1
1 288 . 9 1 1 A 29 29 ASP C C 29 174.901 177.657 -2.756 1
1 289 . 9 1 1 A 29 29 ASP CA C 29 50.178 52.763 -2.585 1
1 290 . 9 1 1 A 29 29 ASP CB C 29 42.291 43.108 -0.817 1
1 291 . 9 1 1 A 29 29 ASP N N 29 117.477 121.905 -4.428 1
1 292 . 9 1 1 A 30 30 SER H H 30 8.800 8.974 -0.174 1
1 293 . 9 1 1 A 30 30 SER HA H 30 4.389 4.164 0.225 1
1 296 . 9 1 1 A 30 30 SER C C 30 174.032 175.722 -1.690 1
1 297 . 9 1 1 A 30 30 SER CA C 30 58.694 60.933 -2.239 1
1 298 . 9 1 1 A 30 30 SER CB C 30 62.428 63.344 -0.916 1
1 299 . 9 1 1 A 30 30 SER N N 30 118.275 120.345 -2.070 1
1 300 . 9 1 1 A 31 31 GLY H H 31 8.759 8.037 0.722 1
1 301 . 9 1 1 A 31 31 GLY HA2 H 31 4.239 4.015 0.224 1
1 302 . 9 1 1 A 31 31 GLY HA3 H 31 3.555 4.048 -0.493 1
1 303 . 9 1 1 A 31 31 GLY C C 31 171.325 174.183 -2.858 1
1 304 . 9 1 1 A 31 31 GLY CA C 31 43.637 45.518 -1.881 1
1 305 . 9 1 1 A 31 31 GLY N N 31 107.961 111.168 -3.207 1
1 306 . 9 1 1 A 32 32 ASN H H 32 8.173 8.273 -0.100 1
1 307 . 9 1 1 A 32 32 ASN HA H 32 4.749 4.964 -0.215 1
1 312 . 9 1 1 A 32 32 ASN C C 32 171.355 174.946 -3.591 1
1 313 . 9 1 1 A 32 32 ASN CA C 32 50.795 53.367 -2.572 1
1 314 . 9 1 1 A 32 32 ASN CB C 32 41.508 39.932 1.576 1
1 315 . 9 1 1 A 32 32 ASN N N 32 117.781 119.597 -1.816 1
1 317 . 9 1 1 A 33 33 SER HA H 33 4.291 4.546 -0.255 1
1 320 . 9 1 1 A 33 33 SER C C 33 172.449 174.211 -1.762 1
1 321 . 9 1 1 A 33 33 SER CA C 33 56.733 59.038 -2.305 1
1 322 . 9 1 1 A 33 33 SER CB C 33 60.884 64.982 -4.098 1
1 323 . 9 1 1 A 34 34 GLU H H 34 7.731 7.649 0.082 1
1 324 . 9 1 1 A 34 34 GLU HA H 34 4.556 4.569 -0.013 1
1 329 . 9 1 1 A 34 34 GLU C C 34 171.792 174.510 -2.718 1
1 330 . 9 1 1 A 34 34 GLU CA C 34 51.818 54.802 -2.984 1
1 331 . 9 1 1 A 34 34 GLU CB C 34 26.891 28.577 -1.686 1
1 333 . 9 1 1 A 34 34 GLU N N 34 122.319 121.007 1.312 1
1 334 . 9 1 1 A 35 35 PRO HA H 35 4.165 4.756 -0.591 1
1 341 . 9 1 1 A 35 35 PRO C C 35 174.288 176.710 -2.422 1
1 342 . 9 1 1 A 35 35 PRO CA C 35 61.374 62.374 -1.000 1
1 343 . 9 1 1 A 35 35 PRO CB C 35 29.887 29.785 0.102 1
1 346 . 9 1 1 A 36 36 VAL H H 36 8.348 8.101 0.247 1
1 347 . 9 1 1 A 36 36 VAL HA H 36 3.899 4.130 -0.231 1
1 355 . 9 1 1 A 36 36 VAL C C 36 173.344 176.385 -3.041 1
1 356 . 9 1 1 A 36 36 VAL CA C 36 59.014 62.839 -3.825 1
1 357 . 9 1 1 A 36 36 VAL CB C 36 31.865 31.899 -0.034 1
1 360 . 9 1 1 A 36 36 VAL N N 36 122.051 123.638 -1.587 1
1 361 . 9 1 1 A 37 37 THR H H 37 8.780 8.545 0.235 1
1 362 . 9 1 1 A 37 37 THR HA H 37 3.923 4.258 -0.335 1
1 367 . 9 1 1 A 37 37 THR C C 37 172.171 174.576 -2.405 1
1 368 . 9 1 1 A 37 37 THR CA C 37 63.155 64.437 -1.282 1
1 369 . 9 1 1 A 37 37 THR CB C 37 65.941 69.268 -3.327 1
1 371 . 9 1 1 A 37 37 THR N N 37 122.351 120.242 2.109 1
1 372 . 9 1 1 A 38 38 TYR H H 38 7.304 7.601 -0.297 1
1 373 . 9 1 1 A 38 38 TYR HA H 38 4.439 5.082 -0.643 1
1 380 . 9 1 1 A 38 38 TYR C C 38 168.385 172.797 -4.412 1
1 381 . 9 1 1 A 38 38 TYR CA C 38 54.101 56.403 -2.302 1
1 382 . 9 1 1 A 38 38 TYR CB C 38 35.874 40.161 -4.287 1
1 387 . 9 1 1 A 38 38 TYR N N 38 113.984 115.084 -1.100 1
1 388 . 9 1 1 A 39 39 TYR H H 39 9.445 9.029 0.416 1
1 389 . 9 1 1 A 39 39 TYR HA H 39 5.293 5.260 0.033 1
1 396 . 9 1 1 A 39 39 TYR C C 39 172.781 175.763 -2.982 1
1 397 . 9 1 1 A 39 39 TYR CA C 39 54.322 55.584 -1.262 1
1 398 . 9 1 1 A 39 39 TYR CB C 39 39.035 41.739 -2.704 1
1 401 . 9 1 1 A 39 39 TYR N N 39 115.092 118.647 -3.555 1
1 402 . 9 1 1 A 40 40 GLY H H 40 8.870 8.724 0.146 1
1 403 . 9 1 1 A 40 40 GLY HA2 H 40 5.137 4.323 0.814 1
1 404 . 9 1 1 A 40 40 GLY HA3 H 40 3.285 4.366 -1.081 1
1 405 . 9 1 1 A 40 40 GLY C C 40 169.688 172.650 -2.962 1
1 406 . 9 1 1 A 40 40 GLY CA C 40 41.415 44.288 -2.873 1
1 407 . 9 1 1 A 40 40 GLY N N 40 106.573 111.391 -4.818 1
1 408 . 9 1 1 A 41 41 ILE H H 41 8.917 8.469 0.448 1
1 409 . 9 1 1 A 41 41 ILE HA H 41 4.527 4.831 -0.304 1
1 419 . 9 1 1 A 41 41 ILE C C 41 172.692 174.955 -2.263 1
1 420 . 9 1 1 A 41 41 ILE CA C 41 57.597 59.934 -2.337 1
1 421 . 9 1 1 A 41 41 ILE CB C 41 37.840 42.229 -4.389 1
1 425 . 9 1 1 A 41 41 ILE N N 41 121.746 121.212 0.534 1
1 426 . 9 1 1 A 42 42 GLN H H 42 9.063 8.756 0.307 1
1 427 . 9 1 1 A 42 42 GLN HA H 42 5.655 5.707 -0.052 1
1 434 . 9 1 1 A 42 42 GLN C C 42 172.841 174.420 -1.579 1
1 435 . 9 1 1 A 42 42 GLN CA C 42 50.789 54.638 -3.849 1
1 436 . 9 1 1 A 42 42 GLN CB C 42 28.898 32.317 -3.419 1
1 438 . 9 1 1 A 42 42 GLN N N 42 125.141 125.779 -0.638 1
1 440 . 9 1 1 A 43 43 TYR H H 43 9.066 8.995 0.071 1
1 441 . 9 1 1 A 43 43 TYR HA H 43 5.922 6.085 -0.163 1
1 448 . 9 1 1 A 43 43 TYR C C 43 171.219 173.364 -2.145 1
1 449 . 9 1 1 A 43 43 TYR CA C 43 53.349 55.963 -2.614 1
1 450 . 9 1 1 A 43 43 TYR CB C 43 41.074 42.680 -1.606 1
1 455 . 9 1 1 A 43 43 TYR N N 43 118.018 120.019 -2.001 1
1 456 . 9 1 1 A 44 44 ARG H H 44 8.400 8.500 -0.100 1
1 457 . 9 1 1 A 44 44 ARG HA H 44 4.542 4.445 0.097 1
1 464 . 9 1 1 A 44 44 ARG C C 44 171.974 173.980 -2.006 1
1 465 . 9 1 1 A 44 44 ARG CA C 44 52.453 55.050 -2.597 1
1 466 . 9 1 1 A 44 44 ARG CB C 44 31.125 33.463 -2.338 1
1 469 . 9 1 1 A 44 44 ARG N N 44 115.214 119.803 -4.589 1
1 470 . 9 1 1 A 45 45 ALA H H 45 8.846 8.213 0.633 1
1 471 . 9 1 1 A 45 45 ALA HA H 45 3.894 2.671 1.223 1
1 475 . 9 1 1 A 45 45 ALA C C 45 175.721 176.952 -1.231 1
1 476 . 9 1 1 A 45 45 ALA CA C 45 50.372 52.389 -2.017 1
1 477 . 9 1 1 A 45 45 ALA CB C 45 15.732 18.826 -3.094 1
1 478 . 9 1 1 A 45 45 ALA N N 45 126.463 126.778 -0.315 1
1 479 . 9 1 1 A 46 46 ALA H H 46 8.282 8.240 0.042 1
1 480 . 9 1 1 A 46 46 ALA HA H 46 3.922 4.203 -0.281 1
1 484 . 9 1 1 A 46 46 ALA C C 46 176.236 177.880 -1.644 1
1 485 . 9 1 1 A 46 46 ALA CA C 46 50.773 52.379 -1.606 1
1 486 . 9 1 1 A 46 46 ALA CB C 46 16.244 18.013 -1.769 1
1 487 . 9 1 1 A 46 46 ALA N N 46 126.301 125.791 0.510 1
1 488 . 9 1 1 A 47 47 GLY HA2 H 47 3.882 3.936 -0.054 1
1 489 . 9 1 1 A 47 47 GLY HA3 H 47 3.695 3.970 -0.275 1
1 490 . 9 1 1 A 47 47 GLY C C 47 171.795 174.529 -2.734 1
1 491 . 9 1 1 A 47 47 GLY CA C 47 43.327 45.391 -2.064 1
1 492 . 9 1 1 A 48 48 THR H H 48 7.145 7.204 -0.059 1
1 493 . 9 1 1 A 48 48 THR HA H 48 4.417 4.345 0.072 1
1 498 . 9 1 1 A 48 48 THR C C 48 171.325 173.885 -2.560 1
1 499 . 9 1 1 A 48 48 THR CA C 48 58.271 61.988 -3.717 1
1 500 . 9 1 1 A 48 48 THR CB C 48 68.846 69.609 -0.763 1
1 502 . 9 1 1 A 48 48 THR N N 48 110.190 116.126 -5.936 1
1 503 . 9 1 1 A 49 49 GLU H H 49 8.346 8.723 -0.377 1
1 504 . 9 1 1 A 49 49 GLU HA H 49 4.277 4.808 -0.531 1
1 509 . 9 1 1 A 49 49 GLU C C 49 174.109 175.198 -1.089 1
1 510 . 9 1 1 A 49 49 GLU CA C 49 52.909 55.209 -2.300 1
1 511 . 9 1 1 A 49 49 GLU CB C 49 27.845 30.451 -2.606 1
1 513 . 9 1 1 A 49 49 GLU N N 49 119.985 125.454 -5.469 1
1 514 . 9 1 1 A 50 50 GLY H H 50 7.617 8.372 -0.755 1
1 515 . 9 1 1 A 50 50 GLY HA2 H 50 3.935 4.166 -0.231 1
1 516 . 9 1 1 A 50 50 GLY HA3 H 50 3.935 4.182 -0.247 1
1 517 . 9 1 1 A 50 50 GLY C C 50 168.223 172.573 -4.350 1
1 518 . 9 1 1 A 50 50 GLY CA C 50 42.121 44.171 -2.050 1
1 519 . 9 1 1 A 50 50 GLY N N 50 108.670 110.630 -1.960 1
1 520 . 9 1 1 A 51 51 PRO HA H 51 4.298 4.662 -0.364 1
1 527 . 9 1 1 A 51 51 PRO C C 51 175.067 177.037 -1.970 1
1 528 . 9 1 1 A 51 51 PRO CA C 51 60.175 62.994 -2.819 1
1 529 . 9 1 1 A 51 51 PRO CB C 51 30.052 32.143 -2.091 1
1 532 . 9 1 1 A 52 52 PHE H H 52 8.442 8.649 -0.207 1
1 533 . 9 1 1 A 52 52 PHE HA H 52 3.981 4.608 -0.627 1
1 541 . 9 1 1 A 52 52 PHE C C 52 175.141 175.468 -0.327 1
1 542 . 9 1 1 A 52 52 PHE CA C 52 56.808 57.544 -0.736 1
1 543 . 9 1 1 A 52 52 PHE CB C 52 36.830 39.762 -2.932 1
1 549 . 9 1 1 A 52 52 PHE N N 52 118.707 122.265 -3.558 1
1 550 . 9 1 1 A 53 53 GLN H H 53 8.778 8.069 0.709 1
1 551 . 9 1 1 A 53 53 GLN HA H 53 4.149 4.099 0.050 1
1 558 . 9 1 1 A 53 53 GLN C C 53 172.773 175.377 -2.604 1
1 559 . 9 1 1 A 53 53 GLN CA C 53 52.999 56.868 -3.869 1
1 560 . 9 1 1 A 53 53 GLN CB C 53 26.962 29.057 -2.095 1
1 562 . 9 1 1 A 53 53 GLN N N 53 122.164 121.731 0.433 1
1 564 . 9 1 1 A 54 54 GLU H H 54 8.432 8.593 -0.161 1
1 565 . 9 1 1 A 54 54 GLU HA H 54 5.533 5.299 0.234 1
1 570 . 9 1 1 A 54 54 GLU C C 54 173.930 174.926 -0.996 1
1 571 . 9 1 1 A 54 54 GLU CA C 54 52.981 54.971 -1.990 1
1 572 . 9 1 1 A 54 54 GLU CB C 54 31.712 33.394 -1.682 1
1 574 . 9 1 1 A 54 54 GLU N N 54 119.688 121.358 -1.670 1
1 575 . 9 1 1 A 55 55 VAL H H 55 9.077 8.615 0.462 1
1 576 . 9 1 1 A 55 55 VAL HA H 55 4.180 4.886 -0.706 1
1 584 . 9 1 1 A 55 55 VAL C C 55 171.811 174.545 -2.734 1
1 585 . 9 1 1 A 55 55 VAL CA C 55 59.664 60.762 -1.098 1
1 586 . 9 1 1 A 55 55 VAL CB C 55 31.827 34.742 -2.915 1
1 589 . 9 1 1 A 55 55 VAL N N 55 125.328 126.259 -0.931 1
1 590 . 9 1 1 A 56 56 ASP H H 56 8.639 8.821 -0.182 1
1 591 . 9 1 1 A 56 56 ASP HA H 56 5.250 5.535 -0.285 1
1 594 . 9 1 1 A 56 56 ASP C C 56 174.252 175.779 -1.527 1
1 595 . 9 1 1 A 56 56 ASP CA C 56 50.108 52.340 -2.232 1
1 596 . 9 1 1 A 56 56 ASP CB C 56 41.407 44.434 -3.027 1
1 597 . 9 1 1 A 56 56 ASP N N 56 125.773 124.888 0.885 1
1 598 . 9 1 1 A 57 57 GLY H H 57 7.222 8.599 -1.377 1
1 599 . 9 1 1 A 57 57 GLY HA2 H 57 3.479 3.861 -0.382 1
1 600 . 9 1 1 A 57 57 GLY HA3 H 57 2.719 3.919 -1.200 1
1 601 . 9 1 1 A 57 57 GLY C C 57 172.281 174.369 -2.088 1
1 602 . 9 1 1 A 57 57 GLY CA C 57 43.919 45.685 -1.766 1
1 603 . 9 1 1 A 57 57 GLY N N 57 105.564 110.834 -5.270 1
1 604 . 9 1 1 A 58 58 VAL H H 58 8.338 8.056 0.282 1
1 605 . 9 1 1 A 58 58 VAL HA H 58 3.860 4.296 -0.436 1
1 613 . 9 1 1 A 58 58 VAL C C 58 173.981 175.438 -1.457 1
1 614 . 9 1 1 A 58 58 VAL CA C 58 61.233 61.607 -0.374 1
1 615 . 9 1 1 A 58 58 VAL CB C 58 29.708 32.421 -2.713 1
1 618 . 9 1 1 A 58 58 VAL N N 58 121.466 120.971 0.495 1
1 619 . 9 1 1 A 59 59 ALA H H 59 9.038 8.746 0.292 1
1 620 . 9 1 1 A 59 59 ALA HA H 59 4.676 4.607 0.069 1
1 624 . 9 1 1 A 59 59 ALA C C 59 175.105 176.727 -1.622 1
1 625 . 9 1 1 A 59 59 ALA CA C 59 50.866 52.057 -1.191 1
1 626 . 9 1 1 A 59 59 ALA CB C 59 17.647 19.175 -1.528 1
1 627 . 9 1 1 A 59 59 ALA N N 59 130.928 130.182 0.746 1
1 628 . 9 1 1 A 60 60 THR H H 60 7.445 7.761 -0.316 1
1 629 . 9 1 1 A 60 60 THR HA H 60 4.642 4.701 -0.059 1
1 634 . 9 1 1 A 60 60 THR C C 60 169.528 174.150 -4.622 1
1 635 . 9 1 1 A 60 60 THR CA C 60 57.101 59.135 -2.034 1
1 636 . 9 1 1 A 60 60 THR CB C 60 67.982 72.385 -4.403 1
1 638 . 9 1 1 A 60 60 THR N N 60 109.256 109.475 -0.219 1
1 639 . 9 1 1 A 61 61 THR H H 61 7.325 8.389 -1.064 1
1 640 . 9 1 1 A 61 61 THR HA H 61 2.896 3.661 -0.765 1
1 645 . 9 1 1 A 61 61 THR C C 61 169.678 172.672 -2.994 1
1 646 . 9 1 1 A 61 61 THR CA C 61 57.246 61.490 -4.244 1
1 647 . 9 1 1 A 61 61 THR CB C 61 63.794 68.432 -4.638 1
1 649 . 9 1 1 A 61 61 THR N N 61 105.670 111.751 -6.081 1
1 650 . 9 1 1 A 62 62 ARG H H 62 6.490 7.271 -0.781 1
1 651 . 9 1 1 A 62 62 ARG HA H 62 4.698 4.136 0.562 1
1 658 . 9 1 1 A 62 62 ARG C C 62 172.881 173.884 -1.003 1
1 659 . 9 1 1 A 62 62 ARG CA C 62 52.276 54.242 -1.966 1
1 660 . 9 1 1 A 62 62 ARG CB C 62 30.774 34.011 -3.237 1
1 663 . 9 1 1 A 62 62 ARG N N 62 117.485 119.609 -2.124 1
1 664 . 9 1 1 A 63 63 TYR H H 63 8.891 8.571 0.320 1
1 665 . 9 1 1 A 63 63 TYR HA H 63 4.356 5.060 -0.704 1
1 672 . 9 1 1 A 63 63 TYR C C 63 170.393 173.785 -3.392 1
1 673 . 9 1 1 A 63 63 TYR CA C 63 57.284 58.311 -1.027 1
1 674 . 9 1 1 A 63 63 TYR CB C 63 41.467 41.834 -0.367 1
1 679 . 9 1 1 A 63 63 TYR N N 63 124.712 124.262 0.450 1
1 680 . 9 1 1 A 64 64 SER H H 64 7.244 8.234 -0.990 1
1 681 . 9 1 1 A 64 64 SER HA H 64 5.077 5.490 -0.413 1
1 684 . 9 1 1 A 64 64 SER C C 64 169.712 173.083 -3.371 1
1 685 . 9 1 1 A 64 64 SER CA C 64 54.181 55.688 -1.507 1
1 686 . 9 1 1 A 64 64 SER CB C 64 61.122 65.496 -4.374 1
1 687 . 9 1 1 A 64 64 SER N N 64 120.593 119.064 1.529 1
1 688 . 9 1 1 A 65 65 ILE H H 65 8.686 8.726 -0.040 1
1 689 . 9 1 1 A 65 65 ILE HA H 65 3.937 4.797 -0.860 1
1 699 . 9 1 1 A 65 65 ILE C C 65 172.217 175.353 -3.136 1
1 700 . 9 1 1 A 65 65 ILE CA C 65 58.288 59.587 -1.299 1
1 701 . 9 1 1 A 65 65 ILE CB C 65 36.110 39.643 -3.533 1
1 705 . 9 1 1 A 65 65 ILE N N 65 127.792 125.636 2.156 1
1 706 . 9 1 1 A 66 66 GLY H H 66 7.883 8.552 -0.669 1
1 707 . 9 1 1 A 66 66 GLY HA2 H 66 4.799 4.340 0.459 1
1 708 . 9 1 1 A 66 66 GLY HA3 H 66 3.468 4.356 -0.888 1
1 709 . 9 1 1 A 66 66 GLY C C 66 171.983 174.022 -2.039 1
1 710 . 9 1 1 A 66 66 GLY CA C 66 40.534 45.085 -4.551 1
1 711 . 9 1 1 A 66 66 GLY N N 66 112.632 113.155 -0.523 1
1 712 . 9 1 1 A 67 67 GLY H H 67 8.483 8.686 -0.203 1
1 713 . 9 1 1 A 67 67 GLY HA2 H 67 3.836 3.974 -0.138 1
1 714 . 9 1 1 A 67 67 GLY HA3 H 67 3.682 3.997 -0.315 1
1 715 . 9 1 1 A 67 67 GLY C C 67 172.954 174.247 -1.293 1
1 716 . 9 1 1 A 67 67 GLY CA C 67 43.568 46.310 -2.742 1
1 717 . 9 1 1 A 67 67 GLY N N 67 104.625 110.389 -5.764 1
1 718 . 9 1 1 A 68 68 LEU H H 68 8.236 7.509 0.727 1
1 719 . 9 1 1 A 68 68 LEU HA H 68 4.154 4.681 -0.527 1
1 729 . 9 1 1 A 68 68 LEU C C 68 173.838 175.207 -1.369 1
1 730 . 9 1 1 A 68 68 LEU CA C 68 51.025 52.934 -1.909 1
1 731 . 9 1 1 A 68 68 LEU CB C 68 38.837 43.800 -4.963 1
1 735 . 9 1 1 A 68 68 LEU N N 68 118.919 120.522 -1.603 1
1 736 . 9 1 1 A 69 69 SER H H 69 8.284 8.895 -0.611 1
1 737 . 9 1 1 A 69 69 SER HA H 69 4.765 5.066 -0.301 1
1 740 . 9 1 1 A 69 69 SER C C 69 170.044 172.985 -2.941 1
1 741 . 9 1 1 A 69 69 SER CA C 69 54.639 55.078 -0.439 1
1 742 . 9 1 1 A 69 69 SER CB C 69 61.216 63.733 -2.517 1
1 743 . 9 1 1 A 69 69 SER N N 69 116.361 117.134 -0.773 1
1 744 . 9 1 1 A 70 70 PRO HA H 70 5.141 4.766 0.375 1
1 751 . 9 1 1 A 70 70 PRO C C 70 174.858 177.549 -2.691 1
1 752 . 9 1 1 A 70 70 PRO CA C 70 60.810 63.987 -3.177 1
1 753 . 9 1 1 A 70 70 PRO CB C 70 30.657 31.736 -1.079 1
1 756 . 9 1 1 A 71 71 PHE H H 71 8.139 9.146 -1.007 1
1 757 . 9 1 1 A 71 71 PHE HA H 71 4.202 4.395 -0.193 1
1 765 . 9 1 1 A 71 71 PHE C C 71 172.870 174.488 -1.618 1
1 766 . 9 1 1 A 71 71 PHE CA C 71 55.410 59.014 -3.604 1
1 767 . 9 1 1 A 71 71 PHE CB C 71 36.027 37.554 -1.527 1
1 773 . 9 1 1 A 71 71 PHE N N 71 125.409 123.314 2.095 1
1 774 . 9 1 1 A 72 72 SER H H 72 8.182 7.842 0.340 1
1 775 . 9 1 1 A 72 72 SER HA H 72 4.755 4.998 -0.243 1
1 778 . 9 1 1 A 72 72 SER C C 72 168.850 172.668 -3.818 1
1 779 . 9 1 1 A 72 72 SER CA C 72 55.926 56.355 -0.429 1
1 780 . 9 1 1 A 72 72 SER CB C 72 64.208 66.778 -2.570 1
1 781 . 9 1 1 A 72 72 SER N N 72 113.509 110.370 3.139 1
1 782 . 9 1 1 A 73 73 GLU H H 73 8.422 8.737 -0.315 1
1 783 . 9 1 1 A 73 73 GLU HA H 73 4.966 5.068 -0.102 1
1 788 . 9 1 1 A 73 73 GLU C C 73 173.192 174.699 -1.507 1
1 789 . 9 1 1 A 73 73 GLU CA C 73 52.815 54.795 -1.980 1
1 790 . 9 1 1 A 73 73 GLU CB C 73 29.416 32.656 -3.240 1
1 792 . 9 1 1 A 73 73 GLU N N 73 123.046 121.927 1.119 1
1 793 . 9 1 1 A 74 74 TYR H H 74 9.205 8.906 0.299 1
1 794 . 9 1 1 A 74 74 TYR HA H 74 4.799 5.012 -0.213 1
1 801 . 9 1 1 A 74 74 TYR C C 74 170.775 174.714 -3.939 1
1 802 . 9 1 1 A 74 74 TYR CA C 74 55.291 56.878 -1.587 1
1 803 . 9 1 1 A 74 74 TYR CB C 74 42.943 42.517 0.426 1
1 808 . 9 1 1 A 74 74 TYR N N 74 125.351 125.199 0.152 1
1 809 . 9 1 1 A 75 75 ALA H H 75 8.639 8.210 0.429 1
1 810 . 9 1 1 A 75 75 ALA HA H 75 5.271 5.560 -0.289 1
1 814 . 9 1 1 A 75 75 ALA C C 75 173.698 176.511 -2.813 1
1 815 . 9 1 1 A 75 75 ALA CA C 75 47.904 50.285 -2.381 1
1 816 . 9 1 1 A 75 75 ALA CB C 75 19.634 21.638 -2.004 1
1 817 . 9 1 1 A 75 75 ALA N N 75 121.555 124.726 -3.171 1
1 818 . 9 1 1 A 76 76 PHE H H 76 9.066 9.147 -0.081 1
1 819 . 9 1 1 A 76 76 PHE HA H 76 5.496 5.456 0.040 1
1 827 . 9 1 1 A 76 76 PHE C C 76 172.268 174.725 -2.457 1
1 828 . 9 1 1 A 76 76 PHE CA C 76 54.216 56.476 -2.260 1
1 829 . 9 1 1 A 76 76 PHE CB C 76 41.901 43.641 -1.740 1
1 835 . 9 1 1 A 76 76 PHE N N 76 116.545 119.523 -2.978 1
1 836 . 9 1 1 A 77 77 ARG H H 77 9.216 9.071 0.145 1
1 837 . 9 1 1 A 77 77 ARG HA H 77 4.357 5.224 -0.867 1
1 845 . 9 1 1 A 77 77 ARG C C 77 169.998 174.097 -4.099 1
1 846 . 9 1 1 A 77 77 ARG CA C 77 52.414 54.945 -2.531 1
1 847 . 9 1 1 A 77 77 ARG CB C 77 30.794 34.020 -3.226 1
1 850 . 9 1 1 A 77 77 ARG N N 77 115.738 118.811 -3.073 1
1 852 . 9 1 1 A 78 78 VAL H H 78 8.135 8.801 -0.666 1
1 853 . 9 1 1 A 78 78 VAL HA H 78 4.884 4.855 0.029 1
1 861 . 9 1 1 A 78 78 VAL C C 78 171.098 174.708 -3.610 1
1 862 . 9 1 1 A 78 78 VAL CA C 78 57.566 60.851 -3.285 1
1 863 . 9 1 1 A 78 78 VAL CB C 78 33.146 33.618 -0.472 1
1 866 . 9 1 1 A 78 78 VAL N N 78 117.942 124.107 -6.165 1
1 867 . 9 1 1 A 79 79 LEU H H 79 9.167 8.332 0.835 1
1 868 . 9 1 1 A 79 79 LEU HA H 79 4.575 4.988 -0.413 1
1 878 . 9 1 1 A 79 79 LEU C C 79 171.447 175.050 -3.603 1
1 879 . 9 1 1 A 79 79 LEU CA C 79 51.642 53.532 -1.890 1
1 880 . 9 1 1 A 79 79 LEU CB C 79 42.776 45.914 -3.138 1
1 884 . 9 1 1 A 79 79 LEU N N 79 123.913 119.747 4.166 1
1 885 . 9 1 1 A 80 80 ALA H H 80 9.325 8.616 0.709 1
1 886 . 9 1 1 A 80 80 ALA HA H 80 4.654 3.986 0.668 1
1 890 . 9 1 1 A 80 80 ALA C C 80 172.070 176.818 -4.748 1
1 891 . 9 1 1 A 80 80 ALA CA C 80 48.169 51.020 -2.851 1
1 892 . 9 1 1 A 80 80 ALA CB C 80 20.366 19.887 0.479 1
1 893 . 9 1 1 A 80 80 ALA N N 80 124.135 122.385 1.750 1
1 894 . 9 1 1 A 81 81 VAL H H 81 7.953 7.795 0.158 1
1 895 . 9 1 1 A 81 81 VAL HA H 81 4.293 4.637 -0.344 1
1 903 . 9 1 1 A 81 81 VAL C C 81 172.873 174.194 -1.321 1
1 904 . 9 1 1 A 81 81 VAL CA C 81 58.959 60.598 -1.639 1
1 905 . 9 1 1 A 81 81 VAL CB C 81 31.412 35.031 -3.619 1
1 908 . 9 1 1 A 81 81 VAL N N 81 118.503 120.906 -2.403 1
1 909 . 9 1 1 A 82 82 ASN H H 82 8.262 8.158 0.104 1
1 910 . 9 1 1 A 82 82 ASN HA H 82 4.945 5.007 -0.062 1
1 915 . 9 1 1 A 82 82 ASN C C 82 173.273 175.403 -2.130 1
1 916 . 9 1 1 A 82 82 ASN CA C 82 48.714 51.552 -2.838 1
1 917 . 9 1 1 A 82 82 ASN CB C 82 36.796 40.211 -3.415 1
1 918 . 9 1 1 A 82 82 ASN N N 82 125.425 123.851 1.574 1
1 920 . 9 1 1 A 83 83 SER HA H 83 3.966 4.071 -0.105 1
1 923 . 9 1 1 A 83 83 SER C C 83 172.812 176.849 -4.037 1
1 924 . 9 1 1 A 83 83 SER CA C 83 59.047 62.336 -3.289 1
1 925 . 9 1 1 A 83 83 SER CB C 83 60.406 62.846 -2.440 1
1 926 . 9 1 1 A 84 84 ILE H H 84 7.803 7.954 -0.151 1
1 927 . 9 1 1 A 84 84 ILE HA H 84 3.862 3.755 0.107 1
1 937 . 9 1 1 A 84 84 ILE C C 84 174.481 176.136 -1.655 1
1 938 . 9 1 1 A 84 84 ILE CA C 84 59.188 64.047 -4.859 1
1 939 . 9 1 1 A 84 84 ILE CB C 84 34.677 38.251 -3.574 1
1 943 . 9 1 1 A 84 84 ILE N N 84 121.222 118.654 2.568 1
1 944 . 9 1 1 A 85 85 GLY H H 85 7.435 7.046 0.389 1
1 945 . 9 1 1 A 85 85 GLY HA2 H 85 4.149 4.029 0.120 1
1 946 . 9 1 1 A 85 85 GLY HA3 H 85 3.747 4.029 -0.282 1
1 947 . 9 1 1 A 85 85 GLY C C 85 168.589 172.572 -3.983 1
1 948 . 9 1 1 A 85 85 GLY CA C 85 42.931 45.209 -2.278 1
1 949 . 9 1 1 A 85 85 GLY N N 85 106.320 105.679 0.641 1
1 950 . 9 1 1 A 86 86 ARG H H 86 8.190 8.429 -0.239 1
1 951 . 9 1 1 A 86 86 ARG HA H 86 4.452 4.471 -0.019 1
1 958 . 9 1 1 A 86 86 ARG C C 86 175.286 176.327 -1.041 1
1 959 . 9 1 1 A 86 86 ARG CA C 86 53.223 55.694 -2.471 1
1 960 . 9 1 1 A 86 86 ARG CB C 86 29.517 30.355 -0.838 1
1 963 . 9 1 1 A 86 86 ARG N N 86 118.339 117.182 1.157 1
1 964 . 9 1 1 A 87 87 GLY H H 87 8.900 9.000 -0.100 1
1 965 . 9 1 1 A 87 87 GLY HA2 H 87 4.211 4.020 0.191 1
1 966 . 9 1 1 A 87 87 GLY HA3 H 87 3.967 4.032 -0.065 1
1 967 . 9 1 1 A 87 87 GLY C C 87 168.101 172.787 -4.686 1
1 968 . 9 1 1 A 87 87 GLY CA C 87 42.281 44.006 -1.725 1
1 969 . 9 1 1 A 87 87 GLY N N 87 113.482 109.107 4.375 1
1 970 . 9 1 1 A 88 88 PRO HA H 88 4.563 4.575 -0.012 1
1 977 . 9 1 1 A 88 88 PRO CA C 88 60.994 62.129 -1.135 1
1 978 . 9 1 1 A 88 88 PRO CB C 88 29.873 31.658 -1.785 1
1 981 . 9 1 1 A 89 89 PRO HA H 89 4.490 4.469 0.021 1
1 987 . 9 1 1 A 89 89 PRO C C 89 174.543 176.306 -1.763 1
1 988 . 9 1 1 A 89 89 PRO CA C 89 59.435 62.425 -2.990 1
1 989 . 9 1 1 A 89 89 PRO CB C 89 29.805 31.758 -1.953 1
1 992 . 9 1 1 A 90 90 SER H H 90 8.808 8.401 0.407 1
1 993 . 9 1 1 A 90 90 SER HA H 90 4.202 4.546 -0.344 1
1 996 . 9 1 1 A 90 90 SER C C 90 171.870 174.118 -2.248 1
1 997 . 9 1 1 A 90 90 SER CA C 90 55.868 57.777 -1.909 1
1 998 . 9 1 1 A 90 90 SER CB C 90 64.504 64.437 0.067 1
1 999 . 9 1 1 A 90 90 SER N N 90 113.781 117.023 -3.242 1
1 1000 . 9 1 1 A 91 91 GLU H H 91 8.291 8.506 -0.215 1
1 1001 . 9 1 1 A 91 91 GLU HA H 91 4.131 4.154 -0.023 1
1 1006 . 9 1 1 A 91 91 GLU C C 91 174.882 176.766 -1.884 1
1 1007 . 9 1 1 A 91 91 GLU CA C 91 54.984 57.010 -2.026 1
1 1008 . 9 1 1 A 91 91 GLU CB C 91 27.643 29.344 -1.701 1
1 1010 . 9 1 1 A 91 91 GLU N N 91 117.930 123.545 -5.615 1
1 1011 . 9 1 1 A 92 92 ALA H H 92 8.605 8.259 0.346 1
1 1012 . 9 1 1 A 92 92 ALA HA H 92 5.068 4.443 0.625 1
1 1016 . 9 1 1 A 92 92 ALA C C 92 176.227 177.852 -1.625 1
1 1017 . 9 1 1 A 92 92 ALA CA C 92 48.997 53.032 -4.035 1
1 1018 . 9 1 1 A 92 92 ALA CB C 92 17.756 19.041 -1.285 1
1 1019 . 9 1 1 A 92 92 ALA N N 92 126.421 127.170 -0.749 1
1 1020 . 9 1 1 A 93 93 VAL H H 93 9.051 8.994 0.057 1
1 1021 . 9 1 1 A 93 93 VAL HA H 93 4.642 5.094 -0.452 1
1 1029 . 9 1 1 A 93 93 VAL C C 93 172.010 174.655 -2.645 1
1 1030 . 9 1 1 A 93 93 VAL CA C 93 57.495 59.530 -2.035 1
1 1031 . 9 1 1 A 93 93 VAL CB C 93 32.774 34.335 -1.561 1
1 1034 . 9 1 1 A 93 93 VAL N N 93 117.322 117.972 -0.650 1
1 1035 . 9 1 1 A 94 94 ARG H H 94 8.470 8.654 -0.184 1
1 1036 . 9 1 1 A 94 94 ARG HA H 94 5.692 5.320 0.372 1
1 1043 . 9 1 1 A 94 94 ARG C C 94 173.635 174.537 -0.902 1
1 1044 . 9 1 1 A 94 94 ARG CA C 94 52.038 54.517 -2.479 1
1 1045 . 9 1 1 A 94 94 ARG CB C 94 30.966 32.935 -1.969 1
1 1048 . 9 1 1 A 94 94 ARG N N 94 122.258 121.397 0.861 1
1 1049 . 9 1 1 A 95 95 ALA H H 95 9.051 8.899 0.152 1
1 1050 . 9 1 1 A 95 95 ALA HA H 95 4.642 5.235 -0.593 1
1 1054 . 9 1 1 A 95 95 ALA C C 95 172.285 175.203 -2.918 1
1 1055 . 9 1 1 A 95 95 ALA CA C 95 49.191 50.821 -1.630 1
1 1056 . 9 1 1 A 95 95 ALA CB C 95 22.562 22.291 0.271 1
1 1057 . 9 1 1 A 95 95 ALA N N 95 121.931 126.126 -4.195 1
1 1058 . 9 1 1 A 96 96 ARG H H 96 8.550 8.621 -0.071 1
1 1059 . 9 1 1 A 96 96 ARG HA H 96 5.407 5.087 0.320 1
1 1066 . 9 1 1 A 96 96 ARG C C 96 174.547 176.164 -1.617 1
1 1067 . 9 1 1 A 96 96 ARG CA C 96 51.439 55.363 -3.924 1
1 1068 . 9 1 1 A 96 96 ARG CB C 96 30.708 31.611 -0.903 1
1 1071 . 9 1 1 A 96 96 ARG N N 96 121.155 124.617 -3.462 1
1 1072 . 9 1 1 A 97 97 THR H H 97 8.797 9.111 -0.314 1
1 1073 . 9 1 1 A 97 97 THR HA H 97 4.116 4.563 -0.447 1
1 1078 . 9 1 1 A 97 97 THR C C 97 173.577 175.024 -1.447 1
1 1079 . 9 1 1 A 97 97 THR CA C 97 58.800 61.181 -2.381 1
1 1080 . 9 1 1 A 97 97 THR CB C 97 67.461 69.665 -2.204 1
1 1082 . 9 1 1 A 97 97 THR N N 97 114.657 116.953 -2.296 1
1 1083 . 9 1 1 A 98 98 GLY H H 98 7.505 8.467 -0.962 1
1 1084 . 9 1 1 A 98 98 GLY HA2 H 98 3.866 4.113 -0.247 1
1 1085 . 9 1 1 A 98 98 GLY HA3 H 98 3.743 4.164 -0.421 1
1 1086 . 9 1 1 A 98 98 GLY C C 98 170.637 172.988 -2.351 1
1 1087 . 9 1 1 A 98 98 GLY CA C 98 42.332 44.657 -2.325 1
1 1088 . 9 1 1 A 98 98 GLY N N 98 106.172 107.831 -1.659 1
1 1089 . 9 1 1 A 99 99 GLU H H 99 8.145 8.617 -0.472 1
1 1090 . 9 1 1 A 99 99 GLU HA H 99 4.210 5.238 -1.028 1
1 1095 . 9 1 1 A 99 99 GLU C C 99 174.134 175.071 -0.937 1
1 1096 . 9 1 1 A 99 99 GLU CA C 99 53.828 55.401 -1.573 1
1 1097 . 9 1 1 A 99 99 GLU CB C 99 28.774 31.892 -3.118 1
1 1099 . 9 1 1 A 99 99 GLU N N 99 117.634 117.699 -0.065 1
1 1100 . 9 1 1 A 100 100 GLN H H 100 8.647 8.708 -0.061 1
1 1101 . 9 1 1 A 100 100 GLN HA H 100 4.247 4.635 -0.388 1
1 1108 . 9 1 1 A 100 100 GLN C C 100 173.348 174.500 -1.152 1
1 1109 . 9 1 1 A 100 100 GLN CA C 100 53.634 54.980 -1.346 1
1 1110 . 9 1 1 A 100 100 GLN CB C 100 27.392 32.648 -5.256 1
1 1112 . 9 1 1 A 100 100 GLN N N 100 121.960 121.252 0.708 1
1 1114 . 9 1 1 A 101 101 SER H H 101 8.416 8.749 -0.333 1
1 1115 . 9 1 1 A 101 101 SER HA H 101 4.418 4.065 0.353 1
1 1117 . 9 1 1 A 101 101 SER C C 101 172.148 175.033 -2.885 1
1 1118 . 9 1 1 A 101 101 SER CA C 101 55.926 60.409 -4.483 1
1 1119 . 9 1 1 A 101 101 SER CB C 101 61.617 63.078 -1.461 1
1 1120 . 9 1 1 A 101 101 SER N N 101 118.609 121.291 -2.682 1
1 1121 . 9 1 1 A 102 102 GLY H H 102 8.233 8.199 0.034 1
1 1122 . 9 1 1 A 102 102 GLY HA2 H 102 4.080 4.044 0.036 1
1 1123 . 9 1 1 A 102 102 GLY HA3 H 102 3.981 4.049 -0.068 1
1 1124 . 9 1 1 A 102 102 GLY C C 102 169.461 174.927 -5.466 1
1 1125 . 9 1 1 A 102 102 GLY CA C 102 42.332 45.941 -3.609 1
1 1126 . 9 1 1 A 102 102 GLY N N 102 110.483 112.875 -2.392 1
1 1127 . 9 1 1 A 103 103 PRO HA H 103 4.618 4.407 0.211 1
1 1134 . 9 1 1 A 103 103 PRO CA C 103 57.843 64.104 -6.261 1
1 1135 . 9 1 1 A 103 103 PRO CB C 103 28.671 31.895 -3.224 1
1 1 . 10 1 1 A 6 6 SER HA H 6 4.492 4.745 -0.253 1
1 4 . 10 1 1 A 6 6 SER CA C 6 55.621 56.617 -0.996 1
1 5 . 10 1 1 A 6 6 SER CB C 6 62.104 64.181 -2.077 1
1 6 . 10 1 1 A 7 7 GLY H H 7 8.244 8.230 0.014 1
1 7 . 10 1 1 A 7 7 GLY HA2 H 7 3.873 4.027 -0.154 1
1 8 . 10 1 1 A 7 7 GLY HA3 H 7 3.737 4.031 -0.294 1
1 9 . 10 1 1 A 7 7 GLY CA C 7 41.743 44.310 -2.567 1
1 10 . 10 1 1 A 7 7 GLY N N 7 109.193 115.466 -6.273 1
1 11 . 10 1 1 A 8 8 PRO HA H 8 4.286 4.582 -0.296 1
1 18 . 10 1 1 A 8 8 PRO C C 8 173.841 175.454 -1.613 1
1 19 . 10 1 1 A 8 8 PRO CA C 8 60.528 62.583 -2.055 1
1 20 . 10 1 1 A 8 8 PRO CB C 8 30.299 33.155 -2.856 1
1 23 . 10 1 1 A 9 9 LYS H H 9 8.877 8.456 0.421 1
1 24 . 10 1 1 A 9 9 LYS HA H 9 4.360 4.832 -0.472 1
1 33 . 10 1 1 A 9 9 LYS C C 9 173.492 174.175 -0.683 1
1 34 . 10 1 1 A 9 9 LYS CA C 9 52.135 53.108 -0.973 1
1 35 . 10 1 1 A 9 9 LYS CB C 9 28.798 33.221 -4.423 1
1 39 . 10 1 1 A 9 9 LYS N N 9 120.404 120.484 -0.080 1
1 40 . 10 1 1 A 10 10 PRO HA H 10 4.284 4.628 -0.344 1
1 47 . 10 1 1 A 10 10 PRO CA C 10 59.326 61.636 -2.310 1
1 48 . 10 1 1 A 10 10 PRO CB C 10 28.825 31.608 -2.783 1
1 51 . 10 1 1 A 11 11 PRO HA H 11 4.468 4.824 -0.356 1
1 58 . 10 1 1 A 11 11 PRO C C 11 171.993 176.313 -4.320 1
1 59 . 10 1 1 A 11 11 PRO CA C 11 60.422 62.571 -2.149 1
1 60 . 10 1 1 A 11 11 PRO CB C 11 30.418 33.052 -2.634 1
1 63 . 10 1 1 A 12 12 ILE H H 12 7.554 8.034 -0.480 1
1 64 . 10 1 1 A 12 12 ILE HA H 12 4.676 4.722 -0.046 1
1 74 . 10 1 1 A 12 12 ILE C C 12 171.721 175.037 -3.316 1
1 75 . 10 1 1 A 12 12 ILE CA C 12 56.843 58.733 -1.890 1
1 76 . 10 1 1 A 12 12 ILE CB C 12 40.560 41.289 -0.729 1
1 80 . 10 1 1 A 12 12 ILE N N 12 109.695 116.603 -6.908 1
1 81 . 10 1 1 A 13 13 ASP H H 13 8.435 9.067 -0.632 1
1 82 . 10 1 1 A 13 13 ASP HA H 13 4.094 4.261 -0.167 1
1 85 . 10 1 1 A 13 13 ASP C C 13 171.803 176.185 -4.382 1
1 86 . 10 1 1 A 13 13 ASP CA C 13 52.610 54.992 -2.382 1
1 87 . 10 1 1 A 13 13 ASP CB C 13 36.357 40.142 -3.785 1
1 88 . 10 1 1 A 13 13 ASP N N 13 116.219 122.070 -5.851 1
1 89 . 10 1 1 A 14 14 LEU H H 14 7.483 8.019 -0.536 1
1 90 . 10 1 1 A 14 14 LEU HA H 14 4.990 4.839 0.151 1
1 100 . 10 1 1 A 14 14 LEU C C 14 174.702 175.374 -0.672 1
1 101 . 10 1 1 A 14 14 LEU CA C 14 53.811 55.041 -1.230 1
1 102 . 10 1 1 A 14 14 LEU CB C 14 40.148 42.338 -2.190 1
1 106 . 10 1 1 A 14 14 LEU N N 14 118.463 121.023 -2.560 1
1 107 . 10 1 1 A 15 15 VAL H H 15 9.209 8.688 0.521 1
1 108 . 10 1 1 A 15 15 VAL HA H 15 4.250 4.832 -0.582 1
1 116 . 10 1 1 A 15 15 VAL C C 15 172.080 174.138 -2.058 1
1 117 . 10 1 1 A 15 15 VAL CA C 15 58.570 60.399 -1.829 1
1 118 . 10 1 1 A 15 15 VAL CB C 15 34.146 36.103 -1.957 1
1 121 . 10 1 1 A 15 15 VAL N N 15 124.833 127.152 -2.319 1
1 122 . 10 1 1 A 16 16 VAL H H 16 8.390 8.920 -0.530 1
1 123 . 10 1 1 A 16 16 VAL HA H 16 4.343 4.495 -0.152 1
1 131 . 10 1 1 A 16 16 VAL C C 16 174.672 175.754 -1.082 1
1 132 . 10 1 1 A 16 16 VAL CA C 16 59.188 61.187 -1.999 1
1 133 . 10 1 1 A 16 16 VAL CB C 16 29.187 33.244 -4.057 1
1 136 . 10 1 1 A 16 16 VAL N N 16 124.654 124.993 -0.339 1
1 137 . 10 1 1 A 17 17 THR H H 17 8.638 8.382 0.256 1
1 138 . 10 1 1 A 17 17 THR HA H 17 4.195 4.419 -0.224 1
1 143 . 10 1 1 A 17 17 THR C C 17 172.661 173.464 -0.803 1
1 144 . 10 1 1 A 17 17 THR CA C 17 60.318 63.462 -3.144 1
1 145 . 10 1 1 A 17 17 THR CB C 17 66.420 70.674 -4.254 1
1 147 . 10 1 1 A 17 17 THR N N 17 120.942 122.663 -1.721 1
1 148 . 10 1 1 A 18 18 GLU H H 18 7.361 7.642 -0.281 1
1 149 . 10 1 1 A 18 18 GLU HA H 18 4.497 4.725 -0.228 1
1 154 . 10 1 1 A 18 18 GLU C C 18 171.691 174.747 -3.056 1
1 155 . 10 1 1 A 18 18 GLU CA C 18 53.687 55.326 -1.639 1
1 156 . 10 1 1 A 18 18 GLU CB C 18 30.802 33.837 -3.035 1
1 158 . 10 1 1 A 18 18 GLU N N 18 119.088 118.139 0.949 1
1 159 . 10 1 1 A 19 19 THR H H 19 8.164 8.599 -0.435 1
1 160 . 10 1 1 A 19 19 THR HA H 19 4.912 5.036 -0.124 1
1 165 . 10 1 1 A 19 19 THR C C 19 171.606 172.827 -1.221 1
1 166 . 10 1 1 A 19 19 THR CA C 19 58.473 60.675 -2.202 1
1 167 . 10 1 1 A 19 19 THR CB C 19 70.103 71.048 -0.945 1
1 169 . 10 1 1 A 19 19 THR N N 19 112.424 113.783 -1.359 1
1 170 . 10 1 1 A 20 20 THR H H 20 8.750 9.012 -0.262 1
1 171 . 10 1 1 A 20 20 THR HA H 20 4.710 4.763 -0.053 1
1 176 . 10 1 1 A 20 20 THR C C 20 172.785 176.161 -3.376 1
1 177 . 10 1 1 A 20 20 THR CA C 20 58.059 61.020 -2.961 1
1 178 . 10 1 1 A 20 20 THR CB C 20 68.782 70.946 -2.164 1
1 180 . 10 1 1 A 20 20 THR N N 20 113.438 121.237 -7.799 1
1 181 . 10 1 1 A 21 21 ALA H H 21 8.453 8.997 -0.544 1
1 182 . 10 1 1 A 21 21 ALA HA H 21 4.079 4.452 -0.373 1
1 186 . 10 1 1 A 21 21 ALA C C 21 174.130 178.016 -3.886 1
1 187 . 10 1 1 A 21 21 ALA CA C 21 52.680 55.439 -2.759 1
1 188 . 10 1 1 A 21 21 ALA CB C 21 16.893 18.500 -1.607 1
1 189 . 10 1 1 A 21 21 ALA N N 21 120.078 126.194 -6.116 1
1 190 . 10 1 1 A 22 22 THR H H 22 7.132 7.497 -0.365 1
1 191 . 10 1 1 A 22 22 THR HA H 22 4.433 4.723 -0.290 1
1 196 . 10 1 1 A 22 22 THR C C 22 171.434 173.499 -2.065 1
1 197 . 10 1 1 A 22 22 THR CA C 22 56.836 60.444 -3.608 1
1 198 . 10 1 1 A 22 22 THR CB C 22 68.772 69.223 -0.451 1
1 200 . 10 1 1 A 22 22 THR N N 22 95.772 104.237 -8.465 1
1 201 . 10 1 1 A 23 23 SER H H 23 7.326 7.519 -0.193 1
1 202 . 10 1 1 A 23 23 SER HA H 23 5.562 5.251 0.311 1
1 205 . 10 1 1 A 23 23 SER C C 23 169.267 172.183 -2.916 1
1 206 . 10 1 1 A 23 23 SER CA C 23 54.445 57.654 -3.209 1
1 207 . 10 1 1 A 23 23 SER CB C 23 65.905 67.061 -1.156 1
1 208 . 10 1 1 A 23 23 SER N N 23 115.757 115.637 0.120 1
1 209 . 10 1 1 A 24 24 VAL H H 24 7.983 8.586 -0.603 1
1 210 . 10 1 1 A 24 24 VAL HA H 24 4.334 4.510 -0.176 1
1 218 . 10 1 1 A 24 24 VAL C C 24 171.917 173.472 -1.555 1
1 219 . 10 1 1 A 24 24 VAL CA C 24 58.642 60.266 -1.624 1
1 220 . 10 1 1 A 24 24 VAL CB C 24 34.254 34.943 -0.689 1
1 223 . 10 1 1 A 24 24 VAL N N 24 116.595 120.695 -4.100 1
1 224 . 10 1 1 A 25 25 THR H H 25 8.636 8.821 -0.185 1
1 225 . 10 1 1 A 25 25 THR HA H 25 4.833 4.926 -0.093 1
1 230 . 10 1 1 A 25 25 THR C C 25 169.721 172.787 -3.066 1
1 231 . 10 1 1 A 25 25 THR CA C 25 59.699 61.736 -2.037 1
1 232 . 10 1 1 A 25 25 THR CB C 25 67.303 70.123 -2.820 1
1 234 . 10 1 1 A 25 25 THR N N 25 121.690 122.648 -0.958 1
1 235 . 10 1 1 A 26 26 LEU H H 26 8.629 9.418 -0.789 1
1 236 . 10 1 1 A 26 26 LEU HA H 26 5.315 5.376 -0.061 1
1 246 . 10 1 1 A 26 26 LEU C C 26 173.182 175.444 -2.262 1
1 247 . 10 1 1 A 26 26 LEU CA C 26 50.643 53.233 -2.590 1
1 248 . 10 1 1 A 26 26 LEU CB C 26 43.976 45.484 -1.508 1
1 252 . 10 1 1 A 26 26 LEU N N 26 126.843 130.476 -3.633 1
1 253 . 10 1 1 A 27 27 THR H H 27 8.704 9.091 -0.387 1
1 254 . 10 1 1 A 27 27 THR HA H 27 4.822 5.371 -0.549 1
1 259 . 10 1 1 A 27 27 THR C C 27 169.840 173.491 -3.651 1
1 260 . 10 1 1 A 27 27 THR CA C 27 58.077 59.566 -1.489 1
1 261 . 10 1 1 A 27 27 THR CB C 27 69.666 71.723 -2.057 1
1 263 . 10 1 1 A 27 27 THR N N 27 111.513 116.289 -4.776 1
1 264 . 10 1 1 A 28 28 TRP H H 28 7.339 8.193 -0.854 1
1 265 . 10 1 1 A 28 28 TRP HA H 28 4.963 5.516 -0.553 1
1 274 . 10 1 1 A 28 28 TRP C C 28 170.637 172.566 -1.929 1
1 275 . 10 1 1 A 28 28 TRP CA C 28 54.438 55.548 -1.110 1
1 276 . 10 1 1 A 28 28 TRP CB C 28 27.497 31.362 -3.865 1
1 282 . 10 1 1 A 28 28 TRP N N 28 117.895 119.179 -1.284 1
1 284 . 10 1 1 A 29 29 ASP H H 29 8.696 9.017 -0.321 1
1 285 . 10 1 1 A 29 29 ASP HA H 29 4.971 4.859 0.112 1
1 288 . 10 1 1 A 29 29 ASP C C 29 174.901 177.405 -2.504 1
1 289 . 10 1 1 A 29 29 ASP CA C 29 50.178 52.758 -2.580 1
1 290 . 10 1 1 A 29 29 ASP CB C 29 42.291 42.222 0.069 1
1 291 . 10 1 1 A 29 29 ASP N N 29 117.477 120.475 -2.998 1
1 292 . 10 1 1 A 30 30 SER H H 30 8.800 8.921 -0.121 1
1 293 . 10 1 1 A 30 30 SER HA H 30 4.389 4.130 0.259 1
1 296 . 10 1 1 A 30 30 SER C C 30 174.032 175.781 -1.749 1
1 297 . 10 1 1 A 30 30 SER CA C 30 58.694 60.639 -1.945 1
1 298 . 10 1 1 A 30 30 SER CB C 30 62.428 63.473 -1.045 1
1 299 . 10 1 1 A 30 30 SER N N 30 118.275 118.072 0.203 1
1 300 . 10 1 1 A 31 31 GLY H H 31 8.759 8.167 0.592 1
1 301 . 10 1 1 A 31 31 GLY HA2 H 31 4.239 4.028 0.211 1
1 302 . 10 1 1 A 31 31 GLY HA3 H 31 3.555 4.068 -0.513 1
1 303 . 10 1 1 A 31 31 GLY C C 31 171.325 174.010 -2.685 1
1 304 . 10 1 1 A 31 31 GLY CA C 31 43.637 45.642 -2.005 1
1 305 . 10 1 1 A 31 31 GLY N N 31 107.961 111.091 -3.130 1
1 306 . 10 1 1 A 32 32 ASN H H 32 8.173 8.333 -0.160 1
1 307 . 10 1 1 A 32 32 ASN HA H 32 4.749 4.832 -0.083 1
1 312 . 10 1 1 A 32 32 ASN C C 32 171.355 175.672 -4.317 1
1 313 . 10 1 1 A 32 32 ASN CA C 32 50.795 53.828 -3.033 1
1 314 . 10 1 1 A 32 32 ASN CB C 32 41.508 39.438 2.070 1
1 315 . 10 1 1 A 32 32 ASN N N 32 117.781 119.950 -2.169 1
1 317 . 10 1 1 A 33 33 SER HA H 33 4.291 4.365 -0.074 1
1 320 . 10 1 1 A 33 33 SER C C 33 172.449 174.157 -1.708 1
1 321 . 10 1 1 A 33 33 SER CA C 33 56.733 60.486 -3.753 1
1 322 . 10 1 1 A 33 33 SER CB C 33 60.884 64.163 -3.279 1
1 323 . 10 1 1 A 34 34 GLU H H 34 7.731 7.878 -0.147 1
1 324 . 10 1 1 A 34 34 GLU HA H 34 4.556 4.736 -0.180 1
1 329 . 10 1 1 A 34 34 GLU C C 34 171.792 173.982 -2.190 1
1 330 . 10 1 1 A 34 34 GLU CA C 34 51.818 53.056 -1.238 1
1 331 . 10 1 1 A 34 34 GLU CB C 34 26.891 30.642 -3.751 1
1 333 . 10 1 1 A 34 34 GLU N N 34 122.319 119.693 2.626 1
1 334 . 10 1 1 A 35 35 PRO HA H 35 4.165 4.822 -0.657 1
1 341 . 10 1 1 A 35 35 PRO C C 35 174.288 176.965 -2.677 1
1 342 . 10 1 1 A 35 35 PRO CA C 35 61.374 62.701 -1.327 1
1 343 . 10 1 1 A 35 35 PRO CB C 35 29.887 31.434 -1.547 1
1 346 . 10 1 1 A 36 36 VAL H H 36 8.348 8.257 0.091 1
1 347 . 10 1 1 A 36 36 VAL HA H 36 3.899 4.449 -0.550 1
1 355 . 10 1 1 A 36 36 VAL C C 36 173.344 177.038 -3.694 1
1 356 . 10 1 1 A 36 36 VAL CA C 36 59.014 60.953 -1.939 1
1 357 . 10 1 1 A 36 36 VAL CB C 36 31.865 33.508 -1.643 1
1 360 . 10 1 1 A 36 36 VAL N N 36 122.051 118.178 3.873 1
1 361 . 10 1 1 A 37 37 THR H H 37 8.780 8.150 0.630 1
1 362 . 10 1 1 A 37 37 THR HA H 37 3.923 4.205 -0.282 1
1 367 . 10 1 1 A 37 37 THR C C 37 172.171 174.558 -2.387 1
1 368 . 10 1 1 A 37 37 THR CA C 37 63.155 64.766 -1.611 1
1 369 . 10 1 1 A 37 37 THR CB C 37 65.941 69.329 -3.388 1
1 371 . 10 1 1 A 37 37 THR N N 37 122.351 117.765 4.586 1
1 372 . 10 1 1 A 38 38 TYR H H 38 7.304 7.269 0.035 1
1 373 . 10 1 1 A 38 38 TYR HA H 38 4.439 5.109 -0.670 1
1 380 . 10 1 1 A 38 38 TYR C C 38 168.385 172.739 -4.354 1
1 381 . 10 1 1 A 38 38 TYR CA C 38 54.101 56.581 -2.480 1
1 382 . 10 1 1 A 38 38 TYR CB C 38 35.874 40.404 -4.530 1
1 387 . 10 1 1 A 38 38 TYR N N 38 113.984 115.120 -1.136 1
1 388 . 10 1 1 A 39 39 TYR H H 39 9.445 8.725 0.720 1
1 389 . 10 1 1 A 39 39 TYR HA H 39 5.293 5.104 0.189 1
1 396 . 10 1 1 A 39 39 TYR C C 39 172.781 175.786 -3.005 1
1 397 . 10 1 1 A 39 39 TYR CA C 39 54.322 55.661 -1.339 1
1 398 . 10 1 1 A 39 39 TYR CB C 39 39.035 41.104 -2.069 1
1 401 . 10 1 1 A 39 39 TYR N N 39 115.092 117.993 -2.901 1
1 402 . 10 1 1 A 40 40 GLY H H 40 8.870 8.463 0.407 1
1 403 . 10 1 1 A 40 40 GLY HA2 H 40 5.137 4.082 1.055 1
1 404 . 10 1 1 A 40 40 GLY HA3 H 40 3.285 4.173 -0.888 1
1 405 . 10 1 1 A 40 40 GLY C C 40 169.688 172.843 -3.155 1
1 406 . 10 1 1 A 40 40 GLY CA C 40 41.415 44.675 -3.260 1
1 407 . 10 1 1 A 40 40 GLY N N 40 106.573 111.738 -5.165 1
1 408 . 10 1 1 A 41 41 ILE H H 41 8.917 8.465 0.452 1
1 409 . 10 1 1 A 41 41 ILE HA H 41 4.527 4.862 -0.335 1
1 419 . 10 1 1 A 41 41 ILE C C 41 172.692 174.705 -2.013 1
1 420 . 10 1 1 A 41 41 ILE CA C 41 57.597 59.992 -2.395 1
1 421 . 10 1 1 A 41 41 ILE CB C 41 37.840 42.196 -4.356 1
1 425 . 10 1 1 A 41 41 ILE N N 41 121.746 120.975 0.771 1
1 426 . 10 1 1 A 42 42 GLN H H 42 9.063 8.859 0.204 1
1 427 . 10 1 1 A 42 42 GLN HA H 42 5.655 5.436 0.219 1
1 434 . 10 1 1 A 42 42 GLN C C 42 172.841 174.421 -1.580 1
1 435 . 10 1 1 A 42 42 GLN CA C 42 50.789 54.392 -3.603 1
1 436 . 10 1 1 A 42 42 GLN CB C 42 28.898 32.925 -4.027 1
1 438 . 10 1 1 A 42 42 GLN N N 42 125.141 125.481 -0.340 1
1 440 . 10 1 1 A 43 43 TYR H H 43 9.066 8.800 0.266 1
1 441 . 10 1 1 A 43 43 TYR HA H 43 5.922 5.943 -0.021 1
1 448 . 10 1 1 A 43 43 TYR C C 43 171.219 172.667 -1.448 1
1 449 . 10 1 1 A 43 43 TYR CA C 43 53.349 56.093 -2.744 1
1 450 . 10 1 1 A 43 43 TYR CB C 43 41.074 42.213 -1.139 1
1 455 . 10 1 1 A 43 43 TYR N N 43 118.018 119.071 -1.053 1
1 456 . 10 1 1 A 44 44 ARG H H 44 8.400 8.537 -0.137 1
1 457 . 10 1 1 A 44 44 ARG HA H 44 4.542 4.368 0.174 1
1 464 . 10 1 1 A 44 44 ARG C C 44 171.974 174.336 -2.362 1
1 465 . 10 1 1 A 44 44 ARG CA C 44 52.453 54.758 -2.305 1
1 466 . 10 1 1 A 44 44 ARG CB C 44 31.125 32.498 -1.373 1
1 469 . 10 1 1 A 44 44 ARG N N 44 115.214 120.436 -5.222 1
1 470 . 10 1 1 A 45 45 ALA H H 45 8.846 8.220 0.626 1
1 471 . 10 1 1 A 45 45 ALA HA H 45 3.894 2.086 1.808 1
1 475 . 10 1 1 A 45 45 ALA C C 45 175.721 176.996 -1.275 1
1 476 . 10 1 1 A 45 45 ALA CA C 45 50.372 51.978 -1.606 1
1 477 . 10 1 1 A 45 45 ALA CB C 45 15.732 18.674 -2.942 1
1 478 . 10 1 1 A 45 45 ALA N N 45 126.463 127.570 -1.107 1
1 479 . 10 1 1 A 46 46 ALA H H 46 8.282 8.221 0.061 1
1 480 . 10 1 1 A 46 46 ALA HA H 46 3.922 3.840 0.082 1
1 484 . 10 1 1 A 46 46 ALA C C 46 176.236 178.134 -1.898 1
1 485 . 10 1 1 A 46 46 ALA CA C 46 50.773 53.631 -2.858 1
1 486 . 10 1 1 A 46 46 ALA CB C 46 16.244 18.386 -2.142 1
1 487 . 10 1 1 A 46 46 ALA N N 46 126.301 124.697 1.604 1
1 488 . 10 1 1 A 47 47 GLY HA2 H 47 3.882 3.940 -0.058 1
1 489 . 10 1 1 A 47 47 GLY HA3 H 47 3.695 3.970 -0.275 1
1 490 . 10 1 1 A 47 47 GLY C C 47 171.795 174.548 -2.753 1
1 491 . 10 1 1 A 47 47 GLY CA C 47 43.327 45.111 -1.784 1
1 492 . 10 1 1 A 48 48 THR H H 48 7.145 7.142 0.003 1
1 493 . 10 1 1 A 48 48 THR HA H 48 4.417 4.204 0.213 1
1 498 . 10 1 1 A 48 48 THR C C 48 171.325 174.409 -3.084 1
1 499 . 10 1 1 A 48 48 THR CA C 48 58.271 62.936 -4.665 1
1 500 . 10 1 1 A 48 48 THR CB C 48 68.846 69.252 -0.406 1
1 502 . 10 1 1 A 48 48 THR N N 48 110.190 114.872 -4.682 1
1 503 . 10 1 1 A 49 49 GLU H H 49 8.346 8.526 -0.180 1
1 504 . 10 1 1 A 49 49 GLU HA H 49 4.277 4.779 -0.502 1
1 509 . 10 1 1 A 49 49 GLU C C 49 174.109 175.742 -1.633 1
1 510 . 10 1 1 A 49 49 GLU CA C 49 52.909 55.674 -2.765 1
1 511 . 10 1 1 A 49 49 GLU CB C 49 27.845 29.501 -1.656 1
1 513 . 10 1 1 A 49 49 GLU N N 49 119.985 124.838 -4.853 1
1 514 . 10 1 1 A 50 50 GLY H H 50 7.617 8.558 -0.941 1
1 515 . 10 1 1 A 50 50 GLY HA2 H 50 3.935 4.201 -0.266 1
1 516 . 10 1 1 A 50 50 GLY HA3 H 50 3.935 4.224 -0.289 1
1 517 . 10 1 1 A 50 50 GLY C C 50 168.223 172.502 -4.279 1
1 518 . 10 1 1 A 50 50 GLY CA C 50 42.121 44.326 -2.205 1
1 519 . 10 1 1 A 50 50 GLY N N 50 108.670 110.622 -1.952 1
1 520 . 10 1 1 A 51 51 PRO HA H 51 4.298 4.736 -0.438 1
1 527 . 10 1 1 A 51 51 PRO C C 51 175.067 177.150 -2.083 1
1 528 . 10 1 1 A 51 51 PRO CA C 51 60.175 62.909 -2.734 1
1 529 . 10 1 1 A 51 51 PRO CB C 51 30.052 31.673 -1.621 1
1 532 . 10 1 1 A 52 52 PHE H H 52 8.442 8.714 -0.272 1
1 533 . 10 1 1 A 52 52 PHE HA H 52 3.981 4.510 -0.529 1
1 541 . 10 1 1 A 52 52 PHE C C 52 175.141 175.807 -0.666 1
1 542 . 10 1 1 A 52 52 PHE CA C 52 56.808 57.723 -0.915 1
1 543 . 10 1 1 A 52 52 PHE CB C 52 36.830 39.725 -2.895 1
1 549 . 10 1 1 A 52 52 PHE N N 52 118.707 123.098 -4.391 1
1 550 . 10 1 1 A 53 53 GLN H H 53 8.778 8.040 0.738 1
1 551 . 10 1 1 A 53 53 GLN HA H 53 4.149 4.176 -0.027 1
1 558 . 10 1 1 A 53 53 GLN C C 53 172.773 175.209 -2.436 1
1 559 . 10 1 1 A 53 53 GLN CA C 53 52.999 56.313 -3.314 1
1 560 . 10 1 1 A 53 53 GLN CB C 53 26.962 29.027 -2.065 1
1 562 . 10 1 1 A 53 53 GLN N N 53 122.164 121.482 0.682 1
1 564 . 10 1 1 A 54 54 GLU H H 54 8.432 8.518 -0.086 1
1 565 . 10 1 1 A 54 54 GLU HA H 54 5.533 5.167 0.366 1
1 570 . 10 1 1 A 54 54 GLU C C 54 173.930 174.890 -0.960 1
1 571 . 10 1 1 A 54 54 GLU CA C 54 52.981 55.173 -2.192 1
1 572 . 10 1 1 A 54 54 GLU CB C 54 31.712 33.642 -1.930 1
1 574 . 10 1 1 A 54 54 GLU N N 54 119.688 121.677 -1.989 1
1 575 . 10 1 1 A 55 55 VAL H H 55 9.077 8.434 0.643 1
1 576 . 10 1 1 A 55 55 VAL HA H 55 4.180 4.783 -0.603 1
1 584 . 10 1 1 A 55 55 VAL C C 55 171.811 174.323 -2.512 1
1 585 . 10 1 1 A 55 55 VAL CA C 55 59.664 60.681 -1.017 1
1 586 . 10 1 1 A 55 55 VAL CB C 55 31.827 35.477 -3.650 1
1 589 . 10 1 1 A 55 55 VAL N N 55 125.328 125.481 -0.153 1
1 590 . 10 1 1 A 56 56 ASP H H 56 8.639 9.066 -0.427 1
1 591 . 10 1 1 A 56 56 ASP HA H 56 5.250 5.763 -0.513 1
1 594 . 10 1 1 A 56 56 ASP C C 56 174.252 175.632 -1.380 1
1 595 . 10 1 1 A 56 56 ASP CA C 56 50.108 52.333 -2.225 1
1 596 . 10 1 1 A 56 56 ASP CB C 56 41.407 44.538 -3.131 1
1 597 . 10 1 1 A 56 56 ASP N N 56 125.773 124.987 0.786 1
1 598 . 10 1 1 A 57 57 GLY H H 57 7.222 8.581 -1.359 1
1 599 . 10 1 1 A 57 57 GLY HA2 H 57 3.479 3.893 -0.414 1
1 600 . 10 1 1 A 57 57 GLY HA3 H 57 2.719 3.960 -1.241 1
1 601 . 10 1 1 A 57 57 GLY C C 57 172.281 174.478 -2.197 1
1 602 . 10 1 1 A 57 57 GLY CA C 57 43.919 45.310 -1.391 1
1 603 . 10 1 1 A 57 57 GLY N N 57 105.564 110.737 -5.173 1
1 604 . 10 1 1 A 58 58 VAL H H 58 8.338 8.052 0.286 1
1 605 . 10 1 1 A 58 58 VAL HA H 58 3.860 4.315 -0.455 1
1 613 . 10 1 1 A 58 58 VAL C C 58 173.981 175.320 -1.339 1
1 614 . 10 1 1 A 58 58 VAL CA C 58 61.233 61.569 -0.336 1
1 615 . 10 1 1 A 58 58 VAL CB C 58 29.708 32.081 -2.373 1
1 618 . 10 1 1 A 58 58 VAL N N 58 121.466 120.978 0.488 1
1 619 . 10 1 1 A 59 59 ALA H H 59 9.038 8.727 0.311 1
1 620 . 10 1 1 A 59 59 ALA HA H 59 4.676 4.529 0.147 1
1 624 . 10 1 1 A 59 59 ALA C C 59 175.105 176.557 -1.452 1
1 625 . 10 1 1 A 59 59 ALA CA C 59 50.866 52.249 -1.383 1
1 626 . 10 1 1 A 59 59 ALA CB C 59 17.647 19.200 -1.553 1
1 627 . 10 1 1 A 59 59 ALA N N 59 130.928 130.664 0.264 1
1 628 . 10 1 1 A 60 60 THR H H 60 7.445 7.756 -0.311 1
1 629 . 10 1 1 A 60 60 THR HA H 60 4.642 4.689 -0.047 1
1 634 . 10 1 1 A 60 60 THR C C 60 169.528 174.113 -4.585 1
1 635 . 10 1 1 A 60 60 THR CA C 60 57.101 59.277 -2.176 1
1 636 . 10 1 1 A 60 60 THR CB C 60 67.982 72.341 -4.359 1
1 638 . 10 1 1 A 60 60 THR N N 60 109.256 109.107 0.149 1
1 639 . 10 1 1 A 61 61 THR H H 61 7.325 8.392 -1.067 1
1 640 . 10 1 1 A 61 61 THR HA H 61 2.896 3.528 -0.632 1
1 645 . 10 1 1 A 61 61 THR C C 61 169.678 173.066 -3.388 1
1 646 . 10 1 1 A 61 61 THR CA C 61 57.246 61.433 -4.187 1
1 647 . 10 1 1 A 61 61 THR CB C 61 63.794 68.243 -4.449 1
1 649 . 10 1 1 A 61 61 THR N N 61 105.670 110.970 -5.300 1
1 650 . 10 1 1 A 62 62 ARG H H 62 6.490 7.111 -0.621 1
1 651 . 10 1 1 A 62 62 ARG HA H 62 4.698 4.662 0.036 1
1 658 . 10 1 1 A 62 62 ARG C C 62 172.881 173.542 -0.661 1
1 659 . 10 1 1 A 62 62 ARG CA C 62 52.276 55.227 -2.951 1
1 660 . 10 1 1 A 62 62 ARG CB C 62 30.774 33.194 -2.420 1
1 663 . 10 1 1 A 62 62 ARG N N 62 117.485 122.361 -4.876 1
1 664 . 10 1 1 A 63 63 TYR H H 63 8.891 8.799 0.092 1
1 665 . 10 1 1 A 63 63 TYR HA H 63 4.356 5.378 -1.022 1
1 672 . 10 1 1 A 63 63 TYR C C 63 170.393 173.948 -3.555 1
1 673 . 10 1 1 A 63 63 TYR CA C 63 57.284 56.859 0.425 1
1 674 . 10 1 1 A 63 63 TYR CB C 63 41.467 42.683 -1.216 1
1 679 . 10 1 1 A 63 63 TYR N N 63 124.712 127.295 -2.583 1
1 680 . 10 1 1 A 64 64 SER H H 64 7.244 8.429 -1.185 1
1 681 . 10 1 1 A 64 64 SER HA H 64 5.077 5.717 -0.640 1
1 684 . 10 1 1 A 64 64 SER C C 64 169.712 173.484 -3.772 1
1 685 . 10 1 1 A 64 64 SER CA C 64 54.181 55.508 -1.327 1
1 686 . 10 1 1 A 64 64 SER CB C 64 61.122 65.780 -4.658 1
1 687 . 10 1 1 A 64 64 SER N N 64 120.593 120.374 0.219 1
1 688 . 10 1 1 A 65 65 ILE H H 65 8.686 8.959 -0.273 1
1 689 . 10 1 1 A 65 65 ILE HA H 65 3.937 4.926 -0.989 1
1 699 . 10 1 1 A 65 65 ILE C C 65 172.217 175.119 -2.902 1
1 700 . 10 1 1 A 65 65 ILE CA C 65 58.288 59.653 -1.365 1
1 701 . 10 1 1 A 65 65 ILE CB C 65 36.110 40.342 -4.232 1
1 705 . 10 1 1 A 65 65 ILE N N 65 127.792 124.415 3.377 1
1 706 . 10 1 1 A 66 66 GLY H H 66 7.883 8.571 -0.688 1
1 707 . 10 1 1 A 66 66 GLY HA2 H 66 4.799 4.162 0.637 1
1 708 . 10 1 1 A 66 66 GLY HA3 H 66 3.468 4.185 -0.717 1
1 709 . 10 1 1 A 66 66 GLY C C 66 171.983 173.939 -1.956 1
1 710 . 10 1 1 A 66 66 GLY CA C 66 40.534 44.487 -3.953 1
1 711 . 10 1 1 A 66 66 GLY N N 66 112.632 114.676 -2.044 1
1 712 . 10 1 1 A 67 67 GLY H H 67 8.483 8.360 0.123 1
1 713 . 10 1 1 A 67 67 GLY HA2 H 67 3.836 3.916 -0.080 1
1 714 . 10 1 1 A 67 67 GLY HA3 H 67 3.682 3.931 -0.249 1
1 715 . 10 1 1 A 67 67 GLY C C 67 172.954 174.365 -1.411 1
1 716 . 10 1 1 A 67 67 GLY CA C 67 43.568 46.326 -2.758 1
1 717 . 10 1 1 A 67 67 GLY N N 67 104.625 108.804 -4.179 1
1 718 . 10 1 1 A 68 68 LEU H H 68 8.236 7.783 0.453 1
1 719 . 10 1 1 A 68 68 LEU HA H 68 4.154 4.679 -0.525 1
1 729 . 10 1 1 A 68 68 LEU C C 68 173.838 175.353 -1.515 1
1 730 . 10 1 1 A 68 68 LEU CA C 68 51.025 53.257 -2.232 1
1 731 . 10 1 1 A 68 68 LEU CB C 68 38.837 43.224 -4.387 1
1 735 . 10 1 1 A 68 68 LEU N N 68 118.919 121.232 -2.313 1
1 736 . 10 1 1 A 69 69 SER H H 69 8.284 8.809 -0.525 1
1 737 . 10 1 1 A 69 69 SER HA H 69 4.765 5.009 -0.244 1
1 740 . 10 1 1 A 69 69 SER C C 69 170.044 172.956 -2.912 1
1 741 . 10 1 1 A 69 69 SER CA C 69 54.639 55.004 -0.365 1
1 742 . 10 1 1 A 69 69 SER CB C 69 61.216 63.984 -2.768 1
1 743 . 10 1 1 A 69 69 SER N N 69 116.361 116.660 -0.299 1
1 744 . 10 1 1 A 70 70 PRO HA H 70 5.141 4.653 0.488 1
1 751 . 10 1 1 A 70 70 PRO C C 70 174.858 177.429 -2.571 1
1 752 . 10 1 1 A 70 70 PRO CA C 70 60.810 63.841 -3.031 1
1 753 . 10 1 1 A 70 70 PRO CB C 70 30.657 32.133 -1.476 1
1 756 . 10 1 1 A 71 71 PHE H H 71 8.139 9.224 -1.085 1
1 757 . 10 1 1 A 71 71 PHE HA H 71 4.202 4.247 -0.045 1
1 765 . 10 1 1 A 71 71 PHE C C 71 172.870 174.486 -1.616 1
1 766 . 10 1 1 A 71 71 PHE CA C 71 55.410 59.047 -3.637 1
1 767 . 10 1 1 A 71 71 PHE CB C 71 36.027 37.696 -1.669 1
1 773 . 10 1 1 A 71 71 PHE N N 71 125.409 123.037 2.372 1
1 774 . 10 1 1 A 72 72 SER H H 72 8.182 7.628 0.554 1
1 775 . 10 1 1 A 72 72 SER HA H 72 4.755 5.022 -0.267 1
1 778 . 10 1 1 A 72 72 SER C C 72 168.850 172.711 -3.861 1
1 779 . 10 1 1 A 72 72 SER CA C 72 55.926 56.233 -0.307 1
1 780 . 10 1 1 A 72 72 SER CB C 72 64.208 66.783 -2.575 1
1 781 . 10 1 1 A 72 72 SER N N 72 113.509 110.436 3.073 1
1 782 . 10 1 1 A 73 73 GLU H H 73 8.422 8.805 -0.383 1
1 783 . 10 1 1 A 73 73 GLU HA H 73 4.966 5.179 -0.213 1
1 788 . 10 1 1 A 73 73 GLU C C 73 173.192 174.900 -1.708 1
1 789 . 10 1 1 A 73 73 GLU CA C 73 52.815 54.844 -2.029 1
1 790 . 10 1 1 A 73 73 GLU CB C 73 29.416 32.863 -3.447 1
1 792 . 10 1 1 A 73 73 GLU N N 73 123.046 121.615 1.431 1
1 793 . 10 1 1 A 74 74 TYR H H 74 9.205 8.983 0.222 1
1 794 . 10 1 1 A 74 74 TYR HA H 74 4.799 5.153 -0.354 1
1 801 . 10 1 1 A 74 74 TYR C C 74 170.775 173.888 -3.113 1
1 802 . 10 1 1 A 74 74 TYR CA C 74 55.291 56.789 -1.498 1
1 803 . 10 1 1 A 74 74 TYR CB C 74 42.943 43.362 -0.419 1
1 808 . 10 1 1 A 74 74 TYR N N 74 125.351 124.775 0.576 1
1 809 . 10 1 1 A 75 75 ALA H H 75 8.639 8.506 0.133 1
1 810 . 10 1 1 A 75 75 ALA HA H 75 5.271 5.562 -0.291 1
1 814 . 10 1 1 A 75 75 ALA C C 75 173.698 175.609 -1.911 1
1 815 . 10 1 1 A 75 75 ALA CA C 75 47.904 50.450 -2.546 1
1 816 . 10 1 1 A 75 75 ALA CB C 75 19.634 20.980 -1.346 1
1 817 . 10 1 1 A 75 75 ALA N N 75 121.555 122.868 -1.313 1
1 818 . 10 1 1 A 76 76 PHE H H 76 9.066 9.477 -0.411 1
1 819 . 10 1 1 A 76 76 PHE HA H 76 5.496 5.417 0.079 1
1 827 . 10 1 1 A 76 76 PHE C C 76 172.268 175.288 -3.020 1
1 828 . 10 1 1 A 76 76 PHE CA C 76 54.216 56.930 -2.714 1
1 829 . 10 1 1 A 76 76 PHE CB C 76 41.901 41.608 0.293 1
1 835 . 10 1 1 A 76 76 PHE N N 76 116.545 123.185 -6.640 1
1 836 . 10 1 1 A 77 77 ARG H H 77 9.216 8.971 0.245 1
1 837 . 10 1 1 A 77 77 ARG HA H 77 4.357 5.217 -0.860 1
1 845 . 10 1 1 A 77 77 ARG C C 77 169.998 173.992 -3.994 1
1 846 . 10 1 1 A 77 77 ARG CA C 77 52.414 54.703 -2.289 1
1 847 . 10 1 1 A 77 77 ARG CB C 77 30.794 34.056 -3.262 1
1 850 . 10 1 1 A 77 77 ARG N N 77 115.738 119.111 -3.373 1
1 852 . 10 1 1 A 78 78 VAL H H 78 8.135 8.704 -0.569 1
1 853 . 10 1 1 A 78 78 VAL HA H 78 4.884 4.836 0.048 1
1 861 . 10 1 1 A 78 78 VAL C C 78 171.098 174.911 -3.813 1
1 862 . 10 1 1 A 78 78 VAL CA C 78 57.566 60.883 -3.317 1
1 863 . 10 1 1 A 78 78 VAL CB C 78 33.146 33.593 -0.447 1
1 866 . 10 1 1 A 78 78 VAL N N 78 117.942 123.180 -5.238 1
1 867 . 10 1 1 A 79 79 LEU H H 79 9.167 8.383 0.784 1
1 868 . 10 1 1 A 79 79 LEU HA H 79 4.575 4.965 -0.390 1
1 878 . 10 1 1 A 79 79 LEU C C 79 171.447 174.848 -3.401 1
1 879 . 10 1 1 A 79 79 LEU CA C 79 51.642 53.465 -1.823 1
1 880 . 10 1 1 A 79 79 LEU CB C 79 42.776 45.754 -2.978 1
1 884 . 10 1 1 A 79 79 LEU N N 79 123.913 121.965 1.948 1
1 885 . 10 1 1 A 80 80 ALA H H 80 9.325 8.595 0.730 1
1 886 . 10 1 1 A 80 80 ALA HA H 80 4.654 3.858 0.796 1
1 890 . 10 1 1 A 80 80 ALA C C 80 172.070 176.777 -4.707 1
1 891 . 10 1 1 A 80 80 ALA CA C 80 48.169 51.432 -3.263 1
1 892 . 10 1 1 A 80 80 ALA CB C 80 20.366 19.172 1.194 1
1 893 . 10 1 1 A 80 80 ALA N N 80 124.135 122.782 1.353 1
1 894 . 10 1 1 A 81 81 VAL H H 81 7.953 8.047 -0.094 1
1 895 . 10 1 1 A 81 81 VAL HA H 81 4.293 4.625 -0.332 1
1 903 . 10 1 1 A 81 81 VAL C C 81 172.873 174.137 -1.264 1
1 904 . 10 1 1 A 81 81 VAL CA C 81 58.959 60.028 -1.069 1
1 905 . 10 1 1 A 81 81 VAL CB C 81 31.412 34.692 -3.280 1
1 908 . 10 1 1 A 81 81 VAL N N 81 118.503 120.431 -1.928 1
1 909 . 10 1 1 A 82 82 ASN H H 82 8.262 8.609 -0.347 1
1 910 . 10 1 1 A 82 82 ASN HA H 82 4.945 5.339 -0.394 1
1 915 . 10 1 1 A 82 82 ASN C C 82 173.273 175.099 -1.826 1
1 916 . 10 1 1 A 82 82 ASN CA C 82 48.714 51.895 -3.181 1
1 917 . 10 1 1 A 82 82 ASN CB C 82 36.796 40.139 -3.343 1
1 918 . 10 1 1 A 82 82 ASN N N 82 125.425 122.861 2.564 1
1 920 . 10 1 1 A 83 83 SER HA H 83 3.966 4.143 -0.177 1
1 923 . 10 1 1 A 83 83 SER C C 83 172.812 176.837 -4.025 1
1 924 . 10 1 1 A 83 83 SER CA C 83 59.047 62.009 -2.962 1
1 925 . 10 1 1 A 83 83 SER CB C 83 60.406 62.959 -2.553 1
1 926 . 10 1 1 A 84 84 ILE H H 84 7.803 8.011 -0.208 1
1 927 . 10 1 1 A 84 84 ILE HA H 84 3.862 3.831 0.031 1
1 937 . 10 1 1 A 84 84 ILE C C 84 174.481 176.002 -1.521 1
1 938 . 10 1 1 A 84 84 ILE CA C 84 59.188 63.309 -4.121 1
1 939 . 10 1 1 A 84 84 ILE CB C 84 34.677 38.547 -3.870 1
1 943 . 10 1 1 A 84 84 ILE N N 84 121.222 118.345 2.877 1
1 944 . 10 1 1 A 85 85 GLY H H 85 7.435 7.470 -0.035 1
1 945 . 10 1 1 A 85 85 GLY HA2 H 85 4.149 4.019 0.130 1
1 946 . 10 1 1 A 85 85 GLY HA3 H 85 3.747 4.025 -0.278 1
1 947 . 10 1 1 A 85 85 GLY C C 85 168.589 172.768 -4.179 1
1 948 . 10 1 1 A 85 85 GLY CA C 85 42.931 45.011 -2.080 1
1 949 . 10 1 1 A 85 85 GLY N N 85 106.320 106.495 -0.175 1
1 950 . 10 1 1 A 86 86 ARG H H 86 8.190 8.394 -0.204 1
1 951 . 10 1 1 A 86 86 ARG HA H 86 4.452 4.344 0.108 1
1 958 . 10 1 1 A 86 86 ARG C C 86 175.286 176.268 -0.982 1
1 959 . 10 1 1 A 86 86 ARG CA C 86 53.223 55.558 -2.335 1
1 960 . 10 1 1 A 86 86 ARG CB C 86 29.517 30.395 -0.878 1
1 963 . 10 1 1 A 86 86 ARG N N 86 118.339 117.308 1.031 1
1 964 . 10 1 1 A 87 87 GLY H H 87 8.900 8.990 -0.090 1
1 965 . 10 1 1 A 87 87 GLY HA2 H 87 4.211 3.984 0.227 1
1 966 . 10 1 1 A 87 87 GLY HA3 H 87 3.967 3.999 -0.032 1
1 967 . 10 1 1 A 87 87 GLY C C 87 168.101 172.756 -4.655 1
1 968 . 10 1 1 A 87 87 GLY CA C 87 42.281 44.100 -1.819 1
1 969 . 10 1 1 A 87 87 GLY N N 87 113.482 109.148 4.334 1
1 970 . 10 1 1 A 88 88 PRO HA H 88 4.563 4.578 -0.015 1
1 977 . 10 1 1 A 88 88 PRO CA C 88 60.994 62.127 -1.133 1
1 978 . 10 1 1 A 88 88 PRO CB C 88 29.873 31.660 -1.787 1
1 981 . 10 1 1 A 89 89 PRO HA H 89 4.490 4.488 0.002 1
1 987 . 10 1 1 A 89 89 PRO C C 89 174.543 175.915 -1.372 1
1 988 . 10 1 1 A 89 89 PRO CA C 89 59.435 62.323 -2.888 1
1 989 . 10 1 1 A 89 89 PRO CB C 89 29.805 32.183 -2.378 1
1 992 . 10 1 1 A 90 90 SER H H 90 8.808 8.362 0.446 1
1 993 . 10 1 1 A 90 90 SER HA H 90 4.202 4.691 -0.489 1
1 996 . 10 1 1 A 90 90 SER C C 90 171.870 173.798 -1.928 1
1 997 . 10 1 1 A 90 90 SER CA C 90 55.868 56.943 -1.075 1
1 998 . 10 1 1 A 90 90 SER CB C 90 64.504 64.834 -0.330 1
1 999 . 10 1 1 A 90 90 SER N N 90 113.781 116.219 -2.438 1
1 1000 . 10 1 1 A 91 91 GLU H H 91 8.291 8.571 -0.280 1
1 1001 . 10 1 1 A 91 91 GLU HA H 91 4.131 4.171 -0.040 1
1 1006 . 10 1 1 A 91 91 GLU C C 91 174.882 176.368 -1.486 1
1 1007 . 10 1 1 A 91 91 GLU CA C 91 54.984 56.916 -1.932 1
1 1008 . 10 1 1 A 91 91 GLU CB C 91 27.643 29.812 -2.169 1
1 1010 . 10 1 1 A 91 91 GLU N N 91 117.930 123.387 -5.457 1
1 1011 . 10 1 1 A 92 92 ALA H H 92 8.605 8.333 0.272 1
1 1012 . 10 1 1 A 92 92 ALA HA H 92 5.068 4.404 0.664 1
1 1016 . 10 1 1 A 92 92 ALA C C 92 176.227 177.919 -1.692 1
1 1017 . 10 1 1 A 92 92 ALA CA C 92 48.997 52.961 -3.964 1
1 1018 . 10 1 1 A 92 92 ALA CB C 92 17.756 19.122 -1.366 1
1 1019 . 10 1 1 A 92 92 ALA N N 92 126.421 126.902 -0.481 1
1 1020 . 10 1 1 A 93 93 VAL H H 93 9.051 9.029 0.022 1
1 1021 . 10 1 1 A 93 93 VAL HA H 93 4.642 4.935 -0.293 1
1 1029 . 10 1 1 A 93 93 VAL C C 93 172.010 174.477 -2.467 1
1 1030 . 10 1 1 A 93 93 VAL CA C 93 57.495 59.502 -2.007 1
1 1031 . 10 1 1 A 93 93 VAL CB C 93 32.774 33.881 -1.107 1
1 1034 . 10 1 1 A 93 93 VAL N N 93 117.322 118.583 -1.261 1
1 1035 . 10 1 1 A 94 94 ARG H H 94 8.470 8.887 -0.417 1
1 1036 . 10 1 1 A 94 94 ARG HA H 94 5.692 5.425 0.267 1
1 1043 . 10 1 1 A 94 94 ARG C C 94 173.635 175.524 -1.889 1
1 1044 . 10 1 1 A 94 94 ARG CA C 94 52.038 54.685 -2.647 1
1 1045 . 10 1 1 A 94 94 ARG CB C 94 30.966 31.806 -0.840 1
1 1048 . 10 1 1 A 94 94 ARG N N 94 122.258 123.544 -1.286 1
1 1049 . 10 1 1 A 95 95 ALA H H 95 9.051 9.252 -0.201 1
1 1050 . 10 1 1 A 95 95 ALA HA H 95 4.642 5.326 -0.684 1
1 1054 . 10 1 1 A 95 95 ALA C C 95 172.285 175.035 -2.750 1
1 1055 . 10 1 1 A 95 95 ALA CA C 95 49.191 50.473 -1.282 1
1 1056 . 10 1 1 A 95 95 ALA CB C 95 22.562 22.010 0.552 1
1 1057 . 10 1 1 A 95 95 ALA N N 95 121.931 127.448 -5.517 1
1 1058 . 10 1 1 A 96 96 ARG H H 96 8.550 8.810 -0.260 1
1 1059 . 10 1 1 A 96 96 ARG HA H 96 5.407 5.187 0.220 1
1 1066 . 10 1 1 A 96 96 ARG C C 96 174.547 176.022 -1.475 1
1 1067 . 10 1 1 A 96 96 ARG CA C 96 51.439 55.029 -3.590 1
1 1068 . 10 1 1 A 96 96 ARG CB C 96 30.708 31.627 -0.919 1
1 1071 . 10 1 1 A 96 96 ARG N N 96 121.155 124.007 -2.852 1
1 1072 . 10 1 1 A 97 97 THR H H 97 8.797 8.968 -0.171 1
1 1073 . 10 1 1 A 97 97 THR HA H 97 4.116 4.455 -0.339 1
1 1078 . 10 1 1 A 97 97 THR C C 97 173.577 175.013 -1.436 1
1 1079 . 10 1 1 A 97 97 THR CA C 97 58.800 61.701 -2.901 1
1 1080 . 10 1 1 A 97 97 THR CB C 97 67.461 69.701 -2.240 1
1 1082 . 10 1 1 A 97 97 THR N N 97 114.657 117.626 -2.969 1
1 1083 . 10 1 1 A 98 98 GLY H H 98 7.505 8.504 -0.999 1
1 1084 . 10 1 1 A 98 98 GLY HA2 H 98 3.866 4.068 -0.202 1
1 1085 . 10 1 1 A 98 98 GLY HA3 H 98 3.743 4.116 -0.373 1
1 1086 . 10 1 1 A 98 98 GLY C C 98 170.637 173.155 -2.518 1
1 1087 . 10 1 1 A 98 98 GLY CA C 98 42.332 44.779 -2.447 1
1 1088 . 10 1 1 A 98 98 GLY N N 98 106.172 108.093 -1.921 1
1 1089 . 10 1 1 A 99 99 GLU H H 99 8.145 8.450 -0.305 1
1 1090 . 10 1 1 A 99 99 GLU HA H 99 4.210 5.131 -0.921 1
1 1095 . 10 1 1 A 99 99 GLU C C 99 174.134 175.068 -0.934 1
1 1096 . 10 1 1 A 99 99 GLU CA C 99 53.828 55.356 -1.528 1
1 1097 . 10 1 1 A 99 99 GLU CB C 99 28.774 31.731 -2.957 1
1 1099 . 10 1 1 A 99 99 GLU N N 99 117.634 118.301 -0.667 1
1 1100 . 10 1 1 A 100 100 GLN H H 100 8.647 8.529 0.118 1
1 1101 . 10 1 1 A 100 100 GLN HA H 100 4.247 4.623 -0.376 1
1 1108 . 10 1 1 A 100 100 GLN C C 100 173.348 174.072 -0.724 1
1 1109 . 10 1 1 A 100 100 GLN CA C 100 53.634 55.436 -1.802 1
1 1110 . 10 1 1 A 100 100 GLN CB C 100 27.392 32.942 -5.550 1
1 1112 . 10 1 1 A 100 100 GLN N N 100 121.960 120.023 1.937 1
1 1114 . 10 1 1 A 101 101 SER H H 101 8.416 8.689 -0.273 1
1 1115 . 10 1 1 A 101 101 SER HA H 101 4.418 4.239 0.179 1
1 1117 . 10 1 1 A 101 101 SER C C 101 172.148 174.622 -2.474 1
1 1118 . 10 1 1 A 101 101 SER CA C 101 55.926 60.484 -4.558 1
1 1119 . 10 1 1 A 101 101 SER CB C 101 61.617 63.187 -1.570 1
1 1120 . 10 1 1 A 101 101 SER N N 101 118.609 120.029 -1.420 1
1 1121 . 10 1 1 A 102 102 GLY H H 102 8.233 8.155 0.078 1
1 1122 . 10 1 1 A 102 102 GLY HA2 H 102 4.080 4.106 -0.026 1
1 1123 . 10 1 1 A 102 102 GLY HA3 H 102 3.981 4.110 -0.129 1
1 1124 . 10 1 1 A 102 102 GLY C C 102 169.461 173.648 -4.187 1
1 1125 . 10 1 1 A 102 102 GLY CA C 102 42.332 46.093 -3.761 1
1 1126 . 10 1 1 A 102 102 GLY N N 102 110.483 112.851 -2.368 1
1 1127 . 10 1 1 A 103 103 PRO HA H 103 4.618 4.411 0.207 1
1 1134 . 10 1 1 A 103 103 PRO CA C 103 57.843 64.499 -6.656 1
1 1135 . 10 1 1 A 103 103 PRO CB C 103 28.671 31.820 -3.149 1
1 1 . 11 1 1 A 6 6 SER HA H 6 4.492 4.787 -0.295 1
1 4 . 11 1 1 A 6 6 SER CA C 6 55.621 56.720 -1.099 1
1 5 . 11 1 1 A 6 6 SER CB C 6 62.104 62.953 -0.849 1
1 6 . 11 1 1 A 7 7 GLY H H 7 8.244 8.237 0.007 1
1 7 . 11 1 1 A 7 7 GLY HA2 H 7 3.873 4.043 -0.170 1
1 8 . 11 1 1 A 7 7 GLY HA3 H 7 3.737 4.051 -0.314 1
1 9 . 11 1 1 A 7 7 GLY CA C 7 41.743 44.028 -2.285 1
1 10 . 11 1 1 A 7 7 GLY N N 7 109.193 110.864 -1.671 1
1 11 . 11 1 1 A 8 8 PRO HA H 8 4.286 4.539 -0.253 1
1 18 . 11 1 1 A 8 8 PRO C C 8 173.841 175.472 -1.631 1
1 19 . 11 1 1 A 8 8 PRO CA C 8 60.528 62.297 -1.769 1
1 20 . 11 1 1 A 8 8 PRO CB C 8 30.299 33.015 -2.716 1
1 23 . 11 1 1 A 9 9 LYS H H 9 8.877 8.534 0.343 1
1 24 . 11 1 1 A 9 9 LYS HA H 9 4.360 4.818 -0.458 1
1 33 . 11 1 1 A 9 9 LYS C C 9 173.492 174.134 -0.642 1
1 34 . 11 1 1 A 9 9 LYS CA C 9 52.135 52.846 -0.711 1
1 35 . 11 1 1 A 9 9 LYS CB C 9 28.798 33.804 -5.006 1
1 39 . 11 1 1 A 9 9 LYS N N 9 120.404 120.258 0.146 1
1 40 . 11 1 1 A 10 10 PRO HA H 10 4.284 4.620 -0.336 1
1 47 . 11 1 1 A 10 10 PRO CA C 10 59.326 61.651 -2.325 1
1 48 . 11 1 1 A 10 10 PRO CB C 10 28.825 31.541 -2.716 1
1 51 . 11 1 1 A 11 11 PRO HA H 11 4.468 4.758 -0.290 1
1 58 . 11 1 1 A 11 11 PRO C C 11 171.993 176.512 -4.519 1
1 59 . 11 1 1 A 11 11 PRO CA C 11 60.422 62.678 -2.256 1
1 60 . 11 1 1 A 11 11 PRO CB C 11 30.418 32.663 -2.245 1
1 63 . 11 1 1 A 12 12 ILE H H 12 7.554 8.007 -0.453 1
1 64 . 11 1 1 A 12 12 ILE HA H 12 4.676 4.676 0.000 1
1 74 . 11 1 1 A 12 12 ILE C C 12 171.721 175.104 -3.383 1
1 75 . 11 1 1 A 12 12 ILE CA C 12 56.843 58.768 -1.925 1
1 76 . 11 1 1 A 12 12 ILE CB C 12 40.560 41.002 -0.442 1
1 80 . 11 1 1 A 12 12 ILE N N 12 109.695 116.693 -6.998 1
1 81 . 11 1 1 A 13 13 ASP H H 13 8.435 9.062 -0.627 1
1 82 . 11 1 1 A 13 13 ASP HA H 13 4.094 4.256 -0.162 1
1 85 . 11 1 1 A 13 13 ASP C C 13 171.803 176.119 -4.316 1
1 86 . 11 1 1 A 13 13 ASP CA C 13 52.610 55.089 -2.479 1
1 87 . 11 1 1 A 13 13 ASP CB C 13 36.357 40.267 -3.910 1
1 88 . 11 1 1 A 13 13 ASP N N 13 116.219 122.128 -5.909 1
1 89 . 11 1 1 A 14 14 LEU H H 14 7.483 8.011 -0.528 1
1 90 . 11 1 1 A 14 14 LEU HA H 14 4.990 4.895 0.095 1
1 100 . 11 1 1 A 14 14 LEU C C 14 174.702 175.375 -0.673 1
1 101 . 11 1 1 A 14 14 LEU CA C 14 53.811 55.098 -1.287 1
1 102 . 11 1 1 A 14 14 LEU CB C 14 40.148 42.347 -2.199 1
1 106 . 11 1 1 A 14 14 LEU N N 14 118.463 121.169 -2.706 1
1 107 . 11 1 1 A 15 15 VAL H H 15 9.209 8.713 0.496 1
1 108 . 11 1 1 A 15 15 VAL HA H 15 4.250 4.778 -0.528 1
1 116 . 11 1 1 A 15 15 VAL C C 15 172.080 174.185 -2.105 1
1 117 . 11 1 1 A 15 15 VAL CA C 15 58.570 60.410 -1.840 1
1 118 . 11 1 1 A 15 15 VAL CB C 15 34.146 36.079 -1.933 1
1 121 . 11 1 1 A 15 15 VAL N N 15 124.833 127.354 -2.521 1
1 122 . 11 1 1 A 16 16 VAL H H 16 8.390 8.891 -0.501 1
1 123 . 11 1 1 A 16 16 VAL HA H 16 4.343 4.619 -0.276 1
1 131 . 11 1 1 A 16 16 VAL C C 16 174.672 175.708 -1.036 1
1 132 . 11 1 1 A 16 16 VAL CA C 16 59.188 61.187 -1.999 1
1 133 . 11 1 1 A 16 16 VAL CB C 16 29.187 33.322 -4.135 1
1 136 . 11 1 1 A 16 16 VAL N N 16 124.654 125.015 -0.361 1
1 137 . 11 1 1 A 17 17 THR H H 17 8.638 8.416 0.222 1
1 138 . 11 1 1 A 17 17 THR HA H 17 4.195 4.423 -0.228 1
1 143 . 11 1 1 A 17 17 THR C C 17 172.661 173.443 -0.782 1
1 144 . 11 1 1 A 17 17 THR CA C 17 60.318 63.385 -3.067 1
1 145 . 11 1 1 A 17 17 THR CB C 17 66.420 70.764 -4.344 1
1 147 . 11 1 1 A 17 17 THR N N 17 120.942 122.599 -1.657 1
1 148 . 11 1 1 A 18 18 GLU H H 18 7.361 7.647 -0.286 1
1 149 . 11 1 1 A 18 18 GLU HA H 18 4.497 4.716 -0.219 1
1 154 . 11 1 1 A 18 18 GLU C C 18 171.691 174.799 -3.108 1
1 155 . 11 1 1 A 18 18 GLU CA C 18 53.687 55.031 -1.344 1
1 156 . 11 1 1 A 18 18 GLU CB C 18 30.802 34.096 -3.294 1
1 158 . 11 1 1 A 18 18 GLU N N 18 119.088 118.039 1.049 1
1 159 . 11 1 1 A 19 19 THR H H 19 8.164 8.594 -0.430 1
1 160 . 11 1 1 A 19 19 THR HA H 19 4.912 5.058 -0.146 1
1 165 . 11 1 1 A 19 19 THR C C 19 171.606 172.840 -1.234 1
1 166 . 11 1 1 A 19 19 THR CA C 19 58.473 60.691 -2.218 1
1 167 . 11 1 1 A 19 19 THR CB C 19 70.103 71.063 -0.960 1
1 169 . 11 1 1 A 19 19 THR N N 19 112.424 113.826 -1.402 1
1 170 . 11 1 1 A 20 20 THR H H 20 8.750 9.121 -0.371 1
1 171 . 11 1 1 A 20 20 THR HA H 20 4.710 4.799 -0.089 1
1 176 . 11 1 1 A 20 20 THR C C 20 172.785 176.244 -3.459 1
1 177 . 11 1 1 A 20 20 THR CA C 20 58.059 61.045 -2.986 1
1 178 . 11 1 1 A 20 20 THR CB C 20 68.782 70.991 -2.209 1
1 180 . 11 1 1 A 20 20 THR N N 20 113.438 121.439 -8.001 1
1 181 . 11 1 1 A 21 21 ALA H H 21 8.453 9.003 -0.550 1
1 182 . 11 1 1 A 21 21 ALA HA H 21 4.079 4.153 -0.074 1
1 186 . 11 1 1 A 21 21 ALA C C 21 174.130 177.944 -3.814 1
1 187 . 11 1 1 A 21 21 ALA CA C 21 52.680 55.249 -2.569 1
1 188 . 11 1 1 A 21 21 ALA CB C 21 16.893 18.547 -1.654 1
1 189 . 11 1 1 A 21 21 ALA N N 21 120.078 125.914 -5.836 1
1 190 . 11 1 1 A 22 22 THR H H 22 7.132 7.554 -0.422 1
1 191 . 11 1 1 A 22 22 THR HA H 22 4.433 4.725 -0.292 1
1 196 . 11 1 1 A 22 22 THR C C 22 171.434 173.451 -2.017 1
1 197 . 11 1 1 A 22 22 THR CA C 22 56.836 60.491 -3.655 1
1 198 . 11 1 1 A 22 22 THR CB C 22 68.772 69.371 -0.599 1
1 200 . 11 1 1 A 22 22 THR N N 22 95.772 104.118 -8.346 1
1 201 . 11 1 1 A 23 23 SER H H 23 7.326 7.566 -0.240 1
1 202 . 11 1 1 A 23 23 SER HA H 23 5.562 5.305 0.257 1
1 205 . 11 1 1 A 23 23 SER C C 23 169.267 172.409 -3.142 1
1 206 . 11 1 1 A 23 23 SER CA C 23 54.445 57.723 -3.278 1
1 207 . 11 1 1 A 23 23 SER CB C 23 65.905 67.270 -1.365 1
1 208 . 11 1 1 A 23 23 SER N N 23 115.757 115.936 -0.179 1
1 209 . 11 1 1 A 24 24 VAL H H 24 7.983 8.568 -0.585 1
1 210 . 11 1 1 A 24 24 VAL HA H 24 4.334 4.612 -0.278 1
1 218 . 11 1 1 A 24 24 VAL C C 24 171.917 174.520 -2.603 1
1 219 . 11 1 1 A 24 24 VAL CA C 24 58.642 60.456 -1.814 1
1 220 . 11 1 1 A 24 24 VAL CB C 24 34.254 36.042 -1.788 1
1 223 . 11 1 1 A 24 24 VAL N N 24 116.595 121.369 -4.774 1
1 224 . 11 1 1 A 25 25 THR H H 25 8.636 8.949 -0.313 1
1 225 . 11 1 1 A 25 25 THR HA H 25 4.833 4.848 -0.015 1
1 230 . 11 1 1 A 25 25 THR C C 25 169.721 172.920 -3.199 1
1 231 . 11 1 1 A 25 25 THR CA C 25 59.699 61.879 -2.180 1
1 232 . 11 1 1 A 25 25 THR CB C 25 67.303 69.992 -2.689 1
1 234 . 11 1 1 A 25 25 THR N N 25 121.690 121.356 0.334 1
1 235 . 11 1 1 A 26 26 LEU H H 26 8.629 9.073 -0.444 1
1 236 . 11 1 1 A 26 26 LEU HA H 26 5.315 5.189 0.126 1
1 246 . 11 1 1 A 26 26 LEU C C 26 173.182 175.416 -2.234 1
1 247 . 11 1 1 A 26 26 LEU CA C 26 50.643 53.245 -2.602 1
1 248 . 11 1 1 A 26 26 LEU CB C 26 43.976 45.222 -1.246 1
1 252 . 11 1 1 A 26 26 LEU N N 26 126.843 130.472 -3.629 1
1 253 . 11 1 1 A 27 27 THR H H 27 8.704 9.040 -0.336 1
1 254 . 11 1 1 A 27 27 THR HA H 27 4.822 5.193 -0.371 1
1 259 . 11 1 1 A 27 27 THR C C 27 169.840 173.493 -3.653 1
1 260 . 11 1 1 A 27 27 THR CA C 27 58.077 59.676 -1.599 1
1 261 . 11 1 1 A 27 27 THR CB C 27 69.666 71.630 -1.964 1
1 263 . 11 1 1 A 27 27 THR N N 27 111.513 115.859 -4.346 1
1 264 . 11 1 1 A 28 28 TRP H H 28 7.339 8.171 -0.832 1
1 265 . 11 1 1 A 28 28 TRP HA H 28 4.963 5.531 -0.568 1
1 274 . 11 1 1 A 28 28 TRP C C 28 170.637 172.414 -1.777 1
1 275 . 11 1 1 A 28 28 TRP CA C 28 54.438 55.500 -1.062 1
1 276 . 11 1 1 A 28 28 TRP CB C 28 27.497 31.401 -3.904 1
1 282 . 11 1 1 A 28 28 TRP N N 28 117.895 119.229 -1.334 1
1 284 . 11 1 1 A 29 29 ASP H H 29 8.696 9.228 -0.532 1
1 285 . 11 1 1 A 29 29 ASP HA H 29 4.971 5.146 -0.175 1
1 288 . 11 1 1 A 29 29 ASP C C 29 174.901 177.543 -2.642 1
1 289 . 11 1 1 A 29 29 ASP CA C 29 50.178 52.313 -2.135 1
1 290 . 11 1 1 A 29 29 ASP CB C 29 42.291 43.398 -1.107 1
1 291 . 11 1 1 A 29 29 ASP N N 29 117.477 121.659 -4.182 1
1 292 . 11 1 1 A 30 30 SER H H 30 8.800 8.844 -0.044 1
1 293 . 11 1 1 A 30 30 SER HA H 30 4.389 4.216 0.173 1
1 296 . 11 1 1 A 30 30 SER C C 30 174.032 175.776 -1.744 1
1 297 . 11 1 1 A 30 30 SER CA C 30 58.694 60.773 -2.079 1
1 298 . 11 1 1 A 30 30 SER CB C 30 62.428 63.383 -0.955 1
1 299 . 11 1 1 A 30 30 SER N N 30 118.275 120.364 -2.089 1
1 300 . 11 1 1 A 31 31 GLY H H 31 8.759 8.349 0.410 1
1 301 . 11 1 1 A 31 31 GLY HA2 H 31 4.239 4.024 0.215 1
1 302 . 11 1 1 A 31 31 GLY HA3 H 31 3.555 4.055 -0.500 1
1 303 . 11 1 1 A 31 31 GLY C C 31 171.325 174.045 -2.720 1
1 304 . 11 1 1 A 31 31 GLY CA C 31 43.637 45.468 -1.831 1
1 305 . 11 1 1 A 31 31 GLY N N 31 107.961 111.091 -3.130 1
1 306 . 11 1 1 A 32 32 ASN H H 32 8.173 7.947 0.226 1
1 307 . 11 1 1 A 32 32 ASN HA H 32 4.749 5.054 -0.305 1
1 312 . 11 1 1 A 32 32 ASN C C 32 171.355 175.186 -3.831 1
1 313 . 11 1 1 A 32 32 ASN CA C 32 50.795 52.836 -2.041 1
1 314 . 11 1 1 A 32 32 ASN CB C 32 41.508 39.677 1.831 1
1 315 . 11 1 1 A 32 32 ASN N N 32 117.781 119.450 -1.669 1
1 317 . 11 1 1 A 33 33 SER HA H 33 4.291 4.374 -0.083 1
1 320 . 11 1 1 A 33 33 SER C C 33 172.449 174.420 -1.971 1
1 321 . 11 1 1 A 33 33 SER CA C 33 56.733 61.137 -4.404 1
1 322 . 11 1 1 A 33 33 SER CB C 33 60.884 63.744 -2.860 1
1 323 . 11 1 1 A 34 34 GLU H H 34 7.731 7.792 -0.061 1
1 324 . 11 1 1 A 34 34 GLU HA H 34 4.556 4.575 -0.019 1
1 329 . 11 1 1 A 34 34 GLU C C 34 171.792 174.509 -2.717 1
1 330 . 11 1 1 A 34 34 GLU CA C 34 51.818 53.747 -1.929 1
1 331 . 11 1 1 A 34 34 GLU CB C 34 26.891 29.654 -2.763 1
1 333 . 11 1 1 A 34 34 GLU N N 34 122.319 120.596 1.723 1
1 334 . 11 1 1 A 35 35 PRO HA H 35 4.165 4.795 -0.630 1
1 341 . 11 1 1 A 35 35 PRO C C 35 174.288 176.984 -2.696 1
1 342 . 11 1 1 A 35 35 PRO CA C 35 61.374 62.693 -1.319 1
1 343 . 11 1 1 A 35 35 PRO CB C 35 29.887 31.375 -1.488 1
1 346 . 11 1 1 A 36 36 VAL H H 36 8.348 8.232 0.116 1
1 347 . 11 1 1 A 36 36 VAL HA H 36 3.899 4.361 -0.462 1
1 355 . 11 1 1 A 36 36 VAL C C 36 173.344 177.086 -3.742 1
1 356 . 11 1 1 A 36 36 VAL CA C 36 59.014 61.351 -2.337 1
1 357 . 11 1 1 A 36 36 VAL CB C 36 31.865 33.308 -1.443 1
1 360 . 11 1 1 A 36 36 VAL N N 36 122.051 118.528 3.523 1
1 361 . 11 1 1 A 37 37 THR H H 37 8.780 8.302 0.478 1
1 362 . 11 1 1 A 37 37 THR HA H 37 3.923 4.192 -0.269 1
1 367 . 11 1 1 A 37 37 THR C C 37 172.171 174.562 -2.391 1
1 368 . 11 1 1 A 37 37 THR CA C 37 63.155 64.543 -1.388 1
1 369 . 11 1 1 A 37 37 THR CB C 37 65.941 69.248 -3.307 1
1 371 . 11 1 1 A 37 37 THR N N 37 122.351 117.037 5.314 1
1 372 . 11 1 1 A 38 38 TYR H H 38 7.304 7.756 -0.452 1
1 373 . 11 1 1 A 38 38 TYR HA H 38 4.439 5.033 -0.594 1
1 380 . 11 1 1 A 38 38 TYR C C 38 168.385 172.624 -4.239 1
1 381 . 11 1 1 A 38 38 TYR CA C 38 54.101 56.529 -2.428 1
1 382 . 11 1 1 A 38 38 TYR CB C 38 35.874 39.948 -4.074 1
1 387 . 11 1 1 A 38 38 TYR N N 38 113.984 115.033 -1.049 1
1 388 . 11 1 1 A 39 39 TYR H H 39 9.445 9.097 0.348 1
1 389 . 11 1 1 A 39 39 TYR HA H 39 5.293 5.414 -0.121 1
1 396 . 11 1 1 A 39 39 TYR C C 39 172.781 175.891 -3.110 1
1 397 . 11 1 1 A 39 39 TYR CA C 39 54.322 55.885 -1.563 1
1 398 . 11 1 1 A 39 39 TYR CB C 39 39.035 41.109 -2.074 1
1 401 . 11 1 1 A 39 39 TYR N N 39 115.092 119.122 -4.030 1
1 402 . 11 1 1 A 40 40 GLY H H 40 8.870 8.887 -0.017 1
1 403 . 11 1 1 A 40 40 GLY HA2 H 40 5.137 4.199 0.938 1
1 404 . 11 1 1 A 40 40 GLY HA3 H 40 3.285 4.257 -0.972 1
1 405 . 11 1 1 A 40 40 GLY C C 40 169.688 172.558 -2.870 1
1 406 . 11 1 1 A 40 40 GLY CA C 40 41.415 44.407 -2.992 1
1 407 . 11 1 1 A 40 40 GLY N N 40 106.573 111.727 -5.154 1
1 408 . 11 1 1 A 41 41 ILE H H 41 8.917 8.455 0.462 1
1 409 . 11 1 1 A 41 41 ILE HA H 41 4.527 4.809 -0.282 1
1 419 . 11 1 1 A 41 41 ILE C C 41 172.692 174.759 -2.067 1
1 420 . 11 1 1 A 41 41 ILE CA C 41 57.597 60.226 -2.629 1
1 421 . 11 1 1 A 41 41 ILE CB C 41 37.840 41.126 -3.286 1
1 425 . 11 1 1 A 41 41 ILE N N 41 121.746 121.436 0.310 1
1 426 . 11 1 1 A 42 42 GLN H H 42 9.063 8.792 0.271 1
1 427 . 11 1 1 A 42 42 GLN HA H 42 5.655 5.478 0.177 1
1 434 . 11 1 1 A 42 42 GLN C C 42 172.841 174.608 -1.767 1
1 435 . 11 1 1 A 42 42 GLN CA C 42 50.789 54.443 -3.654 1
1 436 . 11 1 1 A 42 42 GLN CB C 42 28.898 32.193 -3.295 1
1 438 . 11 1 1 A 42 42 GLN N N 42 125.141 125.653 -0.512 1
1 440 . 11 1 1 A 43 43 TYR H H 43 9.066 8.976 0.090 1
1 441 . 11 1 1 A 43 43 TYR HA H 43 5.922 6.037 -0.115 1
1 448 . 11 1 1 A 43 43 TYR C C 43 171.219 173.099 -1.880 1
1 449 . 11 1 1 A 43 43 TYR CA C 43 53.349 55.997 -2.648 1
1 450 . 11 1 1 A 43 43 TYR CB C 43 41.074 42.360 -1.286 1
1 455 . 11 1 1 A 43 43 TYR N N 43 118.018 119.810 -1.792 1
1 456 . 11 1 1 A 44 44 ARG H H 44 8.400 8.640 -0.240 1
1 457 . 11 1 1 A 44 44 ARG HA H 44 4.542 4.429 0.113 1
1 464 . 11 1 1 A 44 44 ARG C C 44 171.974 174.225 -2.251 1
1 465 . 11 1 1 A 44 44 ARG CA C 44 52.453 54.945 -2.492 1
1 466 . 11 1 1 A 44 44 ARG CB C 44 31.125 32.948 -1.823 1
1 469 . 11 1 1 A 44 44 ARG N N 44 115.214 120.251 -5.037 1
1 470 . 11 1 1 A 45 45 ALA H H 45 8.846 8.227 0.619 1
1 471 . 11 1 1 A 45 45 ALA HA H 45 3.894 2.312 1.582 1
1 475 . 11 1 1 A 45 45 ALA C C 45 175.721 177.073 -1.352 1
1 476 . 11 1 1 A 45 45 ALA CA C 45 50.372 52.062 -1.690 1
1 477 . 11 1 1 A 45 45 ALA CB C 45 15.732 18.682 -2.950 1
1 478 . 11 1 1 A 45 45 ALA N N 45 126.463 127.077 -0.614 1
1 479 . 11 1 1 A 46 46 ALA H H 46 8.282 8.063 0.219 1
1 480 . 11 1 1 A 46 46 ALA HA H 46 3.922 3.868 0.054 1
1 484 . 11 1 1 A 46 46 ALA C C 46 176.236 177.769 -1.533 1
1 485 . 11 1 1 A 46 46 ALA CA C 46 50.773 53.718 -2.945 1
1 486 . 11 1 1 A 46 46 ALA CB C 46 16.244 18.305 -2.061 1
1 487 . 11 1 1 A 46 46 ALA N N 46 126.301 126.107 0.194 1
1 488 . 11 1 1 A 47 47 GLY HA2 H 47 3.882 4.082 -0.200 1
1 489 . 11 1 1 A 47 47 GLY HA3 H 47 3.695 4.115 -0.420 1
1 490 . 11 1 1 A 47 47 GLY C C 47 171.795 173.289 -1.494 1
1 491 . 11 1 1 A 47 47 GLY CA C 47 43.327 45.221 -1.894 1
1 492 . 11 1 1 A 48 48 THR H H 48 7.145 8.114 -0.969 1
1 493 . 11 1 1 A 48 48 THR HA H 48 4.417 4.117 0.300 1
1 498 . 11 1 1 A 48 48 THR C C 48 171.325 174.215 -2.890 1
1 499 . 11 1 1 A 48 48 THR CA C 48 58.271 63.105 -4.834 1
1 500 . 11 1 1 A 48 48 THR CB C 48 68.846 69.333 -0.487 1
1 502 . 11 1 1 A 48 48 THR N N 48 110.190 118.472 -8.282 1
1 503 . 11 1 1 A 49 49 GLU H H 49 8.346 8.637 -0.291 1
1 504 . 11 1 1 A 49 49 GLU HA H 49 4.277 4.443 -0.166 1
1 509 . 11 1 1 A 49 49 GLU C C 49 174.109 175.344 -1.235 1
1 510 . 11 1 1 A 49 49 GLU CA C 49 52.909 55.285 -2.376 1
1 511 . 11 1 1 A 49 49 GLU CB C 49 27.845 28.246 -0.401 1
1 513 . 11 1 1 A 49 49 GLU N N 49 119.985 127.637 -7.652 1
1 514 . 11 1 1 A 50 50 GLY H H 50 7.617 8.245 -0.628 1
1 515 . 11 1 1 A 50 50 GLY HA2 H 50 3.935 4.035 -0.100 1
1 516 . 11 1 1 A 50 50 GLY HA3 H 50 3.935 4.086 -0.151 1
1 517 . 11 1 1 A 50 50 GLY C C 50 168.223 172.950 -4.727 1
1 518 . 11 1 1 A 50 50 GLY CA C 50 42.121 43.847 -1.726 1
1 519 . 11 1 1 A 50 50 GLY N N 50 108.670 112.702 -4.032 1
1 520 . 11 1 1 A 51 51 PRO HA H 51 4.298 4.674 -0.376 1
1 527 . 11 1 1 A 51 51 PRO C C 51 175.067 177.004 -1.937 1
1 528 . 11 1 1 A 51 51 PRO CA C 51 60.175 63.034 -2.859 1
1 529 . 11 1 1 A 51 51 PRO CB C 51 30.052 31.879 -1.827 1
1 532 . 11 1 1 A 52 52 PHE H H 52 8.442 8.780 -0.338 1
1 533 . 11 1 1 A 52 52 PHE HA H 52 3.981 4.508 -0.527 1
1 541 . 11 1 1 A 52 52 PHE C C 52 175.141 175.768 -0.627 1
1 542 . 11 1 1 A 52 52 PHE CA C 52 56.808 57.951 -1.143 1
1 543 . 11 1 1 A 52 52 PHE CB C 52 36.830 39.476 -2.646 1
1 549 . 11 1 1 A 52 52 PHE N N 52 118.707 122.818 -4.111 1
1 550 . 11 1 1 A 53 53 GLN H H 53 8.778 8.083 0.695 1
1 551 . 11 1 1 A 53 53 GLN HA H 53 4.149 4.215 -0.066 1
1 558 . 11 1 1 A 53 53 GLN C C 53 172.773 175.247 -2.474 1
1 559 . 11 1 1 A 53 53 GLN CA C 53 52.999 56.398 -3.399 1
1 560 . 11 1 1 A 53 53 GLN CB C 53 26.962 29.366 -2.404 1
1 562 . 11 1 1 A 53 53 GLN N N 53 122.164 122.337 -0.173 1
1 564 . 11 1 1 A 54 54 GLU H H 54 8.432 8.606 -0.174 1
1 565 . 11 1 1 A 54 54 GLU HA H 54 5.533 5.109 0.424 1
1 570 . 11 1 1 A 54 54 GLU C C 54 173.930 174.829 -0.899 1
1 571 . 11 1 1 A 54 54 GLU CA C 54 52.981 55.271 -2.290 1
1 572 . 11 1 1 A 54 54 GLU CB C 54 31.712 32.834 -1.122 1
1 574 . 11 1 1 A 54 54 GLU N N 54 119.688 121.946 -2.258 1
1 575 . 11 1 1 A 55 55 VAL H H 55 9.077 8.785 0.292 1
1 576 . 11 1 1 A 55 55 VAL HA H 55 4.180 4.866 -0.686 1
1 584 . 11 1 1 A 55 55 VAL C C 55 171.811 174.418 -2.607 1
1 585 . 11 1 1 A 55 55 VAL CA C 55 59.664 61.200 -1.536 1
1 586 . 11 1 1 A 55 55 VAL CB C 55 31.827 34.656 -2.829 1
1 589 . 11 1 1 A 55 55 VAL N N 55 125.328 126.089 -0.761 1
1 590 . 11 1 1 A 56 56 ASP H H 56 8.639 8.771 -0.132 1
1 591 . 11 1 1 A 56 56 ASP HA H 56 5.250 5.594 -0.344 1
1 594 . 11 1 1 A 56 56 ASP C C 56 174.252 176.039 -1.787 1
1 595 . 11 1 1 A 56 56 ASP CA C 56 50.108 52.334 -2.226 1
1 596 . 11 1 1 A 56 56 ASP CB C 56 41.407 44.202 -2.795 1
1 597 . 11 1 1 A 56 56 ASP N N 56 125.773 125.092 0.681 1
1 598 . 11 1 1 A 57 57 GLY H H 57 7.222 8.711 -1.489 1
1 599 . 11 1 1 A 57 57 GLY HA2 H 57 3.479 3.877 -0.398 1
1 600 . 11 1 1 A 57 57 GLY HA3 H 57 2.719 3.935 -1.216 1
1 601 . 11 1 1 A 57 57 GLY C C 57 172.281 174.427 -2.146 1
1 602 . 11 1 1 A 57 57 GLY CA C 57 43.919 45.185 -1.266 1
1 603 . 11 1 1 A 57 57 GLY N N 57 105.564 111.063 -5.499 1
1 604 . 11 1 1 A 58 58 VAL H H 58 8.338 8.034 0.304 1
1 605 . 11 1 1 A 58 58 VAL HA H 58 3.860 4.245 -0.385 1
1 613 . 11 1 1 A 58 58 VAL C C 58 173.981 175.394 -1.413 1
1 614 . 11 1 1 A 58 58 VAL CA C 58 61.233 61.603 -0.370 1
1 615 . 11 1 1 A 58 58 VAL CB C 58 29.708 30.904 -1.196 1
1 618 . 11 1 1 A 58 58 VAL N N 58 121.466 121.109 0.357 1
1 619 . 11 1 1 A 59 59 ALA H H 59 9.038 8.728 0.310 1
1 620 . 11 1 1 A 59 59 ALA HA H 59 4.676 4.614 0.062 1
1 624 . 11 1 1 A 59 59 ALA C C 59 175.105 176.740 -1.635 1
1 625 . 11 1 1 A 59 59 ALA CA C 59 50.866 52.119 -1.253 1
1 626 . 11 1 1 A 59 59 ALA CB C 59 17.647 19.219 -1.572 1
1 627 . 11 1 1 A 59 59 ALA N N 59 130.928 130.304 0.624 1
1 628 . 11 1 1 A 60 60 THR H H 60 7.445 7.751 -0.306 1
1 629 . 11 1 1 A 60 60 THR HA H 60 4.642 4.704 -0.062 1
1 634 . 11 1 1 A 60 60 THR C C 60 169.528 174.098 -4.570 1
1 635 . 11 1 1 A 60 60 THR CA C 60 57.101 59.241 -2.140 1
1 636 . 11 1 1 A 60 60 THR CB C 60 67.982 72.417 -4.435 1
1 638 . 11 1 1 A 60 60 THR N N 60 109.256 109.258 -0.002 1
1 639 . 11 1 1 A 61 61 THR H H 61 7.325 8.374 -1.049 1
1 640 . 11 1 1 A 61 61 THR HA H 61 2.896 3.674 -0.778 1
1 645 . 11 1 1 A 61 61 THR C C 61 169.678 172.785 -3.107 1
1 646 . 11 1 1 A 61 61 THR CA C 61 57.246 61.157 -3.911 1
1 647 . 11 1 1 A 61 61 THR CB C 61 63.794 68.277 -4.483 1
1 649 . 11 1 1 A 61 61 THR N N 61 105.670 111.237 -5.567 1
1 650 . 11 1 1 A 62 62 ARG H H 62 6.490 7.031 -0.541 1
1 651 . 11 1 1 A 62 62 ARG HA H 62 4.698 4.298 0.400 1
1 658 . 11 1 1 A 62 62 ARG C C 62 172.881 173.482 -0.601 1
1 659 . 11 1 1 A 62 62 ARG CA C 62 52.276 54.941 -2.665 1
1 660 . 11 1 1 A 62 62 ARG CB C 62 30.774 33.370 -2.596 1
1 663 . 11 1 1 A 62 62 ARG N N 62 117.485 121.948 -4.463 1
1 664 . 11 1 1 A 63 63 TYR H H 63 8.891 8.575 0.316 1
1 665 . 11 1 1 A 63 63 TYR HA H 63 4.356 5.207 -0.851 1
1 672 . 11 1 1 A 63 63 TYR C C 63 170.393 173.747 -3.354 1
1 673 . 11 1 1 A 63 63 TYR CA C 63 57.284 57.603 -0.319 1
1 674 . 11 1 1 A 63 63 TYR CB C 63 41.467 42.528 -1.061 1
1 679 . 11 1 1 A 63 63 TYR N N 63 124.712 127.139 -2.427 1
1 680 . 11 1 1 A 64 64 SER H H 64 7.244 8.387 -1.143 1
1 681 . 11 1 1 A 64 64 SER HA H 64 5.077 5.532 -0.455 1
1 684 . 11 1 1 A 64 64 SER C C 64 169.712 173.140 -3.428 1
1 685 . 11 1 1 A 64 64 SER CA C 64 54.181 55.714 -1.533 1
1 686 . 11 1 1 A 64 64 SER CB C 64 61.122 65.103 -3.981 1
1 687 . 11 1 1 A 64 64 SER N N 64 120.593 119.877 0.716 1
1 688 . 11 1 1 A 65 65 ILE H H 65 8.686 8.891 -0.205 1
1 689 . 11 1 1 A 65 65 ILE HA H 65 3.937 4.653 -0.716 1
1 699 . 11 1 1 A 65 65 ILE C C 65 172.217 175.176 -2.959 1
1 700 . 11 1 1 A 65 65 ILE CA C 65 58.288 59.590 -1.302 1
1 701 . 11 1 1 A 65 65 ILE CB C 65 36.110 39.376 -3.266 1
1 705 . 11 1 1 A 65 65 ILE N N 65 127.792 125.673 2.119 1
1 706 . 11 1 1 A 66 66 GLY H H 66 7.883 8.531 -0.648 1
1 707 . 11 1 1 A 66 66 GLY HA2 H 66 4.799 4.340 0.459 1
1 708 . 11 1 1 A 66 66 GLY HA3 H 66 3.468 4.349 -0.881 1
1 709 . 11 1 1 A 66 66 GLY C C 66 171.983 174.039 -2.056 1
1 710 . 11 1 1 A 66 66 GLY CA C 66 40.534 45.082 -4.548 1
1 711 . 11 1 1 A 66 66 GLY N N 66 112.632 113.661 -1.029 1
1 712 . 11 1 1 A 67 67 GLY H H 67 8.483 8.534 -0.051 1
1 713 . 11 1 1 A 67 67 GLY HA2 H 67 3.836 3.993 -0.157 1
1 714 . 11 1 1 A 67 67 GLY HA3 H 67 3.682 4.014 -0.332 1
1 715 . 11 1 1 A 67 67 GLY C C 67 172.954 174.148 -1.194 1
1 716 . 11 1 1 A 67 67 GLY CA C 67 43.568 45.810 -2.242 1
1 717 . 11 1 1 A 67 67 GLY N N 67 104.625 110.337 -5.712 1
1 718 . 11 1 1 A 68 68 LEU H H 68 8.236 7.480 0.756 1
1 719 . 11 1 1 A 68 68 LEU HA H 68 4.154 4.713 -0.559 1
1 729 . 11 1 1 A 68 68 LEU C C 68 173.838 175.365 -1.527 1
1 730 . 11 1 1 A 68 68 LEU CA C 68 51.025 53.284 -2.259 1
1 731 . 11 1 1 A 68 68 LEU CB C 68 38.837 43.274 -4.437 1
1 735 . 11 1 1 A 68 68 LEU N N 68 118.919 121.300 -2.381 1
1 736 . 11 1 1 A 69 69 SER H H 69 8.284 8.905 -0.621 1
1 737 . 11 1 1 A 69 69 SER HA H 69 4.765 5.168 -0.403 1
1 740 . 11 1 1 A 69 69 SER C C 69 170.044 172.703 -2.659 1
1 741 . 11 1 1 A 69 69 SER CA C 69 54.639 54.615 0.024 1
1 742 . 11 1 1 A 69 69 SER CB C 69 61.216 64.456 -3.240 1
1 743 . 11 1 1 A 69 69 SER N N 69 116.361 116.547 -0.186 1
1 744 . 11 1 1 A 70 70 PRO HA H 70 5.141 4.636 0.505 1
1 751 . 11 1 1 A 70 70 PRO C C 70 174.858 177.469 -2.611 1
1 752 . 11 1 1 A 70 70 PRO CA C 70 60.810 64.010 -3.200 1
1 753 . 11 1 1 A 70 70 PRO CB C 70 30.657 31.877 -1.220 1
1 756 . 11 1 1 A 71 71 PHE H H 71 8.139 8.924 -0.785 1
1 757 . 11 1 1 A 71 71 PHE HA H 71 4.202 4.262 -0.060 1
1 765 . 11 1 1 A 71 71 PHE C C 71 172.870 174.411 -1.541 1
1 766 . 11 1 1 A 71 71 PHE CA C 71 55.410 59.065 -3.655 1
1 767 . 11 1 1 A 71 71 PHE CB C 71 36.027 37.694 -1.667 1
1 773 . 11 1 1 A 71 71 PHE N N 71 125.409 122.913 2.496 1
1 774 . 11 1 1 A 72 72 SER H H 72 8.182 7.303 0.879 1
1 775 . 11 1 1 A 72 72 SER HA H 72 4.755 5.048 -0.293 1
1 778 . 11 1 1 A 72 72 SER C C 72 168.850 172.501 -3.651 1
1 779 . 11 1 1 A 72 72 SER CA C 72 55.926 56.532 -0.606 1
1 780 . 11 1 1 A 72 72 SER CB C 72 64.208 66.902 -2.694 1
1 781 . 11 1 1 A 72 72 SER N N 72 113.509 110.434 3.075 1
1 782 . 11 1 1 A 73 73 GLU H H 73 8.422 8.784 -0.362 1
1 783 . 11 1 1 A 73 73 GLU HA H 73 4.966 5.106 -0.140 1
1 788 . 11 1 1 A 73 73 GLU C C 73 173.192 174.629 -1.437 1
1 789 . 11 1 1 A 73 73 GLU CA C 73 52.815 54.906 -2.091 1
1 790 . 11 1 1 A 73 73 GLU CB C 73 29.416 31.927 -2.511 1
1 792 . 11 1 1 A 73 73 GLU N N 73 123.046 123.573 -0.527 1
1 793 . 11 1 1 A 74 74 TYR H H 74 9.205 8.876 0.329 1
1 794 . 11 1 1 A 74 74 TYR HA H 74 4.799 5.059 -0.260 1
1 801 . 11 1 1 A 74 74 TYR C C 74 170.775 174.303 -3.528 1
1 802 . 11 1 1 A 74 74 TYR CA C 74 55.291 56.826 -1.535 1
1 803 . 11 1 1 A 74 74 TYR CB C 74 42.943 42.725 0.218 1
1 808 . 11 1 1 A 74 74 TYR N N 74 125.351 124.811 0.540 1
1 809 . 11 1 1 A 75 75 ALA H H 75 8.639 8.319 0.320 1
1 810 . 11 1 1 A 75 75 ALA HA H 75 5.271 5.431 -0.160 1
1 814 . 11 1 1 A 75 75 ALA C C 75 173.698 175.925 -2.227 1
1 815 . 11 1 1 A 75 75 ALA CA C 75 47.904 50.109 -2.205 1
1 816 . 11 1 1 A 75 75 ALA CB C 75 19.634 21.078 -1.444 1
1 817 . 11 1 1 A 75 75 ALA N N 75 121.555 124.498 -2.943 1
1 818 . 11 1 1 A 76 76 PHE H H 76 9.066 9.515 -0.449 1
1 819 . 11 1 1 A 76 76 PHE HA H 76 5.496 5.373 0.123 1
1 827 . 11 1 1 A 76 76 PHE C C 76 172.268 174.963 -2.695 1
1 828 . 11 1 1 A 76 76 PHE CA C 76 54.216 57.047 -2.831 1
1 829 . 11 1 1 A 76 76 PHE CB C 76 41.901 41.990 -0.089 1
1 835 . 11 1 1 A 76 76 PHE N N 76 116.545 122.165 -5.620 1
1 836 . 11 1 1 A 77 77 ARG H H 77 9.216 9.137 0.079 1
1 837 . 11 1 1 A 77 77 ARG HA H 77 4.357 5.167 -0.810 1
1 845 . 11 1 1 A 77 77 ARG C C 77 169.998 174.191 -4.193 1
1 846 . 11 1 1 A 77 77 ARG CA C 77 52.414 54.851 -2.437 1
1 847 . 11 1 1 A 77 77 ARG CB C 77 30.794 34.102 -3.308 1
1 850 . 11 1 1 A 77 77 ARG N N 77 115.738 118.832 -3.094 1
1 852 . 11 1 1 A 78 78 VAL H H 78 8.135 8.837 -0.702 1
1 853 . 11 1 1 A 78 78 VAL HA H 78 4.884 4.726 0.158 1
1 861 . 11 1 1 A 78 78 VAL C C 78 171.098 174.936 -3.838 1
1 862 . 11 1 1 A 78 78 VAL CA C 78 57.566 61.023 -3.457 1
1 863 . 11 1 1 A 78 78 VAL CB C 78 33.146 32.803 0.343 1
1 866 . 11 1 1 A 78 78 VAL N N 78 117.942 124.864 -6.922 1
1 867 . 11 1 1 A 79 79 LEU H H 79 9.167 8.434 0.733 1
1 868 . 11 1 1 A 79 79 LEU HA H 79 4.575 4.999 -0.424 1
1 878 . 11 1 1 A 79 79 LEU C C 79 171.447 174.919 -3.472 1
1 879 . 11 1 1 A 79 79 LEU CA C 79 51.642 53.550 -1.908 1
1 880 . 11 1 1 A 79 79 LEU CB C 79 42.776 45.917 -3.141 1
1 884 . 11 1 1 A 79 79 LEU N N 79 123.913 119.707 4.206 1
1 885 . 11 1 1 A 80 80 ALA H H 80 9.325 8.659 0.666 1
1 886 . 11 1 1 A 80 80 ALA HA H 80 4.654 4.215 0.439 1
1 890 . 11 1 1 A 80 80 ALA C C 80 172.070 176.685 -4.615 1
1 891 . 11 1 1 A 80 80 ALA CA C 80 48.169 51.030 -2.861 1
1 892 . 11 1 1 A 80 80 ALA CB C 80 20.366 20.092 0.274 1
1 893 . 11 1 1 A 80 80 ALA N N 80 124.135 122.590 1.545 1
1 894 . 11 1 1 A 81 81 VAL H H 81 7.953 7.919 0.034 1
1 895 . 11 1 1 A 81 81 VAL HA H 81 4.293 4.889 -0.596 1
1 903 . 11 1 1 A 81 81 VAL C C 81 172.873 174.176 -1.303 1
1 904 . 11 1 1 A 81 81 VAL CA C 81 58.959 60.479 -1.520 1
1 905 . 11 1 1 A 81 81 VAL CB C 81 31.412 35.188 -3.776 1
1 908 . 11 1 1 A 81 81 VAL N N 81 118.503 120.822 -2.319 1
1 909 . 11 1 1 A 82 82 ASN H H 82 8.262 8.647 -0.385 1
1 910 . 11 1 1 A 82 82 ASN HA H 82 4.945 5.000 -0.055 1
1 915 . 11 1 1 A 82 82 ASN C C 82 173.273 175.510 -2.237 1
1 916 . 11 1 1 A 82 82 ASN CA C 82 48.714 51.557 -2.843 1
1 917 . 11 1 1 A 82 82 ASN CB C 82 36.796 40.036 -3.240 1
1 918 . 11 1 1 A 82 82 ASN N N 82 125.425 123.771 1.654 1
1 920 . 11 1 1 A 83 83 SER HA H 83 3.966 4.123 -0.157 1
1 923 . 11 1 1 A 83 83 SER C C 83 172.812 176.759 -3.947 1
1 924 . 11 1 1 A 83 83 SER CA C 83 59.047 62.155 -3.108 1
1 925 . 11 1 1 A 83 83 SER CB C 83 60.406 62.669 -2.263 1
1 926 . 11 1 1 A 84 84 ILE H H 84 7.803 7.945 -0.142 1
1 927 . 11 1 1 A 84 84 ILE HA H 84 3.862 3.724 0.138 1
1 937 . 11 1 1 A 84 84 ILE C C 84 174.481 176.140 -1.659 1
1 938 . 11 1 1 A 84 84 ILE CA C 84 59.188 64.402 -5.214 1
1 939 . 11 1 1 A 84 84 ILE CB C 84 34.677 38.193 -3.516 1
1 943 . 11 1 1 A 84 84 ILE N N 84 121.222 120.772 0.450 1
1 944 . 11 1 1 A 85 85 GLY H H 85 7.435 7.074 0.361 1
1 945 . 11 1 1 A 85 85 GLY HA2 H 85 4.149 4.045 0.104 1
1 946 . 11 1 1 A 85 85 GLY HA3 H 85 3.747 4.046 -0.299 1
1 947 . 11 1 1 A 85 85 GLY C C 85 168.589 171.984 -3.395 1
1 948 . 11 1 1 A 85 85 GLY CA C 85 42.931 45.542 -2.611 1
1 949 . 11 1 1 A 85 85 GLY N N 85 106.320 105.683 0.637 1
1 950 . 11 1 1 A 86 86 ARG H H 86 8.190 8.471 -0.281 1
1 951 . 11 1 1 A 86 86 ARG HA H 86 4.452 4.952 -0.500 1
1 958 . 11 1 1 A 86 86 ARG C C 86 175.286 175.840 -0.554 1
1 959 . 11 1 1 A 86 86 ARG CA C 86 53.223 54.948 -1.725 1
1 960 . 11 1 1 A 86 86 ARG CB C 86 29.517 31.696 -2.179 1
1 963 . 11 1 1 A 86 86 ARG N N 86 118.339 118.554 -0.215 1
1 964 . 11 1 1 A 87 87 GLY H H 87 8.900 8.571 0.329 1
1 965 . 11 1 1 A 87 87 GLY HA2 H 87 4.211 3.998 0.213 1
1 966 . 11 1 1 A 87 87 GLY HA3 H 87 3.967 4.006 -0.039 1
1 967 . 11 1 1 A 87 87 GLY C C 87 168.101 172.850 -4.749 1
1 968 . 11 1 1 A 87 87 GLY CA C 87 42.281 44.105 -1.824 1
1 969 . 11 1 1 A 87 87 GLY N N 87 113.482 109.314 4.168 1
1 970 . 11 1 1 A 88 88 PRO HA H 88 4.563 4.561 0.002 1
1 977 . 11 1 1 A 88 88 PRO CA C 88 60.994 62.113 -1.119 1
1 978 . 11 1 1 A 88 88 PRO CB C 88 29.873 31.580 -1.707 1
1 981 . 11 1 1 A 89 89 PRO HA H 89 4.490 4.497 -0.007 1
1 987 . 11 1 1 A 89 89 PRO C C 89 174.543 175.932 -1.389 1
1 988 . 11 1 1 A 89 89 PRO CA C 89 59.435 62.320 -2.885 1
1 989 . 11 1 1 A 89 89 PRO CB C 89 29.805 32.201 -2.396 1
1 992 . 11 1 1 A 90 90 SER H H 90 8.808 8.209 0.599 1
1 993 . 11 1 1 A 90 90 SER HA H 90 4.202 4.719 -0.517 1
1 996 . 11 1 1 A 90 90 SER C C 90 171.870 173.859 -1.989 1
1 997 . 11 1 1 A 90 90 SER CA C 90 55.868 56.948 -1.080 1
1 998 . 11 1 1 A 90 90 SER CB C 90 64.504 64.842 -0.338 1
1 999 . 11 1 1 A 90 90 SER N N 90 113.781 116.246 -2.465 1
1 1000 . 11 1 1 A 91 91 GLU H H 91 8.291 8.576 -0.285 1
1 1001 . 11 1 1 A 91 91 GLU HA H 91 4.131 4.169 -0.038 1
1 1006 . 11 1 1 A 91 91 GLU C C 91 174.882 176.381 -1.499 1
1 1007 . 11 1 1 A 91 91 GLU CA C 91 54.984 56.692 -1.708 1
1 1008 . 11 1 1 A 91 91 GLU CB C 91 27.643 29.471 -1.828 1
1 1010 . 11 1 1 A 91 91 GLU N N 91 117.930 123.373 -5.443 1
1 1011 . 11 1 1 A 92 92 ALA H H 92 8.605 8.331 0.274 1
1 1012 . 11 1 1 A 92 92 ALA HA H 92 5.068 4.522 0.546 1
1 1016 . 11 1 1 A 92 92 ALA C C 92 176.227 177.976 -1.749 1
1 1017 . 11 1 1 A 92 92 ALA CA C 92 48.997 53.048 -4.051 1
1 1018 . 11 1 1 A 92 92 ALA CB C 92 17.756 19.202 -1.446 1
1 1019 . 11 1 1 A 92 92 ALA N N 92 126.421 127.323 -0.902 1
1 1020 . 11 1 1 A 93 93 VAL H H 93 9.051 9.102 -0.051 1
1 1021 . 11 1 1 A 93 93 VAL HA H 93 4.642 4.958 -0.316 1
1 1029 . 11 1 1 A 93 93 VAL C C 93 172.010 174.556 -2.546 1
1 1030 . 11 1 1 A 93 93 VAL CA C 93 57.495 59.338 -1.843 1
1 1031 . 11 1 1 A 93 93 VAL CB C 93 32.774 34.133 -1.359 1
1 1034 . 11 1 1 A 93 93 VAL N N 93 117.322 118.226 -0.904 1
1 1035 . 11 1 1 A 94 94 ARG H H 94 8.470 8.896 -0.426 1
1 1036 . 11 1 1 A 94 94 ARG HA H 94 5.692 5.170 0.522 1
1 1043 . 11 1 1 A 94 94 ARG C C 94 173.635 175.452 -1.817 1
1 1044 . 11 1 1 A 94 94 ARG CA C 94 52.038 54.732 -2.694 1
1 1045 . 11 1 1 A 94 94 ARG CB C 94 30.966 31.617 -0.651 1
1 1048 . 11 1 1 A 94 94 ARG N N 94 122.258 123.564 -1.306 1
1 1049 . 11 1 1 A 95 95 ALA H H 95 9.051 9.165 -0.114 1
1 1050 . 11 1 1 A 95 95 ALA HA H 95 4.642 5.273 -0.631 1
1 1054 . 11 1 1 A 95 95 ALA C C 95 172.285 175.043 -2.758 1
1 1055 . 11 1 1 A 95 95 ALA CA C 95 49.191 50.769 -1.578 1
1 1056 . 11 1 1 A 95 95 ALA CB C 95 22.562 22.352 0.210 1
1 1057 . 11 1 1 A 95 95 ALA N N 95 121.931 126.824 -4.893 1
1 1058 . 11 1 1 A 96 96 ARG H H 96 8.550 8.882 -0.332 1
1 1059 . 11 1 1 A 96 96 ARG HA H 96 5.407 5.177 0.230 1
1 1066 . 11 1 1 A 96 96 ARG C C 96 174.547 176.108 -1.561 1
1 1067 . 11 1 1 A 96 96 ARG CA C 96 51.439 54.930 -3.491 1
1 1068 . 11 1 1 A 96 96 ARG CB C 96 30.708 31.765 -1.057 1
1 1071 . 11 1 1 A 96 96 ARG N N 96 121.155 124.484 -3.329 1
1 1072 . 11 1 1 A 97 97 THR H H 97 8.797 8.846 -0.049 1
1 1073 . 11 1 1 A 97 97 THR HA H 97 4.116 4.528 -0.412 1
1 1078 . 11 1 1 A 97 97 THR C C 97 173.577 175.036 -1.459 1
1 1079 . 11 1 1 A 97 97 THR CA C 97 58.800 61.618 -2.818 1
1 1080 . 11 1 1 A 97 97 THR CB C 97 67.461 69.688 -2.227 1
1 1082 . 11 1 1 A 97 97 THR N N 97 114.657 117.482 -2.825 1
1 1083 . 11 1 1 A 98 98 GLY H H 98 7.505 8.453 -0.948 1
1 1084 . 11 1 1 A 98 98 GLY HA2 H 98 3.866 4.132 -0.266 1
1 1085 . 11 1 1 A 98 98 GLY HA3 H 98 3.743 4.180 -0.437 1
1 1086 . 11 1 1 A 98 98 GLY C C 98 170.637 173.688 -3.051 1
1 1087 . 11 1 1 A 98 98 GLY CA C 98 42.332 44.547 -2.215 1
1 1088 . 11 1 1 A 98 98 GLY N N 98 106.172 108.331 -2.159 1
1 1089 . 11 1 1 A 99 99 GLU H H 99 8.145 8.309 -0.164 1
1 1090 . 11 1 1 A 99 99 GLU HA H 99 4.210 4.804 -0.594 1
1 1095 . 11 1 1 A 99 99 GLU C C 99 174.134 176.405 -2.271 1
1 1096 . 11 1 1 A 99 99 GLU CA C 99 53.828 55.492 -1.664 1
1 1097 . 11 1 1 A 99 99 GLU CB C 99 28.774 29.259 -0.485 1
1 1099 . 11 1 1 A 99 99 GLU N N 99 117.634 117.226 0.408 1
1 1100 . 11 1 1 A 100 100 GLN H H 100 8.647 8.625 0.022 1
1 1101 . 11 1 1 A 100 100 GLN HA H 100 4.247 4.403 -0.156 1
1 1108 . 11 1 1 A 100 100 GLN C C 100 173.348 176.852 -3.504 1
1 1109 . 11 1 1 A 100 100 GLN CA C 100 53.634 57.495 -3.861 1
1 1110 . 11 1 1 A 100 100 GLN CB C 100 27.392 29.889 -2.497 1
1 1112 . 11 1 1 A 100 100 GLN N N 100 121.960 123.047 -1.087 1
1 1114 . 11 1 1 A 101 101 SER H H 101 8.416 7.840 0.576 1
1 1115 . 11 1 1 A 101 101 SER HA H 101 4.418 4.464 -0.046 1
1 1117 . 11 1 1 A 101 101 SER C C 101 172.148 174.681 -2.533 1
1 1118 . 11 1 1 A 101 101 SER CA C 101 55.926 57.445 -1.519 1
1 1119 . 11 1 1 A 101 101 SER CB C 101 61.617 62.502 -0.885 1
1 1120 . 11 1 1 A 101 101 SER N N 101 118.609 112.159 6.450 1
1 1121 . 11 1 1 A 102 102 GLY H H 102 8.233 8.339 -0.106 1
1 1122 . 11 1 1 A 102 102 GLY HA2 H 102 4.080 4.023 0.057 1
1 1123 . 11 1 1 A 102 102 GLY HA3 H 102 3.981 4.055 -0.074 1
1 1124 . 11 1 1 A 102 102 GLY C C 102 169.461 174.459 -4.998 1
1 1125 . 11 1 1 A 102 102 GLY CA C 102 42.332 45.252 -2.920 1
1 1126 . 11 1 1 A 102 102 GLY N N 102 110.483 110.077 0.406 1
1 1127 . 11 1 1 A 103 103 PRO HA H 103 4.618 4.375 0.243 1
1 1134 . 11 1 1 A 103 103 PRO CA C 103 57.843 64.581 -6.738 1
1 1135 . 11 1 1 A 103 103 PRO CB C 103 28.671 32.255 -3.584 1
1 1 . 12 1 1 A 6 6 SER HA H 6 4.492 5.029 -0.537 1
1 4 . 12 1 1 A 6 6 SER CA C 6 55.621 56.222 -0.601 1
1 5 . 12 1 1 A 6 6 SER CB C 6 62.104 65.680 -3.576 1
1 6 . 12 1 1 A 7 7 GLY H H 7 8.244 8.384 -0.140 1
1 7 . 12 1 1 A 7 7 GLY HA2 H 7 3.873 4.031 -0.158 1
1 8 . 12 1 1 A 7 7 GLY HA3 H 7 3.737 4.039 -0.302 1
1 9 . 12 1 1 A 7 7 GLY CA C 7 41.743 44.246 -2.503 1
1 10 . 12 1 1 A 7 7 GLY N N 7 109.193 108.498 0.695 1
1 11 . 12 1 1 A 8 8 PRO HA H 8 4.286 4.552 -0.266 1
1 18 . 12 1 1 A 8 8 PRO C C 8 173.841 175.534 -1.693 1
1 19 . 12 1 1 A 8 8 PRO CA C 8 60.528 62.575 -2.047 1
1 20 . 12 1 1 A 8 8 PRO CB C 8 30.299 33.127 -2.828 1
1 23 . 12 1 1 A 9 9 LYS H H 9 8.877 8.353 0.524 1
1 24 . 12 1 1 A 9 9 LYS HA H 9 4.360 4.808 -0.448 1
1 33 . 12 1 1 A 9 9 LYS C C 9 173.492 174.328 -0.836 1
1 34 . 12 1 1 A 9 9 LYS CA C 9 52.135 53.202 -1.067 1
1 35 . 12 1 1 A 9 9 LYS CB C 9 28.798 32.803 -4.005 1
1 39 . 12 1 1 A 9 9 LYS N N 9 120.404 120.698 -0.294 1
1 40 . 12 1 1 A 10 10 PRO HA H 10 4.284 4.624 -0.340 1
1 47 . 12 1 1 A 10 10 PRO CA C 10 59.326 61.630 -2.304 1
1 48 . 12 1 1 A 10 10 PRO CB C 10 28.825 31.603 -2.778 1
1 51 . 12 1 1 A 11 11 PRO HA H 11 4.468 4.808 -0.340 1
1 58 . 12 1 1 A 11 11 PRO C C 11 171.993 176.209 -4.216 1
1 59 . 12 1 1 A 11 11 PRO CA C 11 60.422 62.507 -2.085 1
1 60 . 12 1 1 A 11 11 PRO CB C 11 30.418 33.023 -2.605 1
1 63 . 12 1 1 A 12 12 ILE H H 12 7.554 8.105 -0.551 1
1 64 . 12 1 1 A 12 12 ILE HA H 12 4.676 4.666 0.010 1
1 74 . 12 1 1 A 12 12 ILE C C 12 171.721 175.092 -3.371 1
1 75 . 12 1 1 A 12 12 ILE CA C 12 56.843 58.749 -1.906 1
1 76 . 12 1 1 A 12 12 ILE CB C 12 40.560 41.219 -0.659 1
1 80 . 12 1 1 A 12 12 ILE N N 12 109.695 116.548 -6.853 1
1 81 . 12 1 1 A 13 13 ASP H H 13 8.435 9.060 -0.625 1
1 82 . 12 1 1 A 13 13 ASP HA H 13 4.094 4.245 -0.151 1
1 85 . 12 1 1 A 13 13 ASP C C 13 171.803 176.182 -4.379 1
1 86 . 12 1 1 A 13 13 ASP CA C 13 52.610 54.899 -2.289 1
1 87 . 12 1 1 A 13 13 ASP CB C 13 36.357 39.699 -3.342 1
1 88 . 12 1 1 A 13 13 ASP N N 13 116.219 122.102 -5.883 1
1 89 . 12 1 1 A 14 14 LEU H H 14 7.483 7.946 -0.463 1
1 90 . 12 1 1 A 14 14 LEU HA H 14 4.990 5.123 -0.133 1
1 100 . 12 1 1 A 14 14 LEU C C 14 174.702 175.455 -0.753 1
1 101 . 12 1 1 A 14 14 LEU CA C 14 53.811 54.909 -1.098 1
1 102 . 12 1 1 A 14 14 LEU CB C 14 40.148 42.451 -2.303 1
1 106 . 12 1 1 A 14 14 LEU N N 14 118.463 120.671 -2.208 1
1 107 . 12 1 1 A 15 15 VAL H H 15 9.209 8.856 0.353 1
1 108 . 12 1 1 A 15 15 VAL HA H 15 4.250 4.750 -0.500 1
1 116 . 12 1 1 A 15 15 VAL C C 15 172.080 174.389 -2.309 1
1 117 . 12 1 1 A 15 15 VAL CA C 15 58.570 60.437 -1.867 1
1 118 . 12 1 1 A 15 15 VAL CB C 15 34.146 36.152 -2.006 1
1 121 . 12 1 1 A 15 15 VAL N N 15 124.833 127.483 -2.650 1
1 122 . 12 1 1 A 16 16 VAL H H 16 8.390 8.973 -0.583 1
1 123 . 12 1 1 A 16 16 VAL HA H 16 4.343 4.606 -0.263 1
1 131 . 12 1 1 A 16 16 VAL C C 16 174.672 175.653 -0.981 1
1 132 . 12 1 1 A 16 16 VAL CA C 16 59.188 61.160 -1.972 1
1 133 . 12 1 1 A 16 16 VAL CB C 16 29.187 33.406 -4.219 1
1 136 . 12 1 1 A 16 16 VAL N N 16 124.654 125.173 -0.519 1
1 137 . 12 1 1 A 17 17 THR H H 17 8.638 8.361 0.277 1
1 138 . 12 1 1 A 17 17 THR HA H 17 4.195 4.461 -0.266 1
1 143 . 12 1 1 A 17 17 THR C C 17 172.661 173.285 -0.624 1
1 144 . 12 1 1 A 17 17 THR CA C 17 60.318 63.505 -3.187 1
1 145 . 12 1 1 A 17 17 THR CB C 17 66.420 70.886 -4.466 1
1 147 . 12 1 1 A 17 17 THR N N 17 120.942 121.987 -1.045 1
1 148 . 12 1 1 A 18 18 GLU H H 18 7.361 7.648 -0.287 1
1 149 . 12 1 1 A 18 18 GLU HA H 18 4.497 4.839 -0.342 1
1 154 . 12 1 1 A 18 18 GLU C C 18 171.691 175.235 -3.544 1
1 155 . 12 1 1 A 18 18 GLU CA C 18 53.687 54.922 -1.235 1
1 156 . 12 1 1 A 18 18 GLU CB C 18 30.802 33.258 -2.456 1
1 158 . 12 1 1 A 18 18 GLU N N 18 119.088 118.621 0.467 1
1 159 . 12 1 1 A 19 19 THR H H 19 8.164 8.706 -0.542 1
1 160 . 12 1 1 A 19 19 THR HA H 19 4.912 5.055 -0.143 1
1 165 . 12 1 1 A 19 19 THR C C 19 171.606 172.837 -1.231 1
1 166 . 12 1 1 A 19 19 THR CA C 19 58.473 60.689 -2.216 1
1 167 . 12 1 1 A 19 19 THR CB C 19 70.103 71.055 -0.952 1
1 169 . 12 1 1 A 19 19 THR N N 19 112.424 113.848 -1.424 1
1 170 . 12 1 1 A 20 20 THR H H 20 8.750 9.160 -0.410 1
1 171 . 12 1 1 A 20 20 THR HA H 20 4.710 4.760 -0.050 1
1 176 . 12 1 1 A 20 20 THR C C 20 172.785 176.136 -3.351 1
1 177 . 12 1 1 A 20 20 THR CA C 20 58.059 61.332 -3.273 1
1 178 . 12 1 1 A 20 20 THR CB C 20 68.782 70.985 -2.203 1
1 180 . 12 1 1 A 20 20 THR N N 20 113.438 121.469 -8.031 1
1 181 . 12 1 1 A 21 21 ALA H H 21 8.453 8.967 -0.514 1
1 182 . 12 1 1 A 21 21 ALA HA H 21 4.079 4.269 -0.190 1
1 186 . 12 1 1 A 21 21 ALA C C 21 174.130 177.821 -3.691 1
1 187 . 12 1 1 A 21 21 ALA CA C 21 52.680 54.863 -2.183 1
1 188 . 12 1 1 A 21 21 ALA CB C 21 16.893 18.453 -1.560 1
1 189 . 12 1 1 A 21 21 ALA N N 21 120.078 126.187 -6.109 1
1 190 . 12 1 1 A 22 22 THR H H 22 7.132 7.569 -0.437 1
1 191 . 12 1 1 A 22 22 THR HA H 22 4.433 4.694 -0.261 1
1 196 . 12 1 1 A 22 22 THR C C 22 171.434 173.505 -2.071 1
1 197 . 12 1 1 A 22 22 THR CA C 22 56.836 60.511 -3.675 1
1 198 . 12 1 1 A 22 22 THR CB C 22 68.772 69.614 -0.842 1
1 200 . 12 1 1 A 22 22 THR N N 22 95.772 104.118 -8.346 1
1 201 . 12 1 1 A 23 23 SER H H 23 7.326 7.738 -0.412 1
1 202 . 12 1 1 A 23 23 SER HA H 23 5.562 5.360 0.202 1
1 205 . 12 1 1 A 23 23 SER C C 23 169.267 172.143 -2.876 1
1 206 . 12 1 1 A 23 23 SER CA C 23 54.445 57.701 -3.256 1
1 207 . 12 1 1 A 23 23 SER CB C 23 65.905 67.399 -1.494 1
1 208 . 12 1 1 A 23 23 SER N N 23 115.757 115.631 0.126 1
1 209 . 12 1 1 A 24 24 VAL H H 24 7.983 8.555 -0.572 1
1 210 . 12 1 1 A 24 24 VAL HA H 24 4.334 4.528 -0.194 1
1 218 . 12 1 1 A 24 24 VAL C C 24 171.917 173.512 -1.595 1
1 219 . 12 1 1 A 24 24 VAL CA C 24 58.642 60.270 -1.628 1
1 220 . 12 1 1 A 24 24 VAL CB C 24 34.254 34.919 -0.665 1
1 223 . 12 1 1 A 24 24 VAL N N 24 116.595 120.732 -4.137 1
1 224 . 12 1 1 A 25 25 THR H H 25 8.636 8.858 -0.222 1
1 225 . 12 1 1 A 25 25 THR HA H 25 4.833 4.922 -0.089 1
1 230 . 12 1 1 A 25 25 THR C C 25 169.721 172.904 -3.183 1
1 231 . 12 1 1 A 25 25 THR CA C 25 59.699 61.757 -2.058 1
1 232 . 12 1 1 A 25 25 THR CB C 25 67.303 70.171 -2.868 1
1 234 . 12 1 1 A 25 25 THR N N 25 121.690 122.238 -0.548 1
1 235 . 12 1 1 A 26 26 LEU H H 26 8.629 9.456 -0.827 1
1 236 . 12 1 1 A 26 26 LEU HA H 26 5.315 5.244 0.071 1
1 246 . 12 1 1 A 26 26 LEU C C 26 173.182 175.460 -2.278 1
1 247 . 12 1 1 A 26 26 LEU CA C 26 50.643 53.214 -2.571 1
1 248 . 12 1 1 A 26 26 LEU CB C 26 43.976 45.328 -1.352 1
1 252 . 12 1 1 A 26 26 LEU N N 26 126.843 130.914 -4.071 1
1 253 . 12 1 1 A 27 27 THR H H 27 8.704 9.297 -0.593 1
1 254 . 12 1 1 A 27 27 THR HA H 27 4.822 5.326 -0.504 1
1 259 . 12 1 1 A 27 27 THR C C 27 169.840 173.571 -3.731 1
1 260 . 12 1 1 A 27 27 THR CA C 27 58.077 59.717 -1.640 1
1 261 . 12 1 1 A 27 27 THR CB C 27 69.666 71.396 -1.730 1
1 263 . 12 1 1 A 27 27 THR N N 27 111.513 116.294 -4.781 1
1 264 . 12 1 1 A 28 28 TRP H H 28 7.339 7.975 -0.636 1
1 265 . 12 1 1 A 28 28 TRP HA H 28 4.963 5.588 -0.625 1
1 274 . 12 1 1 A 28 28 TRP C C 28 170.637 172.379 -1.742 1
1 275 . 12 1 1 A 28 28 TRP CA C 28 54.438 55.629 -1.191 1
1 276 . 12 1 1 A 28 28 TRP CB C 28 27.497 31.499 -4.002 1
1 282 . 12 1 1 A 28 28 TRP N N 28 117.895 119.627 -1.732 1
1 284 . 12 1 1 A 29 29 ASP H H 29 8.696 9.134 -0.438 1
1 285 . 12 1 1 A 29 29 ASP HA H 29 4.971 5.048 -0.077 1
1 288 . 12 1 1 A 29 29 ASP C C 29 174.901 177.627 -2.726 1
1 289 . 12 1 1 A 29 29 ASP CA C 29 50.178 52.661 -2.483 1
1 290 . 12 1 1 A 29 29 ASP CB C 29 42.291 43.063 -0.772 1
1 291 . 12 1 1 A 29 29 ASP N N 29 117.477 121.917 -4.440 1
1 292 . 12 1 1 A 30 30 SER H H 30 8.800 8.760 0.040 1
1 293 . 12 1 1 A 30 30 SER HA H 30 4.389 4.266 0.123 1
1 296 . 12 1 1 A 30 30 SER C C 30 174.032 175.695 -1.663 1
1 297 . 12 1 1 A 30 30 SER CA C 30 58.694 60.462 -1.768 1
1 298 . 12 1 1 A 30 30 SER CB C 30 62.428 63.510 -1.082 1
1 299 . 12 1 1 A 30 30 SER N N 30 118.275 120.181 -1.906 1
1 300 . 12 1 1 A 31 31 GLY H H 31 8.759 8.626 0.133 1
1 301 . 12 1 1 A 31 31 GLY HA2 H 31 4.239 4.007 0.232 1
1 302 . 12 1 1 A 31 31 GLY HA3 H 31 3.555 4.038 -0.483 1
1 303 . 12 1 1 A 31 31 GLY C C 31 171.325 173.730 -2.405 1
1 304 . 12 1 1 A 31 31 GLY CA C 31 43.637 45.454 -1.817 1
1 305 . 12 1 1 A 31 31 GLY N N 31 107.961 111.027 -3.066 1
1 306 . 12 1 1 A 32 32 ASN H H 32 8.173 7.856 0.317 1
1 307 . 12 1 1 A 32 32 ASN HA H 32 4.749 5.333 -0.584 1
1 312 . 12 1 1 A 32 32 ASN C C 32 171.355 174.980 -3.625 1
1 313 . 12 1 1 A 32 32 ASN CA C 32 50.795 51.831 -1.036 1
1 314 . 12 1 1 A 32 32 ASN CB C 32 41.508 41.990 -0.482 1
1 315 . 12 1 1 A 32 32 ASN N N 32 117.781 118.827 -1.046 1
1 317 . 12 1 1 A 33 33 SER HA H 33 4.291 4.587 -0.296 1
1 320 . 12 1 1 A 33 33 SER C C 33 172.449 174.667 -2.218 1
1 321 . 12 1 1 A 33 33 SER CA C 33 56.733 58.325 -1.592 1
1 322 . 12 1 1 A 33 33 SER CB C 33 60.884 64.958 -4.074 1
1 323 . 12 1 1 A 34 34 GLU H H 34 7.731 7.616 0.115 1
1 324 . 12 1 1 A 34 34 GLU HA H 34 4.556 4.536 0.020 1
1 329 . 12 1 1 A 34 34 GLU C C 34 171.792 174.864 -3.072 1
1 330 . 12 1 1 A 34 34 GLU CA C 34 51.818 54.985 -3.167 1
1 331 . 12 1 1 A 34 34 GLU CB C 34 26.891 28.791 -1.900 1
1 333 . 12 1 1 A 34 34 GLU N N 34 122.319 120.871 1.448 1
1 334 . 12 1 1 A 35 35 PRO HA H 35 4.165 4.754 -0.589 1
1 341 . 12 1 1 A 35 35 PRO C C 35 174.288 176.602 -2.314 1
1 342 . 12 1 1 A 35 35 PRO CA C 35 61.374 62.373 -0.999 1
1 343 . 12 1 1 A 35 35 PRO CB C 35 29.887 29.866 0.021 1
1 346 . 12 1 1 A 36 36 VAL H H 36 8.348 8.249 0.099 1
1 347 . 12 1 1 A 36 36 VAL HA H 36 3.899 4.091 -0.192 1
1 355 . 12 1 1 A 36 36 VAL C C 36 173.344 176.191 -2.847 1
1 356 . 12 1 1 A 36 36 VAL CA C 36 59.014 62.596 -3.582 1
1 357 . 12 1 1 A 36 36 VAL CB C 36 31.865 31.719 0.146 1
1 360 . 12 1 1 A 36 36 VAL N N 36 122.051 123.846 -1.795 1
1 361 . 12 1 1 A 37 37 THR H H 37 8.780 8.730 0.050 1
1 362 . 12 1 1 A 37 37 THR HA H 37 3.923 4.281 -0.358 1
1 367 . 12 1 1 A 37 37 THR C C 37 172.171 174.606 -2.435 1
1 368 . 12 1 1 A 37 37 THR CA C 37 63.155 64.420 -1.265 1
1 369 . 12 1 1 A 37 37 THR CB C 37 65.941 69.282 -3.341 1
1 371 . 12 1 1 A 37 37 THR N N 37 122.351 120.231 2.120 1
1 372 . 12 1 1 A 38 38 TYR H H 38 7.304 7.505 -0.201 1
1 373 . 12 1 1 A 38 38 TYR HA H 38 4.439 5.203 -0.764 1
1 380 . 12 1 1 A 38 38 TYR C C 38 168.385 172.393 -4.008 1
1 381 . 12 1 1 A 38 38 TYR CA C 38 54.101 56.386 -2.285 1
1 382 . 12 1 1 A 38 38 TYR CB C 38 35.874 40.306 -4.432 1
1 387 . 12 1 1 A 38 38 TYR N N 38 113.984 115.287 -1.303 1
1 388 . 12 1 1 A 39 39 TYR H H 39 9.445 9.197 0.248 1
1 389 . 12 1 1 A 39 39 TYR HA H 39 5.293 5.332 -0.039 1
1 396 . 12 1 1 A 39 39 TYR C C 39 172.781 175.730 -2.949 1
1 397 . 12 1 1 A 39 39 TYR CA C 39 54.322 55.598 -1.276 1
1 398 . 12 1 1 A 39 39 TYR CB C 39 39.035 40.071 -1.036 1
1 401 . 12 1 1 A 39 39 TYR N N 39 115.092 118.522 -3.430 1
1 402 . 12 1 1 A 40 40 GLY H H 40 8.870 8.303 0.567 1
1 403 . 12 1 1 A 40 40 GLY HA2 H 40 5.137 4.105 1.032 1
1 404 . 12 1 1 A 40 40 GLY HA3 H 40 3.285 4.173 -0.888 1
1 405 . 12 1 1 A 40 40 GLY C C 40 169.688 172.983 -3.295 1
1 406 . 12 1 1 A 40 40 GLY CA C 40 41.415 45.062 -3.647 1
1 407 . 12 1 1 A 40 40 GLY N N 40 106.573 111.241 -4.668 1
1 408 . 12 1 1 A 41 41 ILE H H 41 8.917 8.376 0.541 1
1 409 . 12 1 1 A 41 41 ILE HA H 41 4.527 4.788 -0.261 1
1 419 . 12 1 1 A 41 41 ILE C C 41 172.692 174.566 -1.874 1
1 420 . 12 1 1 A 41 41 ILE CA C 41 57.597 60.100 -2.503 1
1 421 . 12 1 1 A 41 41 ILE CB C 41 37.840 41.417 -3.577 1
1 425 . 12 1 1 A 41 41 ILE N N 41 121.746 122.088 -0.342 1
1 426 . 12 1 1 A 42 42 GLN H H 42 9.063 8.874 0.189 1
1 427 . 12 1 1 A 42 42 GLN HA H 42 5.655 5.218 0.437 1
1 434 . 12 1 1 A 42 42 GLN C C 42 172.841 174.546 -1.705 1
1 435 . 12 1 1 A 42 42 GLN CA C 42 50.789 54.243 -3.454 1
1 436 . 12 1 1 A 42 42 GLN CB C 42 28.898 31.582 -2.684 1
1 438 . 12 1 1 A 42 42 GLN N N 42 125.141 125.936 -0.795 1
1 440 . 12 1 1 A 43 43 TYR H H 43 9.066 8.840 0.226 1
1 441 . 12 1 1 A 43 43 TYR HA H 43 5.922 6.047 -0.125 1
1 448 . 12 1 1 A 43 43 TYR C C 43 171.219 173.211 -1.992 1
1 449 . 12 1 1 A 43 43 TYR CA C 43 53.349 55.995 -2.646 1
1 450 . 12 1 1 A 43 43 TYR CB C 43 41.074 42.649 -1.575 1
1 455 . 12 1 1 A 43 43 TYR N N 43 118.018 120.010 -1.992 1
1 456 . 12 1 1 A 44 44 ARG H H 44 8.400 8.775 -0.375 1
1 457 . 12 1 1 A 44 44 ARG HA H 44 4.542 4.630 -0.088 1
1 464 . 12 1 1 A 44 44 ARG C C 44 171.974 174.373 -2.399 1
1 465 . 12 1 1 A 44 44 ARG CA C 44 52.453 55.161 -2.708 1
1 466 . 12 1 1 A 44 44 ARG CB C 44 31.125 33.496 -2.371 1
1 469 . 12 1 1 A 44 44 ARG N N 44 115.214 120.434 -5.220 1
1 470 . 12 1 1 A 45 45 ALA H H 45 8.846 8.318 0.528 1
1 471 . 12 1 1 A 45 45 ALA HA H 45 3.894 2.635 1.259 1
1 475 . 12 1 1 A 45 45 ALA C C 45 175.721 176.700 -0.979 1
1 476 . 12 1 1 A 45 45 ALA CA C 45 50.372 52.032 -1.660 1
1 477 . 12 1 1 A 45 45 ALA CB C 45 15.732 18.989 -3.257 1
1 478 . 12 1 1 A 45 45 ALA N N 45 126.463 126.784 -0.321 1
1 479 . 12 1 1 A 46 46 ALA H H 46 8.282 8.256 0.026 1
1 480 . 12 1 1 A 46 46 ALA HA H 46 3.922 3.966 -0.044 1
1 484 . 12 1 1 A 46 46 ALA C C 46 176.236 177.739 -1.503 1
1 485 . 12 1 1 A 46 46 ALA CA C 46 50.773 52.669 -1.896 1
1 486 . 12 1 1 A 46 46 ALA CB C 46 16.244 18.110 -1.866 1
1 487 . 12 1 1 A 46 46 ALA N N 46 126.301 126.705 -0.404 1
1 488 . 12 1 1 A 47 47 GLY HA2 H 47 3.882 3.927 -0.045 1
1 489 . 12 1 1 A 47 47 GLY HA3 H 47 3.695 3.954 -0.259 1
1 490 . 12 1 1 A 47 47 GLY C C 47 171.795 174.480 -2.685 1
1 491 . 12 1 1 A 47 47 GLY CA C 47 43.327 45.356 -2.029 1
1 492 . 12 1 1 A 48 48 THR H H 48 7.145 7.304 -0.159 1
1 493 . 12 1 1 A 48 48 THR HA H 48 4.417 4.302 0.115 1
1 498 . 12 1 1 A 48 48 THR C C 48 171.325 174.382 -3.057 1
1 499 . 12 1 1 A 48 48 THR CA C 48 58.271 62.093 -3.822 1
1 500 . 12 1 1 A 48 48 THR CB C 48 68.846 69.517 -0.671 1
1 502 . 12 1 1 A 48 48 THR N N 48 110.190 115.670 -5.480 1
1 503 . 12 1 1 A 49 49 GLU H H 49 8.346 8.854 -0.508 1
1 504 . 12 1 1 A 49 49 GLU HA H 49 4.277 4.557 -0.280 1
1 509 . 12 1 1 A 49 49 GLU C C 49 174.109 176.832 -2.723 1
1 510 . 12 1 1 A 49 49 GLU CA C 49 52.909 56.334 -3.425 1
1 511 . 12 1 1 A 49 49 GLU CB C 49 27.845 30.432 -2.587 1
1 513 . 12 1 1 A 49 49 GLU N N 49 119.985 123.465 -3.480 1
1 514 . 12 1 1 A 50 50 GLY H H 50 7.617 7.865 -0.248 1
1 515 . 12 1 1 A 50 50 GLY HA2 H 50 3.935 4.038 -0.103 1
1 516 . 12 1 1 A 50 50 GLY HA3 H 50 3.935 4.071 -0.136 1
1 517 . 12 1 1 A 50 50 GLY C C 50 168.223 173.094 -4.871 1
1 518 . 12 1 1 A 50 50 GLY CA C 50 42.121 44.360 -2.239 1
1 519 . 12 1 1 A 50 50 GLY N N 50 108.670 108.296 0.374 1
1 520 . 12 1 1 A 51 51 PRO HA H 51 4.298 4.675 -0.377 1
1 527 . 12 1 1 A 51 51 PRO C C 51 175.067 175.715 -0.648 1
1 528 . 12 1 1 A 51 51 PRO CA C 51 60.175 62.895 -2.720 1
1 529 . 12 1 1 A 51 51 PRO CB C 51 30.052 32.155 -2.103 1
1 532 . 12 1 1 A 52 52 PHE H H 52 8.442 8.592 -0.150 1
1 533 . 12 1 1 A 52 52 PHE HA H 52 3.981 4.764 -0.783 1
1 541 . 12 1 1 A 52 52 PHE C C 52 175.141 175.822 -0.681 1
1 542 . 12 1 1 A 52 52 PHE CA C 52 56.808 57.324 -0.516 1
1 543 . 12 1 1 A 52 52 PHE CB C 52 36.830 40.478 -3.648 1
1 549 . 12 1 1 A 52 52 PHE N N 52 118.707 119.014 -0.307 1
1 550 . 12 1 1 A 53 53 GLN H H 53 8.778 8.358 0.420 1
1 551 . 12 1 1 A 53 53 GLN HA H 53 4.149 4.273 -0.124 1
1 558 . 12 1 1 A 53 53 GLN C C 53 172.773 175.119 -2.346 1
1 559 . 12 1 1 A 53 53 GLN CA C 53 52.999 56.506 -3.507 1
1 560 . 12 1 1 A 53 53 GLN CB C 53 26.962 29.235 -2.273 1
1 562 . 12 1 1 A 53 53 GLN N N 53 122.164 122.131 0.033 1
1 564 . 12 1 1 A 54 54 GLU H H 54 8.432 8.560 -0.128 1
1 565 . 12 1 1 A 54 54 GLU HA H 54 5.533 4.920 0.613 1
1 570 . 12 1 1 A 54 54 GLU C C 54 173.930 174.668 -0.738 1
1 571 . 12 1 1 A 54 54 GLU CA C 54 52.981 55.477 -2.496 1
1 572 . 12 1 1 A 54 54 GLU CB C 54 31.712 32.841 -1.129 1
1 574 . 12 1 1 A 54 54 GLU N N 54 119.688 122.225 -2.537 1
1 575 . 12 1 1 A 55 55 VAL H H 55 9.077 8.808 0.269 1
1 576 . 12 1 1 A 55 55 VAL HA H 55 4.180 4.902 -0.722 1
1 584 . 12 1 1 A 55 55 VAL C C 55 171.811 174.460 -2.649 1
1 585 . 12 1 1 A 55 55 VAL CA C 55 59.664 61.158 -1.494 1
1 586 . 12 1 1 A 55 55 VAL CB C 55 31.827 34.064 -2.237 1
1 589 . 12 1 1 A 55 55 VAL N N 55 125.328 126.136 -0.808 1
1 590 . 12 1 1 A 56 56 ASP H H 56 8.639 9.017 -0.378 1
1 591 . 12 1 1 A 56 56 ASP HA H 56 5.250 5.611 -0.361 1
1 594 . 12 1 1 A 56 56 ASP C C 56 174.252 175.838 -1.586 1
1 595 . 12 1 1 A 56 56 ASP CA C 56 50.108 52.218 -2.110 1
1 596 . 12 1 1 A 56 56 ASP CB C 56 41.407 43.870 -2.463 1
1 597 . 12 1 1 A 56 56 ASP N N 56 125.773 125.283 0.490 1
1 598 . 12 1 1 A 57 57 GLY H H 57 7.222 8.485 -1.263 1
1 599 . 12 1 1 A 57 57 GLY HA2 H 57 3.479 3.863 -0.384 1
1 600 . 12 1 1 A 57 57 GLY HA3 H 57 2.719 3.952 -1.233 1
1 601 . 12 1 1 A 57 57 GLY C C 57 172.281 174.295 -2.014 1
1 602 . 12 1 1 A 57 57 GLY CA C 57 43.919 45.001 -1.082 1
1 603 . 12 1 1 A 57 57 GLY N N 57 105.564 110.734 -5.170 1
1 604 . 12 1 1 A 58 58 VAL H H 58 8.338 7.975 0.363 1
1 605 . 12 1 1 A 58 58 VAL HA H 58 3.860 4.333 -0.473 1
1 613 . 12 1 1 A 58 58 VAL C C 58 173.981 175.423 -1.442 1
1 614 . 12 1 1 A 58 58 VAL CA C 58 61.233 61.800 -0.567 1
1 615 . 12 1 1 A 58 58 VAL CB C 58 29.708 31.029 -1.321 1
1 618 . 12 1 1 A 58 58 VAL N N 58 121.466 121.287 0.179 1
1 619 . 12 1 1 A 59 59 ALA H H 59 9.038 8.721 0.317 1
1 620 . 12 1 1 A 59 59 ALA HA H 59 4.676 4.596 0.080 1
1 624 . 12 1 1 A 59 59 ALA C C 59 175.105 176.860 -1.755 1
1 625 . 12 1 1 A 59 59 ALA CA C 59 50.866 52.151 -1.285 1
1 626 . 12 1 1 A 59 59 ALA CB C 59 17.647 19.084 -1.437 1
1 627 . 12 1 1 A 59 59 ALA N N 59 130.928 130.191 0.737 1
1 628 . 12 1 1 A 60 60 THR H H 60 7.445 7.704 -0.259 1
1 629 . 12 1 1 A 60 60 THR HA H 60 4.642 4.656 -0.014 1
1 634 . 12 1 1 A 60 60 THR C C 60 169.528 174.125 -4.597 1
1 635 . 12 1 1 A 60 60 THR CA C 60 57.101 59.494 -2.393 1
1 636 . 12 1 1 A 60 60 THR CB C 60 67.982 72.176 -4.194 1
1 638 . 12 1 1 A 60 60 THR N N 60 109.256 109.488 -0.232 1
1 639 . 12 1 1 A 61 61 THR H H 61 7.325 8.293 -0.968 1
1 640 . 12 1 1 A 61 61 THR HA H 61 2.896 3.630 -0.734 1
1 645 . 12 1 1 A 61 61 THR C C 61 169.678 172.893 -3.215 1
1 646 . 12 1 1 A 61 61 THR CA C 61 57.246 61.732 -4.486 1
1 647 . 12 1 1 A 61 61 THR CB C 61 63.794 68.741 -4.947 1
1 649 . 12 1 1 A 61 61 THR N N 61 105.670 110.381 -4.711 1
1 650 . 12 1 1 A 62 62 ARG H H 62 6.490 7.145 -0.655 1
1 651 . 12 1 1 A 62 62 ARG HA H 62 4.698 4.553 0.145 1
1 658 . 12 1 1 A 62 62 ARG C C 62 172.881 173.848 -0.967 1
1 659 . 12 1 1 A 62 62 ARG CA C 62 52.276 54.036 -1.760 1
1 660 . 12 1 1 A 62 62 ARG CB C 62 30.774 33.027 -2.253 1
1 663 . 12 1 1 A 62 62 ARG N N 62 117.485 122.226 -4.741 1
1 664 . 12 1 1 A 63 63 TYR H H 63 8.891 8.704 0.187 1
1 665 . 12 1 1 A 63 63 TYR HA H 63 4.356 5.286 -0.930 1
1 672 . 12 1 1 A 63 63 TYR C C 63 170.393 173.949 -3.556 1
1 673 . 12 1 1 A 63 63 TYR CA C 63 57.284 57.221 0.063 1
1 674 . 12 1 1 A 63 63 TYR CB C 63 41.467 42.474 -1.007 1
1 679 . 12 1 1 A 63 63 TYR N N 63 124.712 127.167 -2.455 1
1 680 . 12 1 1 A 64 64 SER H H 64 7.244 8.470 -1.226 1
1 681 . 12 1 1 A 64 64 SER HA H 64 5.077 5.758 -0.681 1
1 684 . 12 1 1 A 64 64 SER C C 64 169.712 173.619 -3.907 1
1 685 . 12 1 1 A 64 64 SER CA C 64 54.181 55.589 -1.408 1
1 686 . 12 1 1 A 64 64 SER CB C 64 61.122 65.719 -4.597 1
1 687 . 12 1 1 A 64 64 SER N N 64 120.593 120.666 -0.073 1
1 688 . 12 1 1 A 65 65 ILE H H 65 8.686 8.838 -0.152 1
1 689 . 12 1 1 A 65 65 ILE HA H 65 3.937 4.927 -0.990 1
1 699 . 12 1 1 A 65 65 ILE C C 65 172.217 175.079 -2.862 1
1 700 . 12 1 1 A 65 65 ILE CA C 65 58.288 59.593 -1.305 1
1 701 . 12 1 1 A 65 65 ILE CB C 65 36.110 40.223 -4.113 1
1 705 . 12 1 1 A 65 65 ILE N N 65 127.792 124.514 3.278 1
1 706 . 12 1 1 A 66 66 GLY H H 66 7.883 8.554 -0.671 1
1 707 . 12 1 1 A 66 66 GLY HA2 H 66 4.799 4.154 0.645 1
1 708 . 12 1 1 A 66 66 GLY HA3 H 66 3.468 4.181 -0.713 1
1 709 . 12 1 1 A 66 66 GLY C C 66 171.983 173.964 -1.981 1
1 710 . 12 1 1 A 66 66 GLY CA C 66 40.534 44.558 -4.024 1
1 711 . 12 1 1 A 66 66 GLY N N 66 112.632 114.334 -1.702 1
1 712 . 12 1 1 A 67 67 GLY H H 67 8.483 8.312 0.171 1
1 713 . 12 1 1 A 67 67 GLY HA2 H 67 3.836 3.984 -0.148 1
1 714 . 12 1 1 A 67 67 GLY HA3 H 67 3.682 3.999 -0.317 1
1 715 . 12 1 1 A 67 67 GLY C C 67 172.954 174.361 -1.407 1
1 716 . 12 1 1 A 67 67 GLY CA C 67 43.568 45.893 -2.325 1
1 717 . 12 1 1 A 67 67 GLY N N 67 104.625 108.894 -4.269 1
1 718 . 12 1 1 A 68 68 LEU H H 68 8.236 7.471 0.765 1
1 719 . 12 1 1 A 68 68 LEU HA H 68 4.154 4.615 -0.461 1
1 729 . 12 1 1 A 68 68 LEU C C 68 173.838 175.753 -1.915 1
1 730 . 12 1 1 A 68 68 LEU CA C 68 51.025 53.492 -2.467 1
1 731 . 12 1 1 A 68 68 LEU CB C 68 38.837 42.716 -3.879 1
1 735 . 12 1 1 A 68 68 LEU N N 68 118.919 122.257 -3.338 1
1 736 . 12 1 1 A 69 69 SER H H 69 8.284 8.823 -0.539 1
1 737 . 12 1 1 A 69 69 SER HA H 69 4.765 5.204 -0.439 1
1 740 . 12 1 1 A 69 69 SER C C 69 170.044 172.790 -2.746 1
1 741 . 12 1 1 A 69 69 SER CA C 69 54.639 54.897 -0.258 1
1 742 . 12 1 1 A 69 69 SER CB C 69 61.216 64.122 -2.906 1
1 743 . 12 1 1 A 69 69 SER N N 69 116.361 116.672 -0.311 1
1 744 . 12 1 1 A 70 70 PRO HA H 70 5.141 4.787 0.354 1
1 751 . 12 1 1 A 70 70 PRO C C 70 174.858 177.516 -2.658 1
1 752 . 12 1 1 A 70 70 PRO CA C 70 60.810 64.016 -3.206 1
1 753 . 12 1 1 A 70 70 PRO CB C 70 30.657 31.756 -1.099 1
1 756 . 12 1 1 A 71 71 PHE H H 71 8.139 9.224 -1.085 1
1 757 . 12 1 1 A 71 71 PHE HA H 71 4.202 4.320 -0.118 1
1 765 . 12 1 1 A 71 71 PHE C C 71 172.870 174.556 -1.686 1
1 766 . 12 1 1 A 71 71 PHE CA C 71 55.410 59.227 -3.817 1
1 767 . 12 1 1 A 71 71 PHE CB C 71 36.027 37.843 -1.816 1
1 773 . 12 1 1 A 71 71 PHE N N 71 125.409 122.947 2.462 1
1 774 . 12 1 1 A 72 72 SER H H 72 8.182 7.276 0.906 1
1 775 . 12 1 1 A 72 72 SER HA H 72 4.755 5.002 -0.247 1
1 778 . 12 1 1 A 72 72 SER C C 72 168.850 172.773 -3.923 1
1 779 . 12 1 1 A 72 72 SER CA C 72 55.926 56.044 -0.118 1
1 780 . 12 1 1 A 72 72 SER CB C 72 64.208 66.597 -2.389 1
1 781 . 12 1 1 A 72 72 SER N N 72 113.509 110.792 2.717 1
1 782 . 12 1 1 A 73 73 GLU H H 73 8.422 8.736 -0.314 1
1 783 . 12 1 1 A 73 73 GLU HA H 73 4.966 5.167 -0.201 1
1 788 . 12 1 1 A 73 73 GLU C C 73 173.192 174.479 -1.287 1
1 789 . 12 1 1 A 73 73 GLU CA C 73 52.815 54.806 -1.991 1
1 790 . 12 1 1 A 73 73 GLU CB C 73 29.416 32.888 -3.472 1
1 792 . 12 1 1 A 73 73 GLU N N 73 123.046 121.617 1.429 1
1 793 . 12 1 1 A 74 74 TYR H H 74 9.205 8.775 0.430 1
1 794 . 12 1 1 A 74 74 TYR HA H 74 4.799 5.066 -0.267 1
1 801 . 12 1 1 A 74 74 TYR C C 74 170.775 174.261 -3.486 1
1 802 . 12 1 1 A 74 74 TYR CA C 74 55.291 56.899 -1.608 1
1 803 . 12 1 1 A 74 74 TYR CB C 74 42.943 42.299 0.644 1
1 808 . 12 1 1 A 74 74 TYR N N 74 125.351 124.719 0.632 1
1 809 . 12 1 1 A 75 75 ALA H H 75 8.639 8.282 0.357 1
1 810 . 12 1 1 A 75 75 ALA HA H 75 5.271 5.094 0.177 1
1 814 . 12 1 1 A 75 75 ALA C C 75 173.698 176.502 -2.804 1
1 815 . 12 1 1 A 75 75 ALA CA C 75 47.904 50.280 -2.376 1
1 816 . 12 1 1 A 75 75 ALA CB C 75 19.634 20.411 -0.777 1
1 817 . 12 1 1 A 75 75 ALA N N 75 121.555 125.455 -3.900 1
1 818 . 12 1 1 A 76 76 PHE H H 76 9.066 9.463 -0.397 1
1 819 . 12 1 1 A 76 76 PHE HA H 76 5.496 5.241 0.255 1
1 827 . 12 1 1 A 76 76 PHE C C 76 172.268 175.255 -2.987 1
1 828 . 12 1 1 A 76 76 PHE CA C 76 54.216 57.268 -3.052 1
1 829 . 12 1 1 A 76 76 PHE CB C 76 41.901 41.523 0.378 1
1 835 . 12 1 1 A 76 76 PHE N N 76 116.545 122.882 -6.337 1
1 836 . 12 1 1 A 77 77 ARG H H 77 9.216 9.116 0.100 1
1 837 . 12 1 1 A 77 77 ARG HA H 77 4.357 5.127 -0.770 1
1 845 . 12 1 1 A 77 77 ARG C C 77 169.998 174.223 -4.225 1
1 846 . 12 1 1 A 77 77 ARG CA C 77 52.414 54.826 -2.412 1
1 847 . 12 1 1 A 77 77 ARG CB C 77 30.794 33.848 -3.054 1
1 850 . 12 1 1 A 77 77 ARG N N 77 115.738 119.074 -3.336 1
1 852 . 12 1 1 A 78 78 VAL H H 78 8.135 8.893 -0.758 1
1 853 . 12 1 1 A 78 78 VAL HA H 78 4.884 4.720 0.164 1
1 861 . 12 1 1 A 78 78 VAL C C 78 171.098 174.924 -3.826 1
1 862 . 12 1 1 A 78 78 VAL CA C 78 57.566 60.932 -3.366 1
1 863 . 12 1 1 A 78 78 VAL CB C 78 33.146 32.576 0.570 1
1 866 . 12 1 1 A 78 78 VAL N N 78 117.942 124.984 -7.042 1
1 867 . 12 1 1 A 79 79 LEU H H 79 9.167 8.450 0.717 1
1 868 . 12 1 1 A 79 79 LEU HA H 79 4.575 4.972 -0.397 1
1 878 . 12 1 1 A 79 79 LEU C C 79 171.447 174.886 -3.439 1
1 879 . 12 1 1 A 79 79 LEU CA C 79 51.642 53.439 -1.797 1
1 880 . 12 1 1 A 79 79 LEU CB C 79 42.776 45.494 -2.718 1
1 884 . 12 1 1 A 79 79 LEU N N 79 123.913 119.305 4.608 1
1 885 . 12 1 1 A 80 80 ALA H H 80 9.325 8.645 0.680 1
1 886 . 12 1 1 A 80 80 ALA HA H 80 4.654 3.580 1.074 1
1 890 . 12 1 1 A 80 80 ALA C C 80 172.070 177.282 -5.212 1
1 891 . 12 1 1 A 80 80 ALA CA C 80 48.169 51.929 -3.760 1
1 892 . 12 1 1 A 80 80 ALA CB C 80 20.366 19.093 1.273 1
1 893 . 12 1 1 A 80 80 ALA N N 80 124.135 125.136 -1.001 1
1 894 . 12 1 1 A 81 81 VAL H H 81 7.953 8.105 -0.152 1
1 895 . 12 1 1 A 81 81 VAL HA H 81 4.293 4.715 -0.422 1
1 903 . 12 1 1 A 81 81 VAL C C 81 172.873 174.153 -1.280 1
1 904 . 12 1 1 A 81 81 VAL CA C 81 58.959 60.160 -1.201 1
1 905 . 12 1 1 A 81 81 VAL CB C 81 31.412 35.118 -3.706 1
1 908 . 12 1 1 A 81 81 VAL N N 81 118.503 120.724 -2.221 1
1 909 . 12 1 1 A 82 82 ASN H H 82 8.262 8.444 -0.182 1
1 910 . 12 1 1 A 82 82 ASN HA H 82 4.945 5.291 -0.346 1
1 915 . 12 1 1 A 82 82 ASN C C 82 173.273 175.208 -1.935 1
1 916 . 12 1 1 A 82 82 ASN CA C 82 48.714 51.804 -3.090 1
1 917 . 12 1 1 A 82 82 ASN CB C 82 36.796 40.145 -3.349 1
1 918 . 12 1 1 A 82 82 ASN N N 82 125.425 123.676 1.749 1
1 920 . 12 1 1 A 83 83 SER HA H 83 3.966 4.054 -0.088 1
1 923 . 12 1 1 A 83 83 SER C C 83 172.812 176.715 -3.903 1
1 924 . 12 1 1 A 83 83 SER CA C 83 59.047 62.500 -3.453 1
1 925 . 12 1 1 A 83 83 SER CB C 83 60.406 62.929 -2.523 1
1 926 . 12 1 1 A 84 84 ILE H H 84 7.803 7.891 -0.088 1
1 927 . 12 1 1 A 84 84 ILE HA H 84 3.862 3.747 0.115 1
1 937 . 12 1 1 A 84 84 ILE C C 84 174.481 176.154 -1.673 1
1 938 . 12 1 1 A 84 84 ILE CA C 84 59.188 64.673 -5.485 1
1 939 . 12 1 1 A 84 84 ILE CB C 84 34.677 38.060 -3.383 1
1 943 . 12 1 1 A 84 84 ILE N N 84 121.222 119.969 1.253 1
1 944 . 12 1 1 A 85 85 GLY H H 85 7.435 7.269 0.166 1
1 945 . 12 1 1 A 85 85 GLY HA2 H 85 4.149 4.046 0.103 1
1 946 . 12 1 1 A 85 85 GLY HA3 H 85 3.747 4.049 -0.302 1
1 947 . 12 1 1 A 85 85 GLY C C 85 168.589 171.918 -3.329 1
1 948 . 12 1 1 A 85 85 GLY CA C 85 42.931 45.409 -2.478 1
1 949 . 12 1 1 A 85 85 GLY N N 85 106.320 105.456 0.864 1
1 950 . 12 1 1 A 86 86 ARG H H 86 8.190 8.379 -0.189 1
1 951 . 12 1 1 A 86 86 ARG HA H 86 4.452 4.578 -0.126 1
1 958 . 12 1 1 A 86 86 ARG C C 86 175.286 176.390 -1.104 1
1 959 . 12 1 1 A 86 86 ARG CA C 86 53.223 55.311 -2.088 1
1 960 . 12 1 1 A 86 86 ARG CB C 86 29.517 31.220 -1.703 1
1 963 . 12 1 1 A 86 86 ARG N N 86 118.339 116.970 1.369 1
1 964 . 12 1 1 A 87 87 GLY H H 87 8.900 8.993 -0.093 1
1 965 . 12 1 1 A 87 87 GLY HA2 H 87 4.211 3.999 0.212 1
1 966 . 12 1 1 A 87 87 GLY HA3 H 87 3.967 4.014 -0.047 1
1 967 . 12 1 1 A 87 87 GLY C C 87 168.101 172.806 -4.705 1
1 968 . 12 1 1 A 87 87 GLY CA C 87 42.281 44.042 -1.761 1
1 969 . 12 1 1 A 87 87 GLY N N 87 113.482 109.001 4.481 1
1 970 . 12 1 1 A 88 88 PRO HA H 88 4.563 4.574 -0.011 1
1 977 . 12 1 1 A 88 88 PRO CA C 88 60.994 62.098 -1.104 1
1 978 . 12 1 1 A 88 88 PRO CB C 88 29.873 31.596 -1.723 1
1 981 . 12 1 1 A 89 89 PRO HA H 89 4.490 4.452 0.038 1
1 987 . 12 1 1 A 89 89 PRO C C 89 174.543 176.693 -2.150 1
1 988 . 12 1 1 A 89 89 PRO CA C 89 59.435 62.584 -3.149 1
1 989 . 12 1 1 A 89 89 PRO CB C 89 29.805 31.915 -2.110 1
1 992 . 12 1 1 A 90 90 SER H H 90 8.808 8.858 -0.050 1
1 993 . 12 1 1 A 90 90 SER HA H 90 4.202 4.453 -0.251 1
1 996 . 12 1 1 A 90 90 SER C C 90 171.870 173.946 -2.076 1
1 997 . 12 1 1 A 90 90 SER CA C 90 55.868 58.297 -2.429 1
1 998 . 12 1 1 A 90 90 SER CB C 90 64.504 63.747 0.757 1
1 999 . 12 1 1 A 90 90 SER N N 90 113.781 117.474 -3.693 1
1 1000 . 12 1 1 A 91 91 GLU H H 91 8.291 8.548 -0.257 1
1 1001 . 12 1 1 A 91 91 GLU HA H 91 4.131 4.176 -0.045 1
1 1006 . 12 1 1 A 91 91 GLU C C 91 174.882 176.471 -1.589 1
1 1007 . 12 1 1 A 91 91 GLU CA C 91 54.984 56.601 -1.617 1
1 1008 . 12 1 1 A 91 91 GLU CB C 91 27.643 29.108 -1.465 1
1 1010 . 12 1 1 A 91 91 GLU N N 91 117.930 123.721 -5.791 1
1 1011 . 12 1 1 A 92 92 ALA H H 92 8.605 8.276 0.329 1
1 1012 . 12 1 1 A 92 92 ALA HA H 92 5.068 4.513 0.555 1
1 1016 . 12 1 1 A 92 92 ALA C C 92 176.227 177.907 -1.680 1
1 1017 . 12 1 1 A 92 92 ALA CA C 92 48.997 53.046 -4.049 1
1 1018 . 12 1 1 A 92 92 ALA CB C 92 17.756 19.155 -1.399 1
1 1019 . 12 1 1 A 92 92 ALA N N 92 126.421 127.579 -1.158 1
1 1020 . 12 1 1 A 93 93 VAL H H 93 9.051 9.363 -0.312 1
1 1021 . 12 1 1 A 93 93 VAL HA H 93 4.642 4.965 -0.323 1
1 1029 . 12 1 1 A 93 93 VAL C C 93 172.010 174.246 -2.236 1
1 1030 . 12 1 1 A 93 93 VAL CA C 93 57.495 59.202 -1.707 1
1 1031 . 12 1 1 A 93 93 VAL CB C 93 32.774 34.881 -2.107 1
1 1034 . 12 1 1 A 93 93 VAL N N 93 117.322 117.565 -0.243 1
1 1035 . 12 1 1 A 94 94 ARG H H 94 8.470 8.856 -0.386 1
1 1036 . 12 1 1 A 94 94 ARG HA H 94 5.692 5.141 0.551 1
1 1043 . 12 1 1 A 94 94 ARG C C 94 173.635 175.530 -1.895 1
1 1044 . 12 1 1 A 94 94 ARG CA C 94 52.038 54.710 -2.672 1
1 1045 . 12 1 1 A 94 94 ARG CB C 94 30.966 31.802 -0.836 1
1 1048 . 12 1 1 A 94 94 ARG N N 94 122.258 123.115 -0.857 1
1 1049 . 12 1 1 A 95 95 ALA H H 95 9.051 9.017 0.034 1
1 1050 . 12 1 1 A 95 95 ALA HA H 95 4.642 5.251 -0.609 1
1 1054 . 12 1 1 A 95 95 ALA C C 95 172.285 175.135 -2.850 1
1 1055 . 12 1 1 A 95 95 ALA CA C 95 49.191 50.944 -1.753 1
1 1056 . 12 1 1 A 95 95 ALA CB C 95 22.562 22.715 -0.153 1
1 1057 . 12 1 1 A 95 95 ALA N N 95 121.931 126.260 -4.329 1
1 1058 . 12 1 1 A 96 96 ARG H H 96 8.550 8.775 -0.225 1
1 1059 . 12 1 1 A 96 96 ARG HA H 96 5.407 5.147 0.260 1
1 1066 . 12 1 1 A 96 96 ARG C C 96 174.547 176.130 -1.583 1
1 1067 . 12 1 1 A 96 96 ARG CA C 96 51.439 55.025 -3.586 1
1 1068 . 12 1 1 A 96 96 ARG CB C 96 30.708 31.810 -1.102 1
1 1071 . 12 1 1 A 96 96 ARG N N 96 121.155 124.016 -2.861 1
1 1072 . 12 1 1 A 97 97 THR H H 97 8.797 8.784 0.013 1
1 1073 . 12 1 1 A 97 97 THR HA H 97 4.116 4.634 -0.518 1
1 1078 . 12 1 1 A 97 97 THR C C 97 173.577 175.216 -1.639 1
1 1079 . 12 1 1 A 97 97 THR CA C 97 58.800 61.001 -2.201 1
1 1080 . 12 1 1 A 97 97 THR CB C 97 67.461 69.629 -2.168 1
1 1082 . 12 1 1 A 97 97 THR N N 97 114.657 117.266 -2.609 1
1 1083 . 12 1 1 A 98 98 GLY H H 98 7.505 8.534 -1.029 1
1 1084 . 12 1 1 A 98 98 GLY HA2 H 98 3.866 4.077 -0.211 1
1 1085 . 12 1 1 A 98 98 GLY HA3 H 98 3.743 4.125 -0.382 1
1 1086 . 12 1 1 A 98 98 GLY C C 98 170.637 173.401 -2.764 1
1 1087 . 12 1 1 A 98 98 GLY CA C 98 42.332 45.037 -2.705 1
1 1088 . 12 1 1 A 98 98 GLY N N 98 106.172 108.451 -2.279 1
1 1089 . 12 1 1 A 99 99 GLU H H 99 8.145 8.339 -0.194 1
1 1090 . 12 1 1 A 99 99 GLU HA H 99 4.210 4.716 -0.506 1
1 1095 . 12 1 1 A 99 99 GLU C C 99 174.134 175.197 -1.063 1
1 1096 . 12 1 1 A 99 99 GLU CA C 99 53.828 55.217 -1.389 1
1 1097 . 12 1 1 A 99 99 GLU CB C 99 28.774 31.005 -2.231 1
1 1099 . 12 1 1 A 99 99 GLU N N 99 117.634 118.175 -0.541 1
1 1100 . 12 1 1 A 100 100 GLN H H 100 8.647 8.530 0.117 1
1 1101 . 12 1 1 A 100 100 GLN HA H 100 4.247 4.741 -0.494 1
1 1108 . 12 1 1 A 100 100 GLN C C 100 173.348 174.044 -0.696 1
1 1109 . 12 1 1 A 100 100 GLN CA C 100 53.634 54.876 -1.242 1
1 1110 . 12 1 1 A 100 100 GLN CB C 100 27.392 32.537 -5.145 1
1 1112 . 12 1 1 A 100 100 GLN N N 100 121.960 119.837 2.123 1
1 1114 . 12 1 1 A 101 101 SER H H 101 8.416 8.535 -0.119 1
1 1115 . 12 1 1 A 101 101 SER HA H 101 4.418 4.748 -0.330 1
1 1117 . 12 1 1 A 101 101 SER C C 101 172.148 175.087 -2.939 1
1 1118 . 12 1 1 A 101 101 SER CA C 101 55.926 57.856 -1.930 1
1 1119 . 12 1 1 A 101 101 SER CB C 101 61.617 63.631 -2.014 1
1 1120 . 12 1 1 A 101 101 SER N N 101 118.609 117.289 1.320 1
1 1121 . 12 1 1 A 102 102 GLY H H 102 8.233 8.370 -0.137 1
1 1122 . 12 1 1 A 102 102 GLY HA2 H 102 4.080 3.817 0.263 1
1 1123 . 12 1 1 A 102 102 GLY HA3 H 102 3.981 3.823 0.158 1
1 1124 . 12 1 1 A 102 102 GLY C C 102 169.461 174.515 -5.054 1
1 1125 . 12 1 1 A 102 102 GLY CA C 102 42.332 47.226 -4.894 1
1 1126 . 12 1 1 A 102 102 GLY N N 102 110.483 110.194 0.289 1
1 1127 . 12 1 1 A 103 103 PRO HA H 103 4.618 4.697 -0.079 1
1 1134 . 12 1 1 A 103 103 PRO CA C 103 57.843 62.302 -4.459 1
1 1135 . 12 1 1 A 103 103 PRO CB C 103 28.671 29.468 -0.797 1
1 1 . 13 1 1 A 6 6 SER HA H 6 4.492 4.852 -0.360 1
1 4 . 13 1 1 A 6 6 SER CA C 6 55.621 57.354 -1.733 1
1 5 . 13 1 1 A 6 6 SER CB C 6 62.104 64.611 -2.507 1
1 6 . 13 1 1 A 7 7 GLY H H 7 8.244 8.683 -0.439 1
1 7 . 13 1 1 A 7 7 GLY HA2 H 7 3.873 4.041 -0.168 1
1 8 . 13 1 1 A 7 7 GLY HA3 H 7 3.737 4.049 -0.312 1
1 9 . 13 1 1 A 7 7 GLY CA C 7 41.743 44.566 -2.823 1
1 10 . 13 1 1 A 7 7 GLY N N 7 109.193 113.864 -4.671 1
1 11 . 13 1 1 A 8 8 PRO HA H 8 4.286 4.554 -0.268 1
1 18 . 13 1 1 A 8 8 PRO C C 8 173.841 175.457 -1.616 1
1 19 . 13 1 1 A 8 8 PRO CA C 8 60.528 62.465 -1.937 1
1 20 . 13 1 1 A 8 8 PRO CB C 8 30.299 32.829 -2.530 1
1 23 . 13 1 1 A 9 9 LYS H H 9 8.877 8.312 0.565 1
1 24 . 13 1 1 A 9 9 LYS HA H 9 4.360 4.809 -0.449 1
1 33 . 13 1 1 A 9 9 LYS C C 9 173.492 174.128 -0.636 1
1 34 . 13 1 1 A 9 9 LYS CA C 9 52.135 52.988 -0.853 1
1 35 . 13 1 1 A 9 9 LYS CB C 9 28.798 33.383 -4.585 1
1 39 . 13 1 1 A 9 9 LYS N N 9 120.404 120.232 0.172 1
1 40 . 13 1 1 A 10 10 PRO HA H 10 4.284 4.638 -0.354 1
1 47 . 13 1 1 A 10 10 PRO CA C 10 59.326 61.632 -2.306 1
1 48 . 13 1 1 A 10 10 PRO CB C 10 28.825 31.555 -2.730 1
1 51 . 13 1 1 A 11 11 PRO HA H 11 4.468 4.780 -0.312 1
1 58 . 13 1 1 A 11 11 PRO C C 11 171.993 176.434 -4.441 1
1 59 . 13 1 1 A 11 11 PRO CA C 11 60.422 62.620 -2.198 1
1 60 . 13 1 1 A 11 11 PRO CB C 11 30.418 32.671 -2.253 1
1 63 . 13 1 1 A 12 12 ILE H H 12 7.554 7.992 -0.438 1
1 64 . 13 1 1 A 12 12 ILE HA H 12 4.676 4.672 0.004 1
1 74 . 13 1 1 A 12 12 ILE C C 12 171.721 175.134 -3.413 1
1 75 . 13 1 1 A 12 12 ILE CA C 12 56.843 58.991 -2.148 1
1 76 . 13 1 1 A 12 12 ILE CB C 12 40.560 40.996 -0.436 1
1 80 . 13 1 1 A 12 12 ILE N N 12 109.695 116.646 -6.951 1
1 81 . 13 1 1 A 13 13 ASP H H 13 8.435 9.046 -0.611 1
1 82 . 13 1 1 A 13 13 ASP HA H 13 4.094 4.248 -0.154 1
1 85 . 13 1 1 A 13 13 ASP C C 13 171.803 176.186 -4.383 1
1 86 . 13 1 1 A 13 13 ASP CA C 13 52.610 54.976 -2.366 1
1 87 . 13 1 1 A 13 13 ASP CB C 13 36.357 39.852 -3.495 1
1 88 . 13 1 1 A 13 13 ASP N N 13 116.219 122.140 -5.921 1
1 89 . 13 1 1 A 14 14 LEU H H 14 7.483 8.013 -0.530 1
1 90 . 13 1 1 A 14 14 LEU HA H 14 4.990 4.897 0.093 1
1 100 . 13 1 1 A 14 14 LEU C C 14 174.702 175.326 -0.624 1
1 101 . 13 1 1 A 14 14 LEU CA C 14 53.811 55.035 -1.224 1
1 102 . 13 1 1 A 14 14 LEU CB C 14 40.148 42.416 -2.268 1
1 106 . 13 1 1 A 14 14 LEU N N 14 118.463 121.048 -2.585 1
1 107 . 13 1 1 A 15 15 VAL H H 15 9.209 8.458 0.751 1
1 108 . 13 1 1 A 15 15 VAL HA H 15 4.250 4.785 -0.535 1
1 116 . 13 1 1 A 15 15 VAL C C 15 172.080 173.611 -1.531 1
1 117 . 13 1 1 A 15 15 VAL CA C 15 58.570 60.536 -1.966 1
1 118 . 13 1 1 A 15 15 VAL CB C 15 34.146 36.143 -1.997 1
1 121 . 13 1 1 A 15 15 VAL N N 15 124.833 127.125 -2.292 1
1 122 . 13 1 1 A 16 16 VAL H H 16 8.390 8.728 -0.338 1
1 123 . 13 1 1 A 16 16 VAL HA H 16 4.343 4.790 -0.447 1
1 131 . 13 1 1 A 16 16 VAL C C 16 174.672 176.183 -1.511 1
1 132 . 13 1 1 A 16 16 VAL CA C 16 59.188 60.131 -0.943 1
1 133 . 13 1 1 A 16 16 VAL CB C 16 29.187 33.663 -4.476 1
1 136 . 13 1 1 A 16 16 VAL N N 16 124.654 126.013 -1.359 1
1 137 . 13 1 1 A 17 17 THR H H 17 8.638 8.502 0.136 1
1 138 . 13 1 1 A 17 17 THR HA H 17 4.195 4.342 -0.147 1
1 143 . 13 1 1 A 17 17 THR C C 17 172.661 173.849 -1.188 1
1 144 . 13 1 1 A 17 17 THR CA C 17 60.318 64.316 -3.998 1
1 145 . 13 1 1 A 17 17 THR CB C 17 66.420 70.262 -3.842 1
1 147 . 13 1 1 A 17 17 THR N N 17 120.942 123.347 -2.405 1
1 148 . 13 1 1 A 18 18 GLU H H 18 7.361 7.655 -0.294 1
1 149 . 13 1 1 A 18 18 GLU HA H 18 4.497 4.757 -0.260 1
1 154 . 13 1 1 A 18 18 GLU C C 18 171.691 175.068 -3.377 1
1 155 . 13 1 1 A 18 18 GLU CA C 18 53.687 54.890 -1.203 1
1 156 . 13 1 1 A 18 18 GLU CB C 18 30.802 33.512 -2.710 1
1 158 . 13 1 1 A 18 18 GLU N N 18 119.088 118.481 0.607 1
1 159 . 13 1 1 A 19 19 THR H H 19 8.164 8.679 -0.515 1
1 160 . 13 1 1 A 19 19 THR HA H 19 4.912 5.034 -0.122 1
1 165 . 13 1 1 A 19 19 THR C C 19 171.606 172.863 -1.257 1
1 166 . 13 1 1 A 19 19 THR CA C 19 58.473 60.635 -2.162 1
1 167 . 13 1 1 A 19 19 THR CB C 19 70.103 71.043 -0.940 1
1 169 . 13 1 1 A 19 19 THR N N 19 112.424 113.712 -1.288 1
1 170 . 13 1 1 A 20 20 THR H H 20 8.750 8.966 -0.216 1
1 171 . 13 1 1 A 20 20 THR HA H 20 4.710 4.820 -0.110 1
1 176 . 13 1 1 A 20 20 THR C C 20 172.785 175.922 -3.137 1
1 177 . 13 1 1 A 20 20 THR CA C 20 58.059 61.181 -3.122 1
1 178 . 13 1 1 A 20 20 THR CB C 20 68.782 70.979 -2.197 1
1 180 . 13 1 1 A 20 20 THR N N 20 113.438 121.410 -7.972 1
1 181 . 13 1 1 A 21 21 ALA H H 21 8.453 8.937 -0.484 1
1 182 . 13 1 1 A 21 21 ALA HA H 21 4.079 4.488 -0.409 1
1 186 . 13 1 1 A 21 21 ALA C C 21 174.130 177.858 -3.728 1
1 187 . 13 1 1 A 21 21 ALA CA C 21 52.680 54.908 -2.228 1
1 188 . 13 1 1 A 21 21 ALA CB C 21 16.893 18.593 -1.700 1
1 189 . 13 1 1 A 21 21 ALA N N 21 120.078 125.700 -5.622 1
1 190 . 13 1 1 A 22 22 THR H H 22 7.132 7.538 -0.406 1
1 191 . 13 1 1 A 22 22 THR HA H 22 4.433 4.732 -0.299 1
1 196 . 13 1 1 A 22 22 THR C C 22 171.434 173.466 -2.032 1
1 197 . 13 1 1 A 22 22 THR CA C 22 56.836 60.463 -3.627 1
1 198 . 13 1 1 A 22 22 THR CB C 22 68.772 69.567 -0.795 1
1 200 . 13 1 1 A 22 22 THR N N 22 95.772 104.074 -8.302 1
1 201 . 13 1 1 A 23 23 SER H H 23 7.326 7.720 -0.394 1
1 202 . 13 1 1 A 23 23 SER HA H 23 5.562 5.361 0.201 1
1 205 . 13 1 1 A 23 23 SER C C 23 169.267 172.117 -2.850 1
1 206 . 13 1 1 A 23 23 SER CA C 23 54.445 57.707 -3.262 1
1 207 . 13 1 1 A 23 23 SER CB C 23 65.905 67.655 -1.750 1
1 208 . 13 1 1 A 23 23 SER N N 23 115.757 116.001 -0.244 1
1 209 . 13 1 1 A 24 24 VAL H H 24 7.983 8.342 -0.359 1
1 210 . 13 1 1 A 24 24 VAL HA H 24 4.334 4.485 -0.151 1
1 218 . 13 1 1 A 24 24 VAL C C 24 171.917 173.452 -1.535 1
1 219 . 13 1 1 A 24 24 VAL CA C 24 58.642 60.318 -1.676 1
1 220 . 13 1 1 A 24 24 VAL CB C 24 34.254 34.790 -0.536 1
1 223 . 13 1 1 A 24 24 VAL N N 24 116.595 120.663 -4.068 1
1 224 . 13 1 1 A 25 25 THR H H 25 8.636 8.966 -0.330 1
1 225 . 13 1 1 A 25 25 THR HA H 25 4.833 4.843 -0.010 1
1 230 . 13 1 1 A 25 25 THR C C 25 169.721 172.682 -2.961 1
1 231 . 13 1 1 A 25 25 THR CA C 25 59.699 61.897 -2.198 1
1 232 . 13 1 1 A 25 25 THR CB C 25 67.303 69.818 -2.515 1
1 234 . 13 1 1 A 25 25 THR N N 25 121.690 122.681 -0.991 1
1 235 . 13 1 1 A 26 26 LEU H H 26 8.629 9.362 -0.733 1
1 236 . 13 1 1 A 26 26 LEU HA H 26 5.315 5.260 0.055 1
1 246 . 13 1 1 A 26 26 LEU C C 26 173.182 175.528 -2.346 1
1 247 . 13 1 1 A 26 26 LEU CA C 26 50.643 53.254 -2.611 1
1 248 . 13 1 1 A 26 26 LEU CB C 26 43.976 45.264 -1.288 1
1 252 . 13 1 1 A 26 26 LEU N N 26 126.843 129.813 -2.970 1
1 253 . 13 1 1 A 27 27 THR H H 27 8.704 9.337 -0.633 1
1 254 . 13 1 1 A 27 27 THR HA H 27 4.822 5.208 -0.386 1
1 259 . 13 1 1 A 27 27 THR C C 27 169.840 173.148 -3.308 1
1 260 . 13 1 1 A 27 27 THR CA C 27 58.077 59.167 -1.090 1
1 261 . 13 1 1 A 27 27 THR CB C 27 69.666 72.211 -2.545 1
1 263 . 13 1 1 A 27 27 THR N N 27 111.513 115.641 -4.128 1
1 264 . 13 1 1 A 28 28 TRP H H 28 7.339 8.313 -0.974 1
1 265 . 13 1 1 A 28 28 TRP HA H 28 4.963 5.451 -0.488 1
1 274 . 13 1 1 A 28 28 TRP C C 28 170.637 172.297 -1.660 1
1 275 . 13 1 1 A 28 28 TRP CA C 28 54.438 55.779 -1.341 1
1 276 . 13 1 1 A 28 28 TRP CB C 28 27.497 30.844 -3.347 1
1 282 . 13 1 1 A 28 28 TRP N N 28 117.895 118.074 -0.179 1
1 284 . 13 1 1 A 29 29 ASP H H 29 8.696 9.342 -0.646 1
1 285 . 13 1 1 A 29 29 ASP HA H 29 4.971 5.033 -0.062 1
1 288 . 13 1 1 A 29 29 ASP C C 29 174.901 177.003 -2.102 1
1 289 . 13 1 1 A 29 29 ASP CA C 29 50.178 52.662 -2.484 1
1 290 . 13 1 1 A 29 29 ASP CB C 29 42.291 43.109 -0.818 1
1 291 . 13 1 1 A 29 29 ASP N N 29 117.477 121.873 -4.396 1
1 292 . 13 1 1 A 30 30 SER H H 30 8.800 8.912 -0.112 1
1 293 . 13 1 1 A 30 30 SER HA H 30 4.389 4.112 0.277 1
1 296 . 13 1 1 A 30 30 SER C C 30 174.032 175.054 -1.022 1
1 297 . 13 1 1 A 30 30 SER CA C 30 58.694 61.743 -3.049 1
1 298 . 13 1 1 A 30 30 SER CB C 30 62.428 63.550 -1.122 1
1 299 . 13 1 1 A 30 30 SER N N 30 118.275 120.129 -1.854 1
1 300 . 13 1 1 A 31 31 GLY H H 31 8.759 8.028 0.731 1
1 301 . 13 1 1 A 31 31 GLY HA2 H 31 4.239 4.018 0.221 1
1 302 . 13 1 1 A 31 31 GLY HA3 H 31 3.555 4.050 -0.495 1
1 303 . 13 1 1 A 31 31 GLY C C 31 171.325 173.917 -2.592 1
1 304 . 13 1 1 A 31 31 GLY CA C 31 43.637 45.494 -1.857 1
1 305 . 13 1 1 A 31 31 GLY N N 31 107.961 109.995 -2.034 1
1 306 . 13 1 1 A 32 32 ASN H H 32 8.173 8.074 0.099 1
1 307 . 13 1 1 A 32 32 ASN HA H 32 4.749 5.082 -0.333 1
1 312 . 13 1 1 A 32 32 ASN C C 32 171.355 174.997 -3.642 1
1 313 . 13 1 1 A 32 32 ASN CA C 32 50.795 52.632 -1.837 1
1 314 . 13 1 1 A 32 32 ASN CB C 32 41.508 39.886 1.622 1
1 315 . 13 1 1 A 32 32 ASN N N 32 117.781 119.534 -1.753 1
1 317 . 13 1 1 A 33 33 SER HA H 33 4.291 4.514 -0.223 1
1 320 . 13 1 1 A 33 33 SER C C 33 172.449 174.217 -1.768 1
1 321 . 13 1 1 A 33 33 SER CA C 33 56.733 59.301 -2.568 1
1 322 . 13 1 1 A 33 33 SER CB C 33 60.884 64.432 -3.548 1
1 323 . 13 1 1 A 34 34 GLU H H 34 7.731 7.637 0.094 1
1 324 . 13 1 1 A 34 34 GLU HA H 34 4.556 4.554 0.002 1
1 329 . 13 1 1 A 34 34 GLU C C 34 171.792 174.826 -3.034 1
1 330 . 13 1 1 A 34 34 GLU CA C 34 51.818 54.863 -3.045 1
1 331 . 13 1 1 A 34 34 GLU CB C 34 26.891 28.907 -2.016 1
1 333 . 13 1 1 A 34 34 GLU N N 34 122.319 121.025 1.294 1
1 334 . 13 1 1 A 35 35 PRO HA H 35 4.165 4.761 -0.596 1
1 341 . 13 1 1 A 35 35 PRO C C 35 174.288 176.765 -2.477 1
1 342 . 13 1 1 A 35 35 PRO CA C 35 61.374 62.374 -1.000 1
1 343 . 13 1 1 A 35 35 PRO CB C 35 29.887 29.713 0.174 1
1 346 . 13 1 1 A 36 36 VAL H H 36 8.348 8.028 0.320 1
1 347 . 13 1 1 A 36 36 VAL HA H 36 3.899 4.213 -0.314 1
1 355 . 13 1 1 A 36 36 VAL C C 36 173.344 176.605 -3.261 1
1 356 . 13 1 1 A 36 36 VAL CA C 36 59.014 62.989 -3.975 1
1 357 . 13 1 1 A 36 36 VAL CB C 36 31.865 31.875 -0.010 1
1 360 . 13 1 1 A 36 36 VAL N N 36 122.051 123.477 -1.426 1
1 361 . 13 1 1 A 37 37 THR H H 37 8.780 8.676 0.104 1
1 362 . 13 1 1 A 37 37 THR HA H 37 3.923 4.309 -0.386 1
1 367 . 13 1 1 A 37 37 THR C C 37 172.171 174.656 -2.485 1
1 368 . 13 1 1 A 37 37 THR CA C 37 63.155 64.107 -0.952 1
1 369 . 13 1 1 A 37 37 THR CB C 37 65.941 69.488 -3.547 1
1 371 . 13 1 1 A 37 37 THR N N 37 122.351 118.986 3.365 1
1 372 . 13 1 1 A 38 38 TYR H H 38 7.304 7.620 -0.316 1
1 373 . 13 1 1 A 38 38 TYR HA H 38 4.439 5.070 -0.631 1
1 380 . 13 1 1 A 38 38 TYR C C 38 168.385 172.624 -4.239 1
1 381 . 13 1 1 A 38 38 TYR CA C 38 54.101 56.562 -2.461 1
1 382 . 13 1 1 A 38 38 TYR CB C 38 35.874 39.919 -4.045 1
1 387 . 13 1 1 A 38 38 TYR N N 38 113.984 115.298 -1.314 1
1 388 . 13 1 1 A 39 39 TYR H H 39 9.445 9.153 0.292 1
1 389 . 13 1 1 A 39 39 TYR HA H 39 5.293 5.354 -0.061 1
1 396 . 13 1 1 A 39 39 TYR C C 39 172.781 175.803 -3.022 1
1 397 . 13 1 1 A 39 39 TYR CA C 39 54.322 55.668 -1.346 1
1 398 . 13 1 1 A 39 39 TYR CB C 39 39.035 40.964 -1.929 1
1 401 . 13 1 1 A 39 39 TYR N N 39 115.092 119.070 -3.978 1
1 402 . 13 1 1 A 40 40 GLY H H 40 8.870 8.601 0.269 1
1 403 . 13 1 1 A 40 40 GLY HA2 H 40 5.137 4.136 1.001 1
1 404 . 13 1 1 A 40 40 GLY HA3 H 40 3.285 4.192 -0.907 1
1 405 . 13 1 1 A 40 40 GLY C C 40 169.688 172.771 -3.083 1
1 406 . 13 1 1 A 40 40 GLY CA C 40 41.415 44.684 -3.269 1
1 407 . 13 1 1 A 40 40 GLY N N 40 106.573 111.919 -5.346 1
1 408 . 13 1 1 A 41 41 ILE H H 41 8.917 8.364 0.553 1
1 409 . 13 1 1 A 41 41 ILE HA H 41 4.527 4.920 -0.393 1
1 419 . 13 1 1 A 41 41 ILE C C 41 172.692 174.564 -1.872 1
1 420 . 13 1 1 A 41 41 ILE CA C 41 57.597 60.127 -2.530 1
1 421 . 13 1 1 A 41 41 ILE CB C 41 37.840 40.872 -3.032 1
1 425 . 13 1 1 A 41 41 ILE N N 41 121.746 121.782 -0.036 1
1 426 . 13 1 1 A 42 42 GLN H H 42 9.063 8.870 0.193 1
1 427 . 13 1 1 A 42 42 GLN HA H 42 5.655 5.582 0.073 1
1 434 . 13 1 1 A 42 42 GLN C C 42 172.841 174.640 -1.799 1
1 435 . 13 1 1 A 42 42 GLN CA C 42 50.789 54.232 -3.443 1
1 436 . 13 1 1 A 42 42 GLN CB C 42 28.898 31.910 -3.012 1
1 438 . 13 1 1 A 42 42 GLN N N 42 125.141 125.895 -0.754 1
1 440 . 13 1 1 A 43 43 TYR H H 43 9.066 8.810 0.256 1
1 441 . 13 1 1 A 43 43 TYR HA H 43 5.922 5.856 0.066 1
1 448 . 13 1 1 A 43 43 TYR C C 43 171.219 172.890 -1.671 1
1 449 . 13 1 1 A 43 43 TYR CA C 43 53.349 56.422 -3.073 1
1 450 . 13 1 1 A 43 43 TYR CB C 43 41.074 41.701 -0.627 1
1 455 . 13 1 1 A 43 43 TYR N N 43 118.018 119.467 -1.449 1
1 456 . 13 1 1 A 44 44 ARG H H 44 8.400 8.778 -0.378 1
1 457 . 13 1 1 A 44 44 ARG HA H 44 4.542 4.616 -0.074 1
1 464 . 13 1 1 A 44 44 ARG C C 44 171.974 174.427 -2.453 1
1 465 . 13 1 1 A 44 44 ARG CA C 44 52.453 54.608 -2.155 1
1 466 . 13 1 1 A 44 44 ARG CB C 44 31.125 33.180 -2.055 1
1 469 . 13 1 1 A 44 44 ARG N N 44 115.214 121.001 -5.787 1
1 470 . 13 1 1 A 45 45 ALA H H 45 8.846 8.414 0.432 1
1 471 . 13 1 1 A 45 45 ALA HA H 45 3.894 2.479 1.415 1
1 475 . 13 1 1 A 45 45 ALA C C 45 175.721 176.940 -1.219 1
1 476 . 13 1 1 A 45 45 ALA CA C 45 50.372 52.258 -1.886 1
1 477 . 13 1 1 A 45 45 ALA CB C 45 15.732 18.788 -3.056 1
1 478 . 13 1 1 A 45 45 ALA N N 45 126.463 127.357 -0.894 1
1 479 . 13 1 1 A 46 46 ALA H H 46 8.282 8.147 0.135 1
1 480 . 13 1 1 A 46 46 ALA HA H 46 3.922 4.197 -0.275 1
1 484 . 13 1 1 A 46 46 ALA C C 46 176.236 177.643 -1.407 1
1 485 . 13 1 1 A 46 46 ALA CA C 46 50.773 51.925 -1.152 1
1 486 . 13 1 1 A 46 46 ALA CB C 46 16.244 17.699 -1.455 1
1 487 . 13 1 1 A 46 46 ALA N N 46 126.301 124.533 1.768 1
1 488 . 13 1 1 A 47 47 GLY HA2 H 47 3.882 3.920 -0.038 1
1 489 . 13 1 1 A 47 47 GLY HA3 H 47 3.695 3.947 -0.252 1
1 490 . 13 1 1 A 47 47 GLY C C 47 171.795 174.771 -2.976 1
1 491 . 13 1 1 A 47 47 GLY CA C 47 43.327 45.372 -2.045 1
1 492 . 13 1 1 A 48 48 THR H H 48 7.145 7.624 -0.479 1
1 493 . 13 1 1 A 48 48 THR HA H 48 4.417 4.203 0.214 1
1 498 . 13 1 1 A 48 48 THR C C 48 171.325 174.305 -2.980 1
1 499 . 13 1 1 A 48 48 THR CA C 48 58.271 62.959 -4.688 1
1 500 . 13 1 1 A 48 48 THR CB C 48 68.846 69.612 -0.766 1
1 502 . 13 1 1 A 48 48 THR N N 48 110.190 115.191 -5.001 1
1 503 . 13 1 1 A 49 49 GLU H H 49 8.346 8.611 -0.265 1
1 504 . 13 1 1 A 49 49 GLU HA H 49 4.277 4.614 -0.337 1
1 509 . 13 1 1 A 49 49 GLU C C 49 174.109 175.913 -1.804 1
1 510 . 13 1 1 A 49 49 GLU CA C 49 52.909 56.074 -3.165 1
1 511 . 13 1 1 A 49 49 GLU CB C 49 27.845 28.463 -0.618 1
1 513 . 13 1 1 A 49 49 GLU N N 49 119.985 126.025 -6.040 1
1 514 . 13 1 1 A 50 50 GLY H H 50 7.617 8.350 -0.733 1
1 515 . 13 1 1 A 50 50 GLY HA2 H 50 3.935 4.151 -0.216 1
1 516 . 13 1 1 A 50 50 GLY HA3 H 50 3.935 4.200 -0.265 1
1 517 . 13 1 1 A 50 50 GLY C C 50 168.223 172.544 -4.321 1
1 518 . 13 1 1 A 50 50 GLY CA C 50 42.121 44.251 -2.130 1
1 519 . 13 1 1 A 50 50 GLY N N 50 108.670 111.222 -2.552 1
1 520 . 13 1 1 A 51 51 PRO HA H 51 4.298 4.711 -0.413 1
1 527 . 13 1 1 A 51 51 PRO C C 51 175.067 177.139 -2.072 1
1 528 . 13 1 1 A 51 51 PRO CA C 51 60.175 63.050 -2.875 1
1 529 . 13 1 1 A 51 51 PRO CB C 51 30.052 31.890 -1.838 1
1 532 . 13 1 1 A 52 52 PHE H H 52 8.442 8.645 -0.203 1
1 533 . 13 1 1 A 52 52 PHE HA H 52 3.981 4.664 -0.683 1
1 541 . 13 1 1 A 52 52 PHE C C 52 175.141 175.832 -0.691 1
1 542 . 13 1 1 A 52 52 PHE CA C 52 56.808 57.824 -1.016 1
1 543 . 13 1 1 A 52 52 PHE CB C 52 36.830 39.549 -2.719 1
1 549 . 13 1 1 A 52 52 PHE N N 52 118.707 123.089 -4.382 1
1 550 . 13 1 1 A 53 53 GLN H H 53 8.778 8.148 0.630 1
1 551 . 13 1 1 A 53 53 GLN HA H 53 4.149 4.344 -0.195 1
1 558 . 13 1 1 A 53 53 GLN C C 53 172.773 174.895 -2.122 1
1 559 . 13 1 1 A 53 53 GLN CA C 53 52.999 56.386 -3.387 1
1 560 . 13 1 1 A 53 53 GLN CB C 53 26.962 29.077 -2.115 1
1 562 . 13 1 1 A 53 53 GLN N N 53 122.164 121.680 0.484 1
1 564 . 13 1 1 A 54 54 GLU H H 54 8.432 8.667 -0.235 1
1 565 . 13 1 1 A 54 54 GLU HA H 54 5.533 5.164 0.369 1
1 570 . 13 1 1 A 54 54 GLU C C 54 173.930 174.491 -0.561 1
1 571 . 13 1 1 A 54 54 GLU CA C 54 52.981 55.133 -2.152 1
1 572 . 13 1 1 A 54 54 GLU CB C 54 31.712 33.339 -1.627 1
1 574 . 13 1 1 A 54 54 GLU N N 54 119.688 122.454 -2.766 1
1 575 . 13 1 1 A 55 55 VAL H H 55 9.077 9.167 -0.090 1
1 576 . 13 1 1 A 55 55 VAL HA H 55 4.180 4.870 -0.690 1
1 584 . 13 1 1 A 55 55 VAL C C 55 171.811 174.657 -2.846 1
1 585 . 13 1 1 A 55 55 VAL CA C 55 59.664 61.427 -1.763 1
1 586 . 13 1 1 A 55 55 VAL CB C 55 31.827 33.458 -1.631 1
1 589 . 13 1 1 A 55 55 VAL N N 55 125.328 127.017 -1.689 1
1 590 . 13 1 1 A 56 56 ASP H H 56 8.639 8.739 -0.100 1
1 591 . 13 1 1 A 56 56 ASP HA H 56 5.250 5.525 -0.275 1
1 594 . 13 1 1 A 56 56 ASP C C 56 174.252 176.044 -1.792 1
1 595 . 13 1 1 A 56 56 ASP CA C 56 50.108 52.296 -2.188 1
1 596 . 13 1 1 A 56 56 ASP CB C 56 41.407 44.031 -2.624 1
1 597 . 13 1 1 A 56 56 ASP N N 56 125.773 124.868 0.905 1
1 598 . 13 1 1 A 57 57 GLY H H 57 7.222 8.467 -1.245 1
1 599 . 13 1 1 A 57 57 GLY HA2 H 57 3.479 3.837 -0.358 1
1 600 . 13 1 1 A 57 57 GLY HA3 H 57 2.719 3.927 -1.208 1
1 601 . 13 1 1 A 57 57 GLY C C 57 172.281 174.292 -2.011 1
1 602 . 13 1 1 A 57 57 GLY CA C 57 43.919 45.582 -1.663 1
1 603 . 13 1 1 A 57 57 GLY N N 57 105.564 110.847 -5.283 1
1 604 . 13 1 1 A 58 58 VAL H H 58 8.338 8.005 0.333 1
1 605 . 13 1 1 A 58 58 VAL HA H 58 3.860 4.364 -0.504 1
1 613 . 13 1 1 A 58 58 VAL C C 58 173.981 175.261 -1.280 1
1 614 . 13 1 1 A 58 58 VAL CA C 58 61.233 61.733 -0.500 1
1 615 . 13 1 1 A 58 58 VAL CB C 58 29.708 32.804 -3.096 1
1 618 . 13 1 1 A 58 58 VAL N N 58 121.466 120.975 0.491 1
1 619 . 13 1 1 A 59 59 ALA H H 59 9.038 8.819 0.219 1
1 620 . 13 1 1 A 59 59 ALA HA H 59 4.676 4.655 0.021 1
1 624 . 13 1 1 A 59 59 ALA C C 59 175.105 176.701 -1.596 1
1 625 . 13 1 1 A 59 59 ALA CA C 59 50.866 51.934 -1.068 1
1 626 . 13 1 1 A 59 59 ALA CB C 59 17.647 19.256 -1.609 1
1 627 . 13 1 1 A 59 59 ALA N N 59 130.928 129.954 0.974 1
1 628 . 13 1 1 A 60 60 THR H H 60 7.445 7.767 -0.322 1
1 629 . 13 1 1 A 60 60 THR HA H 60 4.642 4.632 0.010 1
1 634 . 13 1 1 A 60 60 THR C C 60 169.528 174.449 -4.921 1
1 635 . 13 1 1 A 60 60 THR CA C 60 57.101 59.449 -2.348 1
1 636 . 13 1 1 A 60 60 THR CB C 60 67.982 72.515 -4.533 1
1 638 . 13 1 1 A 60 60 THR N N 60 109.256 108.986 0.270 1
1 639 . 13 1 1 A 61 61 THR H H 61 7.325 8.315 -0.990 1
1 640 . 13 1 1 A 61 61 THR HA H 61 2.896 3.524 -0.628 1
1 645 . 13 1 1 A 61 61 THR C C 61 169.678 172.937 -3.259 1
1 646 . 13 1 1 A 61 61 THR CA C 61 57.246 62.372 -5.126 1
1 647 . 13 1 1 A 61 61 THR CB C 61 63.794 68.543 -4.749 1
1 649 . 13 1 1 A 61 61 THR N N 61 105.670 111.620 -5.950 1
1 650 . 13 1 1 A 62 62 ARG H H 62 6.490 7.198 -0.708 1
1 651 . 13 1 1 A 62 62 ARG HA H 62 4.698 4.541 0.157 1
1 658 . 13 1 1 A 62 62 ARG C C 62 172.881 174.092 -1.211 1
1 659 . 13 1 1 A 62 62 ARG CA C 62 52.276 54.085 -1.809 1
1 660 . 13 1 1 A 62 62 ARG CB C 62 30.774 32.828 -2.054 1
1 663 . 13 1 1 A 62 62 ARG N N 62 117.485 121.910 -4.425 1
1 664 . 13 1 1 A 63 63 TYR H H 63 8.891 9.099 -0.208 1
1 665 . 13 1 1 A 63 63 TYR HA H 63 4.356 5.309 -0.953 1
1 672 . 13 1 1 A 63 63 TYR C C 63 170.393 173.228 -2.835 1
1 673 . 13 1 1 A 63 63 TYR CA C 63 57.284 57.319 -0.035 1
1 674 . 13 1 1 A 63 63 TYR CB C 63 41.467 42.710 -1.243 1
1 679 . 13 1 1 A 63 63 TYR N N 63 124.712 127.301 -2.589 1
1 680 . 13 1 1 A 64 64 SER H H 64 7.244 8.066 -0.822 1
1 681 . 13 1 1 A 64 64 SER HA H 64 5.077 5.707 -0.630 1
1 684 . 13 1 1 A 64 64 SER C C 64 169.712 172.618 -2.906 1
1 685 . 13 1 1 A 64 64 SER CA C 64 54.181 56.206 -2.025 1
1 686 . 13 1 1 A 64 64 SER CB C 64 61.122 65.628 -4.506 1
1 687 . 13 1 1 A 64 64 SER N N 64 120.593 121.199 -0.606 1
1 688 . 13 1 1 A 65 65 ILE H H 65 8.686 8.598 0.088 1
1 689 . 13 1 1 A 65 65 ILE HA H 65 3.937 4.974 -1.037 1
1 699 . 13 1 1 A 65 65 ILE C C 65 172.217 175.057 -2.840 1
1 700 . 13 1 1 A 65 65 ILE CA C 65 58.288 59.461 -1.173 1
1 701 . 13 1 1 A 65 65 ILE CB C 65 36.110 40.441 -4.331 1
1 705 . 13 1 1 A 65 65 ILE N N 65 127.792 125.129 2.663 1
1 706 . 13 1 1 A 66 66 GLY H H 66 7.883 8.622 -0.739 1
1 707 . 13 1 1 A 66 66 GLY HA2 H 66 4.799 4.244 0.555 1
1 708 . 13 1 1 A 66 66 GLY HA3 H 66 3.468 4.268 -0.800 1
1 709 . 13 1 1 A 66 66 GLY C C 66 171.983 173.959 -1.976 1
1 710 . 13 1 1 A 66 66 GLY CA C 66 40.534 44.785 -4.251 1
1 711 . 13 1 1 A 66 66 GLY N N 66 112.632 113.570 -0.938 1
1 712 . 13 1 1 A 67 67 GLY H H 67 8.483 8.223 0.260 1
1 713 . 13 1 1 A 67 67 GLY HA2 H 67 3.836 3.966 -0.130 1
1 714 . 13 1 1 A 67 67 GLY HA3 H 67 3.682 3.989 -0.307 1
1 715 . 13 1 1 A 67 67 GLY C C 67 172.954 174.231 -1.277 1
1 716 . 13 1 1 A 67 67 GLY CA C 67 43.568 46.244 -2.676 1
1 717 . 13 1 1 A 67 67 GLY N N 67 104.625 109.570 -4.945 1
1 718 . 13 1 1 A 68 68 LEU H H 68 8.236 7.365 0.871 1
1 719 . 13 1 1 A 68 68 LEU HA H 68 4.154 4.711 -0.557 1
1 729 . 13 1 1 A 68 68 LEU C C 68 173.838 175.521 -1.683 1
1 730 . 13 1 1 A 68 68 LEU CA C 68 51.025 53.212 -2.187 1
1 731 . 13 1 1 A 68 68 LEU CB C 68 38.837 43.282 -4.445 1
1 735 . 13 1 1 A 68 68 LEU N N 68 118.919 121.465 -2.546 1
1 736 . 13 1 1 A 69 69 SER H H 69 8.284 8.795 -0.511 1
1 737 . 13 1 1 A 69 69 SER HA H 69 4.765 5.119 -0.354 1
1 740 . 13 1 1 A 69 69 SER C C 69 170.044 172.817 -2.773 1
1 741 . 13 1 1 A 69 69 SER CA C 69 54.639 54.846 -0.207 1
1 742 . 13 1 1 A 69 69 SER CB C 69 61.216 64.238 -3.022 1
1 743 . 13 1 1 A 69 69 SER N N 69 116.361 116.864 -0.503 1
1 744 . 13 1 1 A 70 70 PRO HA H 70 5.141 4.749 0.392 1
1 751 . 13 1 1 A 70 70 PRO C C 70 174.858 177.483 -2.625 1
1 752 . 13 1 1 A 70 70 PRO CA C 70 60.810 63.982 -3.172 1
1 753 . 13 1 1 A 70 70 PRO CB C 70 30.657 31.746 -1.089 1
1 756 . 13 1 1 A 71 71 PHE H H 71 8.139 9.425 -1.286 1
1 757 . 13 1 1 A 71 71 PHE HA H 71 4.202 4.273 -0.071 1
1 765 . 13 1 1 A 71 71 PHE C C 71 172.870 174.416 -1.546 1
1 766 . 13 1 1 A 71 71 PHE CA C 71 55.410 58.998 -3.588 1
1 767 . 13 1 1 A 71 71 PHE CB C 71 36.027 37.647 -1.620 1
1 773 . 13 1 1 A 71 71 PHE N N 71 125.409 123.224 2.185 1
1 774 . 13 1 1 A 72 72 SER H H 72 8.182 7.492 0.690 1
1 775 . 13 1 1 A 72 72 SER HA H 72 4.755 5.062 -0.307 1
1 778 . 13 1 1 A 72 72 SER C C 72 168.850 172.531 -3.681 1
1 779 . 13 1 1 A 72 72 SER CA C 72 55.926 56.493 -0.567 1
1 780 . 13 1 1 A 72 72 SER CB C 72 64.208 67.035 -2.827 1
1 781 . 13 1 1 A 72 72 SER N N 72 113.509 110.365 3.144 1
1 782 . 13 1 1 A 73 73 GLU H H 73 8.422 8.787 -0.365 1
1 783 . 13 1 1 A 73 73 GLU HA H 73 4.966 5.219 -0.253 1
1 788 . 13 1 1 A 73 73 GLU C C 73 173.192 174.697 -1.505 1
1 789 . 13 1 1 A 73 73 GLU CA C 73 52.815 54.885 -2.070 1
1 790 . 13 1 1 A 73 73 GLU CB C 73 29.416 32.928 -3.512 1
1 792 . 13 1 1 A 73 73 GLU N N 73 123.046 122.876 0.170 1
1 793 . 13 1 1 A 74 74 TYR H H 74 9.205 8.789 0.416 1
1 794 . 13 1 1 A 74 74 TYR HA H 74 4.799 4.974 -0.175 1
1 801 . 13 1 1 A 74 74 TYR C C 74 170.775 174.322 -3.547 1
1 802 . 13 1 1 A 74 74 TYR CA C 74 55.291 56.682 -1.391 1
1 803 . 13 1 1 A 74 74 TYR CB C 74 42.943 42.516 0.427 1
1 808 . 13 1 1 A 74 74 TYR N N 74 125.351 124.134 1.217 1
1 809 . 13 1 1 A 75 75 ALA H H 75 8.639 8.129 0.510 1
1 810 . 13 1 1 A 75 75 ALA HA H 75 5.271 5.329 -0.058 1
1 814 . 13 1 1 A 75 75 ALA C C 75 173.698 176.162 -2.464 1
1 815 . 13 1 1 A 75 75 ALA CA C 75 47.904 50.284 -2.380 1
1 816 . 13 1 1 A 75 75 ALA CB C 75 19.634 20.226 -0.592 1
1 817 . 13 1 1 A 75 75 ALA N N 75 121.555 124.606 -3.051 1
1 818 . 13 1 1 A 76 76 PHE H H 76 9.066 9.539 -0.473 1
1 819 . 13 1 1 A 76 76 PHE HA H 76 5.496 5.207 0.289 1
1 827 . 13 1 1 A 76 76 PHE C C 76 172.268 175.535 -3.267 1
1 828 . 13 1 1 A 76 76 PHE CA C 76 54.216 56.907 -2.691 1
1 829 . 13 1 1 A 76 76 PHE CB C 76 41.901 41.512 0.389 1
1 835 . 13 1 1 A 76 76 PHE N N 76 116.545 123.417 -6.872 1
1 836 . 13 1 1 A 77 77 ARG H H 77 9.216 8.854 0.362 1
1 837 . 13 1 1 A 77 77 ARG HA H 77 4.357 5.165 -0.808 1
1 845 . 13 1 1 A 77 77 ARG C C 77 169.998 174.049 -4.051 1
1 846 . 13 1 1 A 77 77 ARG CA C 77 52.414 54.678 -2.264 1
1 847 . 13 1 1 A 77 77 ARG CB C 77 30.794 33.995 -3.201 1
1 850 . 13 1 1 A 77 77 ARG N N 77 115.738 119.492 -3.754 1
1 852 . 13 1 1 A 78 78 VAL H H 78 8.135 8.712 -0.577 1
1 853 . 13 1 1 A 78 78 VAL HA H 78 4.884 4.841 0.043 1
1 861 . 13 1 1 A 78 78 VAL C C 78 171.098 174.902 -3.804 1
1 862 . 13 1 1 A 78 78 VAL CA C 78 57.566 60.798 -3.232 1
1 863 . 13 1 1 A 78 78 VAL CB C 78 33.146 33.287 -0.141 1
1 866 . 13 1 1 A 78 78 VAL N N 78 117.942 123.356 -5.414 1
1 867 . 13 1 1 A 79 79 LEU H H 79 9.167 8.515 0.652 1
1 868 . 13 1 1 A 79 79 LEU HA H 79 4.575 4.990 -0.415 1
1 878 . 13 1 1 A 79 79 LEU C C 79 171.447 174.992 -3.545 1
1 879 . 13 1 1 A 79 79 LEU CA C 79 51.642 53.408 -1.766 1
1 880 . 13 1 1 A 79 79 LEU CB C 79 42.776 45.680 -2.904 1
1 884 . 13 1 1 A 79 79 LEU N N 79 123.913 120.343 3.570 1
1 885 . 13 1 1 A 80 80 ALA H H 80 9.325 8.625 0.700 1
1 886 . 13 1 1 A 80 80 ALA HA H 80 4.654 3.550 1.104 1
1 890 . 13 1 1 A 80 80 ALA C C 80 172.070 176.899 -4.829 1
1 891 . 13 1 1 A 80 80 ALA CA C 80 48.169 51.351 -3.182 1
1 892 . 13 1 1 A 80 80 ALA CB C 80 20.366 19.379 0.987 1
1 893 . 13 1 1 A 80 80 ALA N N 80 124.135 122.939 1.196 1
1 894 . 13 1 1 A 81 81 VAL H H 81 7.953 8.085 -0.132 1
1 895 . 13 1 1 A 81 81 VAL HA H 81 4.293 4.699 -0.406 1
1 903 . 13 1 1 A 81 81 VAL C C 81 172.873 174.277 -1.404 1
1 904 . 13 1 1 A 81 81 VAL CA C 81 58.959 60.379 -1.420 1
1 905 . 13 1 1 A 81 81 VAL CB C 81 31.412 35.143 -3.731 1
1 908 . 13 1 1 A 81 81 VAL N N 81 118.503 120.879 -2.376 1
1 909 . 13 1 1 A 82 82 ASN H H 82 8.262 8.180 0.082 1
1 910 . 13 1 1 A 82 82 ASN HA H 82 4.945 5.311 -0.366 1
1 915 . 13 1 1 A 82 82 ASN C C 82 173.273 175.285 -2.012 1
1 916 . 13 1 1 A 82 82 ASN CA C 82 48.714 51.780 -3.066 1
1 917 . 13 1 1 A 82 82 ASN CB C 82 36.796 39.946 -3.150 1
1 918 . 13 1 1 A 82 82 ASN N N 82 125.425 123.742 1.683 1
1 920 . 13 1 1 A 83 83 SER HA H 83 3.966 4.105 -0.139 1
1 923 . 13 1 1 A 83 83 SER C C 83 172.812 176.886 -4.074 1
1 924 . 13 1 1 A 83 83 SER CA C 83 59.047 62.391 -3.344 1
1 925 . 13 1 1 A 83 83 SER CB C 83 60.406 62.683 -2.277 1
1 926 . 13 1 1 A 84 84 ILE H H 84 7.803 7.902 -0.099 1
1 927 . 13 1 1 A 84 84 ILE HA H 84 3.862 3.782 0.080 1
1 937 . 13 1 1 A 84 84 ILE C C 84 174.481 176.245 -1.764 1
1 938 . 13 1 1 A 84 84 ILE CA C 84 59.188 63.826 -4.638 1
1 939 . 13 1 1 A 84 84 ILE CB C 84 34.677 38.254 -3.577 1
1 943 . 13 1 1 A 84 84 ILE N N 84 121.222 118.931 2.291 1
1 944 . 13 1 1 A 85 85 GLY H H 85 7.435 7.296 0.139 1
1 945 . 13 1 1 A 85 85 GLY HA2 H 85 4.149 4.038 0.111 1
1 946 . 13 1 1 A 85 85 GLY HA3 H 85 3.747 4.041 -0.294 1
1 947 . 13 1 1 A 85 85 GLY C C 85 168.589 172.646 -4.057 1
1 948 . 13 1 1 A 85 85 GLY CA C 85 42.931 45.117 -2.186 1
1 949 . 13 1 1 A 85 85 GLY N N 85 106.320 105.876 0.444 1
1 950 . 13 1 1 A 86 86 ARG H H 86 8.190 8.461 -0.271 1
1 951 . 13 1 1 A 86 86 ARG HA H 86 4.452 4.402 0.050 1
1 958 . 13 1 1 A 86 86 ARG C C 86 175.286 176.305 -1.019 1
1 959 . 13 1 1 A 86 86 ARG CA C 86 53.223 55.564 -2.341 1
1 960 . 13 1 1 A 86 86 ARG CB C 86 29.517 30.395 -0.878 1
1 963 . 13 1 1 A 86 86 ARG N N 86 118.339 117.248 1.091 1
1 964 . 13 1 1 A 87 87 GLY H H 87 8.900 8.920 -0.020 1
1 965 . 13 1 1 A 87 87 GLY HA2 H 87 4.211 3.982 0.229 1
1 966 . 13 1 1 A 87 87 GLY HA3 H 87 3.967 3.995 -0.028 1
1 967 . 13 1 1 A 87 87 GLY C C 87 168.101 172.761 -4.660 1
1 968 . 13 1 1 A 87 87 GLY CA C 87 42.281 44.093 -1.812 1
1 969 . 13 1 1 A 87 87 GLY N N 87 113.482 109.245 4.237 1
1 970 . 13 1 1 A 88 88 PRO HA H 88 4.563 4.576 -0.013 1
1 977 . 13 1 1 A 88 88 PRO CA C 88 60.994 62.124 -1.130 1
1 978 . 13 1 1 A 88 88 PRO CB C 88 29.873 31.656 -1.783 1
1 981 . 13 1 1 A 89 89 PRO HA H 89 4.490 4.469 0.021 1
1 987 . 13 1 1 A 89 89 PRO C C 89 174.543 176.086 -1.543 1
1 988 . 13 1 1 A 89 89 PRO CA C 89 59.435 62.309 -2.874 1
1 989 . 13 1 1 A 89 89 PRO CB C 89 29.805 32.184 -2.379 1
1 992 . 13 1 1 A 90 90 SER H H 90 8.808 8.266 0.542 1
1 993 . 13 1 1 A 90 90 SER HA H 90 4.202 4.582 -0.380 1
1 996 . 13 1 1 A 90 90 SER C C 90 171.870 173.842 -1.972 1
1 997 . 13 1 1 A 90 90 SER CA C 90 55.868 57.065 -1.197 1
1 998 . 13 1 1 A 90 90 SER CB C 90 64.504 64.636 -0.132 1
1 999 . 13 1 1 A 90 90 SER N N 90 113.781 116.686 -2.905 1
1 1000 . 13 1 1 A 91 91 GLU H H 91 8.291 8.491 -0.200 1
1 1001 . 13 1 1 A 91 91 GLU HA H 91 4.131 4.108 0.023 1
1 1006 . 13 1 1 A 91 91 GLU C C 91 174.882 176.910 -2.028 1
1 1007 . 13 1 1 A 91 91 GLU CA C 91 54.984 57.294 -2.310 1
1 1008 . 13 1 1 A 91 91 GLU CB C 91 27.643 29.707 -2.064 1
1 1010 . 13 1 1 A 91 91 GLU N N 91 117.930 122.819 -4.889 1
1 1011 . 13 1 1 A 92 92 ALA H H 92 8.605 8.319 0.286 1
1 1012 . 13 1 1 A 92 92 ALA HA H 92 5.068 4.299 0.769 1
1 1016 . 13 1 1 A 92 92 ALA C C 92 176.227 177.947 -1.720 1
1 1017 . 13 1 1 A 92 92 ALA CA C 92 48.997 52.913 -3.916 1
1 1018 . 13 1 1 A 92 92 ALA CB C 92 17.756 19.203 -1.447 1
1 1019 . 13 1 1 A 92 92 ALA N N 92 126.421 127.501 -1.080 1
1 1020 . 13 1 1 A 93 93 VAL H H 93 9.051 9.157 -0.106 1
1 1021 . 13 1 1 A 93 93 VAL HA H 93 4.642 4.975 -0.333 1
1 1029 . 13 1 1 A 93 93 VAL C C 93 172.010 174.437 -2.427 1
1 1030 . 13 1 1 A 93 93 VAL CA C 93 57.495 59.335 -1.840 1
1 1031 . 13 1 1 A 93 93 VAL CB C 93 32.774 34.300 -1.526 1
1 1034 . 13 1 1 A 93 93 VAL N N 93 117.322 118.449 -1.127 1
1 1035 . 13 1 1 A 94 94 ARG H H 94 8.470 8.878 -0.408 1
1 1036 . 13 1 1 A 94 94 ARG HA H 94 5.692 5.311 0.381 1
1 1043 . 13 1 1 A 94 94 ARG C C 94 173.635 175.491 -1.856 1
1 1044 . 13 1 1 A 94 94 ARG CA C 94 52.038 54.670 -2.632 1
1 1045 . 13 1 1 A 94 94 ARG CB C 94 30.966 31.865 -0.899 1
1 1048 . 13 1 1 A 94 94 ARG N N 94 122.258 123.253 -0.995 1
1 1049 . 13 1 1 A 95 95 ALA H H 95 9.051 9.132 -0.081 1
1 1050 . 13 1 1 A 95 95 ALA HA H 95 4.642 5.268 -0.626 1
1 1054 . 13 1 1 A 95 95 ALA C C 95 172.285 175.158 -2.873 1
1 1055 . 13 1 1 A 95 95 ALA CA C 95 49.191 50.650 -1.459 1
1 1056 . 13 1 1 A 95 95 ALA CB C 95 22.562 22.224 0.338 1
1 1057 . 13 1 1 A 95 95 ALA N N 95 121.931 127.096 -5.165 1
1 1058 . 13 1 1 A 96 96 ARG H H 96 8.550 8.704 -0.154 1
1 1059 . 13 1 1 A 96 96 ARG HA H 96 5.407 5.190 0.217 1
1 1066 . 13 1 1 A 96 96 ARG C C 96 174.547 176.056 -1.509 1
1 1067 . 13 1 1 A 96 96 ARG CA C 96 51.439 55.256 -3.817 1
1 1068 . 13 1 1 A 96 96 ARG CB C 96 30.708 31.481 -0.773 1
1 1071 . 13 1 1 A 96 96 ARG N N 96 121.155 124.588 -3.433 1
1 1072 . 13 1 1 A 97 97 THR H H 97 8.797 8.991 -0.194 1
1 1073 . 13 1 1 A 97 97 THR HA H 97 4.116 4.449 -0.333 1
1 1078 . 13 1 1 A 97 97 THR C C 97 173.577 174.965 -1.388 1
1 1079 . 13 1 1 A 97 97 THR CA C 97 58.800 61.474 -2.674 1
1 1080 . 13 1 1 A 97 97 THR CB C 97 67.461 69.909 -2.448 1
1 1082 . 13 1 1 A 97 97 THR N N 97 114.657 117.883 -3.226 1
1 1083 . 13 1 1 A 98 98 GLY H H 98 7.505 8.248 -0.743 1
1 1084 . 13 1 1 A 98 98 GLY HA2 H 98 3.866 4.089 -0.223 1
1 1085 . 13 1 1 A 98 98 GLY HA3 H 98 3.743 4.139 -0.396 1
1 1086 . 13 1 1 A 98 98 GLY C C 98 170.637 173.281 -2.644 1
1 1087 . 13 1 1 A 98 98 GLY CA C 98 42.332 44.772 -2.440 1
1 1088 . 13 1 1 A 98 98 GLY N N 98 106.172 108.119 -1.947 1
1 1089 . 13 1 1 A 99 99 GLU H H 99 8.145 8.393 -0.248 1
1 1090 . 13 1 1 A 99 99 GLU HA H 99 4.210 4.913 -0.703 1
1 1095 . 13 1 1 A 99 99 GLU C C 99 174.134 175.056 -0.922 1
1 1096 . 13 1 1 A 99 99 GLU CA C 99 53.828 55.763 -1.935 1
1 1097 . 13 1 1 A 99 99 GLU CB C 99 28.774 31.015 -2.241 1
1 1099 . 13 1 1 A 99 99 GLU N N 99 117.634 117.946 -0.312 1
1 1100 . 13 1 1 A 100 100 GLN H H 100 8.647 8.740 -0.093 1
1 1101 . 13 1 1 A 100 100 GLN HA H 100 4.247 4.951 -0.704 1
1 1108 . 13 1 1 A 100 100 GLN C C 100 173.348 174.030 -0.682 1
1 1109 . 13 1 1 A 100 100 GLN CA C 100 53.634 54.219 -0.585 1
1 1110 . 13 1 1 A 100 100 GLN CB C 100 27.392 32.634 -5.242 1
1 1112 . 13 1 1 A 100 100 GLN N N 100 121.960 120.192 1.768 1
1 1114 . 13 1 1 A 101 101 SER H H 101 8.416 8.765 -0.349 1
1 1115 . 13 1 1 A 101 101 SER HA H 101 4.418 4.536 -0.118 1
1 1117 . 13 1 1 A 101 101 SER C C 101 172.148 174.077 -1.929 1
1 1118 . 13 1 1 A 101 101 SER CA C 101 55.926 57.005 -1.079 1
1 1119 . 13 1 1 A 101 101 SER CB C 101 61.617 62.065 -0.448 1
1 1120 . 13 1 1 A 101 101 SER N N 101 118.609 119.068 -0.459 1
1 1121 . 13 1 1 A 102 102 GLY H H 102 8.233 7.935 0.298 1
1 1122 . 13 1 1 A 102 102 GLY HA2 H 102 4.080 3.895 0.185 1
1 1123 . 13 1 1 A 102 102 GLY HA3 H 102 3.981 3.901 0.080 1
1 1124 . 13 1 1 A 102 102 GLY C C 102 169.461 173.881 -4.420 1
1 1125 . 13 1 1 A 102 102 GLY CA C 102 42.332 46.938 -4.606 1
1 1126 . 13 1 1 A 102 102 GLY N N 102 110.483 113.129 -2.646 1
1 1127 . 13 1 1 A 103 103 PRO HA H 103 4.618 4.749 -0.131 1
1 1134 . 13 1 1 A 103 103 PRO CA C 103 57.843 62.809 -4.966 1
1 1135 . 13 1 1 A 103 103 PRO CB C 103 28.671 31.653 -2.982 1
1 1 . 14 1 1 A 6 6 SER HA H 6 4.492 4.758 -0.266 1
1 4 . 14 1 1 A 6 6 SER CA C 6 55.621 57.437 -1.816 1
1 5 . 14 1 1 A 6 6 SER CB C 6 62.104 63.472 -1.368 1
1 6 . 14 1 1 A 7 7 GLY H H 7 8.244 7.923 0.321 1
1 7 . 14 1 1 A 7 7 GLY HA2 H 7 3.873 4.029 -0.156 1
1 8 . 14 1 1 A 7 7 GLY HA3 H 7 3.737 4.036 -0.299 1
1 9 . 14 1 1 A 7 7 GLY CA C 7 41.743 43.946 -2.203 1
1 10 . 14 1 1 A 7 7 GLY N N 7 109.193 115.468 -6.275 1
1 11 . 14 1 1 A 8 8 PRO HA H 8 4.286 4.611 -0.325 1
1 18 . 14 1 1 A 8 8 PRO C C 8 173.841 175.350 -1.509 1
1 19 . 14 1 1 A 8 8 PRO CA C 8 60.528 62.511 -1.983 1
1 20 . 14 1 1 A 8 8 PRO CB C 8 30.299 33.205 -2.906 1
1 23 . 14 1 1 A 9 9 LYS H H 9 8.877 8.319 0.558 1
1 24 . 14 1 1 A 9 9 LYS HA H 9 4.360 4.843 -0.483 1
1 33 . 14 1 1 A 9 9 LYS C C 9 173.492 174.192 -0.700 1
1 34 . 14 1 1 A 9 9 LYS CA C 9 52.135 52.997 -0.862 1
1 35 . 14 1 1 A 9 9 LYS CB C 9 28.798 33.634 -4.836 1
1 39 . 14 1 1 A 9 9 LYS N N 9 120.404 120.421 -0.017 1
1 40 . 14 1 1 A 10 10 PRO HA H 10 4.284 4.650 -0.366 1
1 47 . 14 1 1 A 10 10 PRO CA C 10 59.326 61.642 -2.316 1
1 48 . 14 1 1 A 10 10 PRO CB C 10 28.825 31.605 -2.780 1
1 51 . 14 1 1 A 11 11 PRO HA H 11 4.468 4.873 -0.405 1
1 58 . 14 1 1 A 11 11 PRO C C 11 171.993 176.443 -4.450 1
1 59 . 14 1 1 A 11 11 PRO CA C 11 60.422 62.654 -2.232 1
1 60 . 14 1 1 A 11 11 PRO CB C 11 30.418 32.786 -2.368 1
1 63 . 14 1 1 A 12 12 ILE H H 12 7.554 8.126 -0.572 1
1 64 . 14 1 1 A 12 12 ILE HA H 12 4.676 4.677 -0.001 1
1 74 . 14 1 1 A 12 12 ILE C C 12 171.721 175.097 -3.376 1
1 75 . 14 1 1 A 12 12 ILE CA C 12 56.843 58.769 -1.926 1
1 76 . 14 1 1 A 12 12 ILE CB C 12 40.560 41.003 -0.443 1
1 80 . 14 1 1 A 12 12 ILE N N 12 109.695 116.671 -6.976 1
1 81 . 14 1 1 A 13 13 ASP H H 13 8.435 9.066 -0.631 1
1 82 . 14 1 1 A 13 13 ASP HA H 13 4.094 4.272 -0.178 1
1 85 . 14 1 1 A 13 13 ASP C C 13 171.803 176.171 -4.368 1
1 86 . 14 1 1 A 13 13 ASP CA C 13 52.610 55.070 -2.460 1
1 87 . 14 1 1 A 13 13 ASP CB C 13 36.357 40.227 -3.870 1
1 88 . 14 1 1 A 13 13 ASP N N 13 116.219 122.143 -5.924 1
1 89 . 14 1 1 A 14 14 LEU H H 14 7.483 8.026 -0.543 1
1 90 . 14 1 1 A 14 14 LEU HA H 14 4.990 4.974 0.016 1
1 100 . 14 1 1 A 14 14 LEU C C 14 174.702 175.301 -0.599 1
1 101 . 14 1 1 A 14 14 LEU CA C 14 53.811 54.888 -1.077 1
1 102 . 14 1 1 A 14 14 LEU CB C 14 40.148 41.896 -1.748 1
1 106 . 14 1 1 A 14 14 LEU N N 14 118.463 121.057 -2.594 1
1 107 . 14 1 1 A 15 15 VAL H H 15 9.209 8.637 0.572 1
1 108 . 14 1 1 A 15 15 VAL HA H 15 4.250 4.754 -0.504 1
1 116 . 14 1 1 A 15 15 VAL C C 15 172.080 174.436 -2.356 1
1 117 . 14 1 1 A 15 15 VAL CA C 15 58.570 60.634 -2.064 1
1 118 . 14 1 1 A 15 15 VAL CB C 15 34.146 36.131 -1.985 1
1 121 . 14 1 1 A 15 15 VAL N N 15 124.833 126.822 -1.989 1
1 122 . 14 1 1 A 16 16 VAL H H 16 8.390 9.055 -0.665 1
1 123 . 14 1 1 A 16 16 VAL HA H 16 4.343 4.513 -0.170 1
1 131 . 14 1 1 A 16 16 VAL C C 16 174.672 176.122 -1.450 1
1 132 . 14 1 1 A 16 16 VAL CA C 16 59.188 61.855 -2.667 1
1 133 . 14 1 1 A 16 16 VAL CB C 16 29.187 31.899 -2.712 1
1 136 . 14 1 1 A 16 16 VAL N N 16 124.654 125.595 -0.941 1
1 137 . 14 1 1 A 17 17 THR H H 17 8.638 8.325 0.313 1
1 138 . 14 1 1 A 17 17 THR HA H 17 4.195 4.323 -0.128 1
1 143 . 14 1 1 A 17 17 THR C C 17 172.661 173.544 -0.883 1
1 144 . 14 1 1 A 17 17 THR CA C 17 60.318 64.887 -4.569 1
1 145 . 14 1 1 A 17 17 THR CB C 17 66.420 69.611 -3.191 1
1 147 . 14 1 1 A 17 17 THR N N 17 120.942 123.087 -2.145 1
1 148 . 14 1 1 A 18 18 GLU H H 18 7.361 7.633 -0.272 1
1 149 . 14 1 1 A 18 18 GLU HA H 18 4.497 4.716 -0.219 1
1 154 . 14 1 1 A 18 18 GLU C C 18 171.691 175.168 -3.477 1
1 155 . 14 1 1 A 18 18 GLU CA C 18 53.687 54.844 -1.157 1
1 156 . 14 1 1 A 18 18 GLU CB C 18 30.802 33.238 -2.436 1
1 158 . 14 1 1 A 18 18 GLU N N 18 119.088 118.768 0.320 1
1 159 . 14 1 1 A 19 19 THR H H 19 8.164 8.709 -0.545 1
1 160 . 14 1 1 A 19 19 THR HA H 19 4.912 5.079 -0.167 1
1 165 . 14 1 1 A 19 19 THR C C 19 171.606 172.902 -1.296 1
1 166 . 14 1 1 A 19 19 THR CA C 19 58.473 60.701 -2.228 1
1 167 . 14 1 1 A 19 19 THR CB C 19 70.103 71.139 -1.036 1
1 169 . 14 1 1 A 19 19 THR N N 19 112.424 113.566 -1.142 1
1 170 . 14 1 1 A 20 20 THR H H 20 8.750 9.107 -0.357 1
1 171 . 14 1 1 A 20 20 THR HA H 20 4.710 4.813 -0.103 1
1 176 . 14 1 1 A 20 20 THR C C 20 172.785 175.868 -3.083 1
1 177 . 14 1 1 A 20 20 THR CA C 20 58.059 61.004 -2.945 1
1 178 . 14 1 1 A 20 20 THR CB C 20 68.782 71.033 -2.251 1
1 180 . 14 1 1 A 20 20 THR N N 20 113.438 121.322 -7.884 1
1 181 . 14 1 1 A 21 21 ALA H H 21 8.453 9.006 -0.553 1
1 182 . 14 1 1 A 21 21 ALA HA H 21 4.079 4.341 -0.262 1
1 186 . 14 1 1 A 21 21 ALA C C 21 174.130 178.232 -4.102 1
1 187 . 14 1 1 A 21 21 ALA CA C 21 52.680 55.802 -3.122 1
1 188 . 14 1 1 A 21 21 ALA CB C 21 16.893 18.494 -1.601 1
1 189 . 14 1 1 A 21 21 ALA N N 21 120.078 125.936 -5.858 1
1 190 . 14 1 1 A 22 22 THR H H 22 7.132 7.461 -0.329 1
1 191 . 14 1 1 A 22 22 THR HA H 22 4.433 5.012 -0.579 1
1 196 . 14 1 1 A 22 22 THR C C 22 171.434 173.539 -2.105 1
1 197 . 14 1 1 A 22 22 THR CA C 22 56.836 60.550 -3.714 1
1 198 . 14 1 1 A 22 22 THR CB C 22 68.772 68.960 -0.188 1
1 200 . 14 1 1 A 22 22 THR N N 22 95.772 104.523 -8.751 1
1 201 . 14 1 1 A 23 23 SER H H 23 7.326 7.553 -0.227 1
1 202 . 14 1 1 A 23 23 SER HA H 23 5.562 5.266 0.296 1
1 205 . 14 1 1 A 23 23 SER C C 23 169.267 172.412 -3.145 1
1 206 . 14 1 1 A 23 23 SER CA C 23 54.445 57.698 -3.253 1
1 207 . 14 1 1 A 23 23 SER CB C 23 65.905 66.753 -0.848 1
1 208 . 14 1 1 A 23 23 SER N N 23 115.757 115.758 -0.001 1
1 209 . 14 1 1 A 24 24 VAL H H 24 7.983 8.456 -0.473 1
1 210 . 14 1 1 A 24 24 VAL HA H 24 4.334 4.701 -0.367 1
1 218 . 14 1 1 A 24 24 VAL C C 24 171.917 174.684 -2.767 1
1 219 . 14 1 1 A 24 24 VAL CA C 24 58.642 60.440 -1.798 1
1 220 . 14 1 1 A 24 24 VAL CB C 24 34.254 35.714 -1.460 1
1 223 . 14 1 1 A 24 24 VAL N N 24 116.595 121.184 -4.589 1
1 224 . 14 1 1 A 25 25 THR H H 25 8.636 8.764 -0.128 1
1 225 . 14 1 1 A 25 25 THR HA H 25 4.833 4.883 -0.050 1
1 230 . 14 1 1 A 25 25 THR C C 25 169.721 172.959 -3.238 1
1 231 . 14 1 1 A 25 25 THR CA C 25 59.699 61.757 -2.058 1
1 232 . 14 1 1 A 25 25 THR CB C 25 67.303 70.153 -2.850 1
1 234 . 14 1 1 A 25 25 THR N N 25 121.690 120.648 1.042 1
1 235 . 14 1 1 A 26 26 LEU H H 26 8.629 9.069 -0.440 1
1 236 . 14 1 1 A 26 26 LEU HA H 26 5.315 5.319 -0.004 1
1 246 . 14 1 1 A 26 26 LEU C C 26 173.182 175.531 -2.349 1
1 247 . 14 1 1 A 26 26 LEU CA C 26 50.643 53.180 -2.537 1
1 248 . 14 1 1 A 26 26 LEU CB C 26 43.976 45.464 -1.488 1
1 252 . 14 1 1 A 26 26 LEU N N 26 126.843 130.761 -3.918 1
1 253 . 14 1 1 A 27 27 THR H H 27 8.704 8.994 -0.290 1
1 254 . 14 1 1 A 27 27 THR HA H 27 4.822 5.288 -0.466 1
1 259 . 14 1 1 A 27 27 THR C C 27 169.840 173.578 -3.738 1
1 260 . 14 1 1 A 27 27 THR CA C 27 58.077 59.867 -1.790 1
1 261 . 14 1 1 A 27 27 THR CB C 27 69.666 71.374 -1.708 1
1 263 . 14 1 1 A 27 27 THR N N 27 111.513 115.694 -4.181 1
1 264 . 14 1 1 A 28 28 TRP H H 28 7.339 8.221 -0.882 1
1 265 . 14 1 1 A 28 28 TRP HA H 28 4.963 5.259 -0.296 1
1 274 . 14 1 1 A 28 28 TRP C C 28 170.637 172.502 -1.865 1
1 275 . 14 1 1 A 28 28 TRP CA C 28 54.438 55.462 -1.024 1
1 276 . 14 1 1 A 28 28 TRP CB C 28 27.497 31.423 -3.926 1
1 282 . 14 1 1 A 28 28 TRP N N 28 117.895 119.718 -1.823 1
1 284 . 14 1 1 A 29 29 ASP H H 29 8.696 9.225 -0.529 1
1 285 . 14 1 1 A 29 29 ASP HA H 29 4.971 5.063 -0.092 1
1 288 . 14 1 1 A 29 29 ASP C C 29 174.901 177.430 -2.529 1
1 289 . 14 1 1 A 29 29 ASP CA C 29 50.178 52.009 -1.831 1
1 290 . 14 1 1 A 29 29 ASP CB C 29 42.291 43.321 -1.030 1
1 291 . 14 1 1 A 29 29 ASP N N 29 117.477 121.147 -3.670 1
1 292 . 14 1 1 A 30 30 SER H H 30 8.800 8.880 -0.080 1
1 293 . 14 1 1 A 30 30 SER HA H 30 4.389 4.122 0.267 1
1 296 . 14 1 1 A 30 30 SER C C 30 174.032 175.682 -1.650 1
1 297 . 14 1 1 A 30 30 SER CA C 30 58.694 60.593 -1.899 1
1 298 . 14 1 1 A 30 30 SER CB C 30 62.428 63.503 -1.075 1
1 299 . 14 1 1 A 30 30 SER N N 30 118.275 119.395 -1.120 1
1 300 . 14 1 1 A 31 31 GLY H H 31 8.759 7.746 1.013 1
1 301 . 14 1 1 A 31 31 GLY HA2 H 31 4.239 4.017 0.222 1
1 302 . 14 1 1 A 31 31 GLY HA3 H 31 3.555 4.050 -0.495 1
1 303 . 14 1 1 A 31 31 GLY C C 31 171.325 174.217 -2.892 1
1 304 . 14 1 1 A 31 31 GLY CA C 31 43.637 45.556 -1.919 1
1 305 . 14 1 1 A 31 31 GLY N N 31 107.961 110.820 -2.859 1
1 306 . 14 1 1 A 32 32 ASN H H 32 8.173 8.096 0.077 1
1 307 . 14 1 1 A 32 32 ASN HA H 32 4.749 4.948 -0.199 1
1 312 . 14 1 1 A 32 32 ASN C C 32 171.355 176.041 -4.686 1
1 313 . 14 1 1 A 32 32 ASN CA C 32 50.795 52.306 -1.511 1
1 314 . 14 1 1 A 32 32 ASN CB C 32 41.508 39.556 1.952 1
1 315 . 14 1 1 A 32 32 ASN N N 32 117.781 119.229 -1.448 1
1 317 . 14 1 1 A 33 33 SER HA H 33 4.291 4.286 0.005 1
1 320 . 14 1 1 A 33 33 SER C C 33 172.449 174.887 -2.438 1
1 321 . 14 1 1 A 33 33 SER CA C 33 56.733 61.647 -4.914 1
1 322 . 14 1 1 A 33 33 SER CB C 33 60.884 62.881 -1.997 1
1 323 . 14 1 1 A 34 34 GLU H H 34 7.731 7.820 -0.089 1
1 324 . 14 1 1 A 34 34 GLU HA H 34 4.556 4.594 -0.038 1
1 329 . 14 1 1 A 34 34 GLU C C 34 171.792 174.940 -3.148 1
1 330 . 14 1 1 A 34 34 GLU CA C 34 51.818 54.746 -2.928 1
1 331 . 14 1 1 A 34 34 GLU CB C 34 26.891 30.406 -3.515 1
1 333 . 14 1 1 A 34 34 GLU N N 34 122.319 118.451 3.868 1
1 334 . 14 1 1 A 35 35 PRO HA H 35 4.165 4.700 -0.535 1
1 341 . 14 1 1 A 35 35 PRO C C 35 174.288 176.903 -2.615 1
1 342 . 14 1 1 A 35 35 PRO CA C 35 61.374 62.770 -1.396 1
1 343 . 14 1 1 A 35 35 PRO CB C 35 29.887 32.284 -2.397 1
1 346 . 14 1 1 A 36 36 VAL H H 36 8.348 8.184 0.164 1
1 347 . 14 1 1 A 36 36 VAL HA H 36 3.899 4.373 -0.474 1
1 355 . 14 1 1 A 36 36 VAL C C 36 173.344 177.181 -3.837 1
1 356 . 14 1 1 A 36 36 VAL CA C 36 59.014 60.302 -1.288 1
1 357 . 14 1 1 A 36 36 VAL CB C 36 31.865 34.044 -2.179 1
1 360 . 14 1 1 A 36 36 VAL N N 36 122.051 117.949 4.102 1
1 361 . 14 1 1 A 37 37 THR H H 37 8.780 8.231 0.549 1
1 362 . 14 1 1 A 37 37 THR HA H 37 3.923 4.181 -0.258 1
1 367 . 14 1 1 A 37 37 THR C C 37 172.171 174.533 -2.362 1
1 368 . 14 1 1 A 37 37 THR CA C 37 63.155 64.698 -1.543 1
1 369 . 14 1 1 A 37 37 THR CB C 37 65.941 69.120 -3.179 1
1 371 . 14 1 1 A 37 37 THR N N 37 122.351 116.914 5.437 1
1 372 . 14 1 1 A 38 38 TYR H H 38 7.304 7.748 -0.444 1
1 373 . 14 1 1 A 38 38 TYR HA H 38 4.439 5.047 -0.608 1
1 380 . 14 1 1 A 38 38 TYR C C 38 168.385 172.361 -3.976 1
1 381 . 14 1 1 A 38 38 TYR CA C 38 54.101 56.267 -2.166 1
1 382 . 14 1 1 A 38 38 TYR CB C 38 35.874 40.132 -4.258 1
1 387 . 14 1 1 A 38 38 TYR N N 38 113.984 115.400 -1.416 1
1 388 . 14 1 1 A 39 39 TYR H H 39 9.445 8.956 0.489 1
1 389 . 14 1 1 A 39 39 TYR HA H 39 5.293 5.421 -0.128 1
1 396 . 14 1 1 A 39 39 TYR C C 39 172.781 175.971 -3.190 1
1 397 . 14 1 1 A 39 39 TYR CA C 39 54.322 55.628 -1.306 1
1 398 . 14 1 1 A 39 39 TYR CB C 39 39.035 40.269 -1.234 1
1 401 . 14 1 1 A 39 39 TYR N N 39 115.092 118.938 -3.846 1
1 402 . 14 1 1 A 40 40 GLY H H 40 8.870 8.342 0.528 1
1 403 . 14 1 1 A 40 40 GLY HA2 H 40 5.137 4.107 1.030 1
1 404 . 14 1 1 A 40 40 GLY HA3 H 40 3.285 4.166 -0.881 1
1 405 . 14 1 1 A 40 40 GLY C C 40 169.688 172.946 -3.258 1
1 406 . 14 1 1 A 40 40 GLY CA C 40 41.415 44.704 -3.289 1
1 407 . 14 1 1 A 40 40 GLY N N 40 106.573 111.651 -5.078 1
1 408 . 14 1 1 A 41 41 ILE H H 41 8.917 8.340 0.577 1
1 409 . 14 1 1 A 41 41 ILE HA H 41 4.527 5.096 -0.569 1
1 419 . 14 1 1 A 41 41 ILE C C 41 172.692 174.487 -1.795 1
1 420 . 14 1 1 A 41 41 ILE CA C 41 57.597 60.231 -2.634 1
1 421 . 14 1 1 A 41 41 ILE CB C 41 37.840 41.994 -4.154 1
1 425 . 14 1 1 A 41 41 ILE N N 41 121.746 120.605 1.141 1
1 426 . 14 1 1 A 42 42 GLN H H 42 9.063 8.887 0.176 1
1 427 . 14 1 1 A 42 42 GLN HA H 42 5.655 5.257 0.398 1
1 434 . 14 1 1 A 42 42 GLN C C 42 172.841 174.650 -1.809 1
1 435 . 14 1 1 A 42 42 GLN CA C 42 50.789 54.017 -3.228 1
1 436 . 14 1 1 A 42 42 GLN CB C 42 28.898 32.344 -3.446 1
1 438 . 14 1 1 A 42 42 GLN N N 42 125.141 125.380 -0.239 1
1 440 . 14 1 1 A 43 43 TYR H H 43 9.066 8.925 0.141 1
1 441 . 14 1 1 A 43 43 TYR HA H 43 5.922 5.991 -0.069 1
1 448 . 14 1 1 A 43 43 TYR C C 43 171.219 173.262 -2.043 1
1 449 . 14 1 1 A 43 43 TYR CA C 43 53.349 56.357 -3.008 1
1 450 . 14 1 1 A 43 43 TYR CB C 43 41.074 41.927 -0.853 1
1 455 . 14 1 1 A 43 43 TYR N N 43 118.018 119.290 -1.272 1
1 456 . 14 1 1 A 44 44 ARG H H 44 8.400 8.848 -0.448 1
1 457 . 14 1 1 A 44 44 ARG HA H 44 4.542 4.658 -0.116 1
1 464 . 14 1 1 A 44 44 ARG C C 44 171.974 174.341 -2.367 1
1 465 . 14 1 1 A 44 44 ARG CA C 44 52.453 55.079 -2.626 1
1 466 . 14 1 1 A 44 44 ARG CB C 44 31.125 33.697 -2.572 1
1 469 . 14 1 1 A 44 44 ARG N N 44 115.214 120.664 -5.450 1
1 470 . 14 1 1 A 45 45 ALA H H 45 8.846 8.309 0.537 1
1 471 . 14 1 1 A 45 45 ALA HA H 45 3.894 2.945 0.949 1
1 475 . 14 1 1 A 45 45 ALA C C 45 175.721 177.116 -1.395 1
1 476 . 14 1 1 A 45 45 ALA CA C 45 50.372 52.439 -2.067 1
1 477 . 14 1 1 A 45 45 ALA CB C 45 15.732 18.823 -3.091 1
1 478 . 14 1 1 A 45 45 ALA N N 45 126.463 126.966 -0.503 1
1 479 . 14 1 1 A 46 46 ALA H H 46 8.282 8.269 0.013 1
1 480 . 14 1 1 A 46 46 ALA HA H 46 3.922 3.857 0.065 1
1 484 . 14 1 1 A 46 46 ALA C C 46 176.236 178.310 -2.074 1
1 485 . 14 1 1 A 46 46 ALA CA C 46 50.773 53.718 -2.945 1
1 486 . 14 1 1 A 46 46 ALA CB C 46 16.244 18.426 -2.182 1
1 487 . 14 1 1 A 46 46 ALA N N 46 126.301 124.995 1.306 1
1 488 . 14 1 1 A 47 47 GLY HA2 H 47 3.882 3.988 -0.106 1
1 489 . 14 1 1 A 47 47 GLY HA3 H 47 3.695 4.022 -0.327 1
1 490 . 14 1 1 A 47 47 GLY C C 47 171.795 174.125 -2.330 1
1 491 . 14 1 1 A 47 47 GLY CA C 47 43.327 45.433 -2.106 1
1 492 . 14 1 1 A 48 48 THR H H 48 7.145 7.958 -0.813 1
1 493 . 14 1 1 A 48 48 THR HA H 48 4.417 4.129 0.288 1
1 498 . 14 1 1 A 48 48 THR C C 48 171.325 174.267 -2.942 1
1 499 . 14 1 1 A 48 48 THR CA C 48 58.271 63.151 -4.880 1
1 500 . 14 1 1 A 48 48 THR CB C 48 68.846 69.045 -0.199 1
1 502 . 14 1 1 A 48 48 THR N N 48 110.190 117.381 -7.191 1
1 503 . 14 1 1 A 49 49 GLU H H 49 8.346 8.854 -0.508 1
1 504 . 14 1 1 A 49 49 GLU HA H 49 4.277 4.735 -0.458 1
1 509 . 14 1 1 A 49 49 GLU C C 49 174.109 176.134 -2.025 1
1 510 . 14 1 1 A 49 49 GLU CA C 49 52.909 55.357 -2.448 1
1 511 . 14 1 1 A 49 49 GLU CB C 49 27.845 29.548 -1.703 1
1 513 . 14 1 1 A 49 49 GLU N N 49 119.985 126.656 -6.671 1
1 514 . 14 1 1 A 50 50 GLY H H 50 7.617 8.079 -0.462 1
1 515 . 14 1 1 A 50 50 GLY HA2 H 50 3.935 4.028 -0.093 1
1 516 . 14 1 1 A 50 50 GLY HA3 H 50 3.935 4.088 -0.153 1
1 517 . 14 1 1 A 50 50 GLY C C 50 168.223 172.923 -4.700 1
1 518 . 14 1 1 A 50 50 GLY CA C 50 42.121 44.113 -1.992 1
1 519 . 14 1 1 A 50 50 GLY N N 50 108.670 109.721 -1.051 1
1 520 . 14 1 1 A 51 51 PRO HA H 51 4.298 4.703 -0.405 1
1 527 . 14 1 1 A 51 51 PRO C C 51 175.067 177.011 -1.944 1
1 528 . 14 1 1 A 51 51 PRO CA C 51 60.175 62.900 -2.725 1
1 529 . 14 1 1 A 51 51 PRO CB C 51 30.052 31.672 -1.620 1
1 532 . 14 1 1 A 52 52 PHE H H 52 8.442 8.723 -0.281 1
1 533 . 14 1 1 A 52 52 PHE HA H 52 3.981 4.678 -0.697 1
1 541 . 14 1 1 A 52 52 PHE C C 52 175.141 175.652 -0.511 1
1 542 . 14 1 1 A 52 52 PHE CA C 52 56.808 57.747 -0.939 1
1 543 . 14 1 1 A 52 52 PHE CB C 52 36.830 39.624 -2.794 1
1 549 . 14 1 1 A 52 52 PHE N N 52 118.707 122.753 -4.046 1
1 550 . 14 1 1 A 53 53 GLN H H 53 8.778 8.080 0.698 1
1 551 . 14 1 1 A 53 53 GLN HA H 53 4.149 4.155 -0.006 1
1 558 . 14 1 1 A 53 53 GLN C C 53 172.773 175.614 -2.841 1
1 559 . 14 1 1 A 53 53 GLN CA C 53 52.999 56.610 -3.611 1
1 560 . 14 1 1 A 53 53 GLN CB C 53 26.962 29.076 -2.114 1
1 562 . 14 1 1 A 53 53 GLN N N 53 122.164 121.475 0.689 1
1 564 . 14 1 1 A 54 54 GLU H H 54 8.432 8.590 -0.158 1
1 565 . 14 1 1 A 54 54 GLU HA H 54 5.533 5.046 0.487 1
1 570 . 14 1 1 A 54 54 GLU C C 54 173.930 174.748 -0.818 1
1 571 . 14 1 1 A 54 54 GLU CA C 54 52.981 55.839 -2.858 1
1 572 . 14 1 1 A 54 54 GLU CB C 54 31.712 33.401 -1.689 1
1 574 . 14 1 1 A 54 54 GLU N N 54 119.688 120.989 -1.301 1
1 575 . 14 1 1 A 55 55 VAL H H 55 9.077 8.811 0.266 1
1 576 . 14 1 1 A 55 55 VAL HA H 55 4.180 4.896 -0.716 1
1 584 . 14 1 1 A 55 55 VAL C C 55 171.811 174.465 -2.654 1
1 585 . 14 1 1 A 55 55 VAL CA C 55 59.664 61.130 -1.466 1
1 586 . 14 1 1 A 55 55 VAL CB C 55 31.827 34.648 -2.821 1
1 589 . 14 1 1 A 55 55 VAL N N 55 125.328 126.014 -0.686 1
1 590 . 14 1 1 A 56 56 ASP H H 56 8.639 8.759 -0.120 1
1 591 . 14 1 1 A 56 56 ASP HA H 56 5.250 5.563 -0.313 1
1 594 . 14 1 1 A 56 56 ASP C C 56 174.252 176.019 -1.767 1
1 595 . 14 1 1 A 56 56 ASP CA C 56 50.108 52.306 -2.198 1
1 596 . 14 1 1 A 56 56 ASP CB C 56 41.407 44.167 -2.760 1
1 597 . 14 1 1 A 56 56 ASP N N 56 125.773 125.362 0.411 1
1 598 . 14 1 1 A 57 57 GLY H H 57 7.222 8.613 -1.391 1
1 599 . 14 1 1 A 57 57 GLY HA2 H 57 3.479 3.853 -0.374 1
1 600 . 14 1 1 A 57 57 GLY HA3 H 57 2.719 3.917 -1.198 1
1 601 . 14 1 1 A 57 57 GLY C C 57 172.281 174.411 -2.130 1
1 602 . 14 1 1 A 57 57 GLY CA C 57 43.919 45.356 -1.437 1
1 603 . 14 1 1 A 57 57 GLY N N 57 105.564 110.877 -5.313 1
1 604 . 14 1 1 A 58 58 VAL H H 58 8.338 8.006 0.332 1
1 605 . 14 1 1 A 58 58 VAL HA H 58 3.860 4.271 -0.411 1
1 613 . 14 1 1 A 58 58 VAL C C 58 173.981 175.337 -1.356 1
1 614 . 14 1 1 A 58 58 VAL CA C 58 61.233 61.519 -0.286 1
1 615 . 14 1 1 A 58 58 VAL CB C 58 29.708 31.766 -2.058 1
1 618 . 14 1 1 A 58 58 VAL N N 58 121.466 120.925 0.541 1
1 619 . 14 1 1 A 59 59 ALA H H 59 9.038 8.695 0.343 1
1 620 . 14 1 1 A 59 59 ALA HA H 59 4.676 4.547 0.129 1
1 624 . 14 1 1 A 59 59 ALA C C 59 175.105 176.592 -1.487 1
1 625 . 14 1 1 A 59 59 ALA CA C 59 50.866 52.316 -1.450 1
1 626 . 14 1 1 A 59 59 ALA CB C 59 17.647 19.148 -1.501 1
1 627 . 14 1 1 A 59 59 ALA N N 59 130.928 130.513 0.415 1
1 628 . 14 1 1 A 60 60 THR H H 60 7.445 7.778 -0.333 1
1 629 . 14 1 1 A 60 60 THR HA H 60 4.642 4.680 -0.038 1
1 634 . 14 1 1 A 60 60 THR C C 60 169.528 174.337 -4.809 1
1 635 . 14 1 1 A 60 60 THR CA C 60 57.101 59.262 -2.161 1
1 636 . 14 1 1 A 60 60 THR CB C 60 67.982 72.377 -4.395 1
1 638 . 14 1 1 A 60 60 THR N N 60 109.256 108.894 0.362 1
1 639 . 14 1 1 A 61 61 THR H H 61 7.325 8.345 -1.020 1
1 640 . 14 1 1 A 61 61 THR HA H 61 2.896 3.569 -0.673 1
1 645 . 14 1 1 A 61 61 THR C C 61 169.678 172.961 -3.283 1
1 646 . 14 1 1 A 61 61 THR CA C 61 57.246 61.361 -4.115 1
1 647 . 14 1 1 A 61 61 THR CB C 61 63.794 68.359 -4.565 1
1 649 . 14 1 1 A 61 61 THR N N 61 105.670 111.772 -6.102 1
1 650 . 14 1 1 A 62 62 ARG H H 62 6.490 7.101 -0.611 1
1 651 . 14 1 1 A 62 62 ARG HA H 62 4.698 4.416 0.282 1
1 658 . 14 1 1 A 62 62 ARG C C 62 172.881 173.472 -0.591 1
1 659 . 14 1 1 A 62 62 ARG CA C 62 52.276 54.999 -2.723 1
1 660 . 14 1 1 A 62 62 ARG CB C 62 30.774 33.393 -2.619 1
1 663 . 14 1 1 A 62 62 ARG N N 62 117.485 122.239 -4.754 1
1 664 . 14 1 1 A 63 63 TYR H H 63 8.891 8.610 0.281 1
1 665 . 14 1 1 A 63 63 TYR HA H 63 4.356 5.202 -0.846 1
1 672 . 14 1 1 A 63 63 TYR C C 63 170.393 173.973 -3.580 1
1 673 . 14 1 1 A 63 63 TYR CA C 63 57.284 57.692 -0.408 1
1 674 . 14 1 1 A 63 63 TYR CB C 63 41.467 42.353 -0.886 1
1 679 . 14 1 1 A 63 63 TYR N N 63 124.712 127.257 -2.545 1
1 680 . 14 1 1 A 64 64 SER H H 64 7.244 8.320 -1.076 1
1 681 . 14 1 1 A 64 64 SER HA H 64 5.077 5.426 -0.349 1
1 684 . 14 1 1 A 64 64 SER C C 64 169.712 173.284 -3.572 1
1 685 . 14 1 1 A 64 64 SER CA C 64 54.181 55.385 -1.204 1
1 686 . 14 1 1 A 64 64 SER CB C 64 61.122 65.758 -4.636 1
1 687 . 14 1 1 A 64 64 SER N N 64 120.593 119.168 1.425 1
1 688 . 14 1 1 A 65 65 ILE H H 65 8.686 8.548 0.138 1
1 689 . 14 1 1 A 65 65 ILE HA H 65 3.937 4.846 -0.909 1
1 699 . 14 1 1 A 65 65 ILE C C 65 172.217 175.162 -2.945 1
1 700 . 14 1 1 A 65 65 ILE CA C 65 58.288 59.367 -1.079 1
1 701 . 14 1 1 A 65 65 ILE CB C 65 36.110 40.472 -4.362 1
1 705 . 14 1 1 A 65 65 ILE N N 65 127.792 124.200 3.592 1
1 706 . 14 1 1 A 66 66 GLY H H 66 7.883 8.546 -0.663 1
1 707 . 14 1 1 A 66 66 GLY HA2 H 66 4.799 4.209 0.590 1
1 708 . 14 1 1 A 66 66 GLY HA3 H 66 3.468 4.231 -0.763 1
1 709 . 14 1 1 A 66 66 GLY C C 66 171.983 173.914 -1.931 1
1 710 . 14 1 1 A 66 66 GLY CA C 66 40.534 44.683 -4.149 1
1 711 . 14 1 1 A 66 66 GLY N N 66 112.632 113.508 -0.876 1
1 712 . 14 1 1 A 67 67 GLY H H 67 8.483 8.367 0.116 1
1 713 . 14 1 1 A 67 67 GLY HA2 H 67 3.836 3.967 -0.131 1
1 714 . 14 1 1 A 67 67 GLY HA3 H 67 3.682 3.984 -0.302 1
1 715 . 14 1 1 A 67 67 GLY C C 67 172.954 174.370 -1.416 1
1 716 . 14 1 1 A 67 67 GLY CA C 67 43.568 46.128 -2.560 1
1 717 . 14 1 1 A 67 67 GLY N N 67 104.625 109.234 -4.609 1
1 718 . 14 1 1 A 68 68 LEU H H 68 8.236 7.518 0.718 1
1 719 . 14 1 1 A 68 68 LEU HA H 68 4.154 4.656 -0.502 1
1 729 . 14 1 1 A 68 68 LEU C C 68 173.838 176.075 -2.237 1
1 730 . 14 1 1 A 68 68 LEU CA C 68 51.025 53.234 -2.209 1
1 731 . 14 1 1 A 68 68 LEU CB C 68 38.837 43.481 -4.644 1
1 735 . 14 1 1 A 68 68 LEU N N 68 118.919 121.435 -2.516 1
1 736 . 14 1 1 A 69 69 SER H H 69 8.284 8.786 -0.502 1
1 737 . 14 1 1 A 69 69 SER HA H 69 4.765 5.009 -0.244 1
1 740 . 14 1 1 A 69 69 SER C C 69 170.044 172.498 -2.454 1
1 741 . 14 1 1 A 69 69 SER CA C 69 54.639 56.842 -2.203 1
1 742 . 14 1 1 A 69 69 SER CB C 69 61.216 63.373 -2.157 1
1 743 . 14 1 1 A 69 69 SER N N 69 116.361 117.522 -1.161 1
1 744 . 14 1 1 A 70 70 PRO HA H 70 5.141 4.551 0.590 1
1 751 . 14 1 1 A 70 70 PRO C C 70 174.858 177.427 -2.569 1
1 752 . 14 1 1 A 70 70 PRO CA C 70 60.810 63.895 -3.085 1
1 753 . 14 1 1 A 70 70 PRO CB C 70 30.657 32.037 -1.380 1
1 756 . 14 1 1 A 71 71 PHE H H 71 8.139 8.812 -0.673 1
1 757 . 14 1 1 A 71 71 PHE HA H 71 4.202 4.316 -0.114 1
1 765 . 14 1 1 A 71 71 PHE C C 71 172.870 174.591 -1.721 1
1 766 . 14 1 1 A 71 71 PHE CA C 71 55.410 59.167 -3.757 1
1 767 . 14 1 1 A 71 71 PHE CB C 71 36.027 38.147 -2.120 1
1 773 . 14 1 1 A 71 71 PHE N N 71 125.409 122.726 2.683 1
1 774 . 14 1 1 A 72 72 SER H H 72 8.182 7.658 0.524 1
1 775 . 14 1 1 A 72 72 SER HA H 72 4.755 4.889 -0.134 1
1 778 . 14 1 1 A 72 72 SER C C 72 168.850 172.852 -4.002 1
1 779 . 14 1 1 A 72 72 SER CA C 72 55.926 56.096 -0.170 1
1 780 . 14 1 1 A 72 72 SER CB C 72 64.208 66.335 -2.127 1
1 781 . 14 1 1 A 72 72 SER N N 72 113.509 112.329 1.180 1
1 782 . 14 1 1 A 73 73 GLU H H 73 8.422 8.706 -0.284 1
1 783 . 14 1 1 A 73 73 GLU HA H 73 4.966 5.094 -0.128 1
1 788 . 14 1 1 A 73 73 GLU C C 73 173.192 174.710 -1.518 1
1 789 . 14 1 1 A 73 73 GLU CA C 73 52.815 54.746 -1.931 1
1 790 . 14 1 1 A 73 73 GLU CB C 73 29.416 32.948 -3.532 1
1 792 . 14 1 1 A 73 73 GLU N N 73 123.046 121.690 1.356 1
1 793 . 14 1 1 A 74 74 TYR H H 74 9.205 8.643 0.562 1
1 794 . 14 1 1 A 74 74 TYR HA H 74 4.799 5.124 -0.325 1
1 801 . 14 1 1 A 74 74 TYR C C 74 170.775 174.142 -3.367 1
1 802 . 14 1 1 A 74 74 TYR CA C 74 55.291 56.864 -1.573 1
1 803 . 14 1 1 A 74 74 TYR CB C 74 42.943 42.626 0.317 1
1 808 . 14 1 1 A 74 74 TYR N N 74 125.351 124.600 0.751 1
1 809 . 14 1 1 A 75 75 ALA H H 75 8.639 8.403 0.236 1
1 810 . 14 1 1 A 75 75 ALA HA H 75 5.271 5.322 -0.051 1
1 814 . 14 1 1 A 75 75 ALA C C 75 173.698 175.696 -1.998 1
1 815 . 14 1 1 A 75 75 ALA CA C 75 47.904 50.259 -2.355 1
1 816 . 14 1 1 A 75 75 ALA CB C 75 19.634 21.198 -1.564 1
1 817 . 14 1 1 A 75 75 ALA N N 75 121.555 123.499 -1.944 1
1 818 . 14 1 1 A 76 76 PHE H H 76 9.066 9.390 -0.324 1
1 819 . 14 1 1 A 76 76 PHE HA H 76 5.496 5.379 0.117 1
1 827 . 14 1 1 A 76 76 PHE C C 76 172.268 174.935 -2.667 1
1 828 . 14 1 1 A 76 76 PHE CA C 76 54.216 57.318 -3.102 1
1 829 . 14 1 1 A 76 76 PHE CB C 76 41.901 41.581 0.320 1
1 835 . 14 1 1 A 76 76 PHE N N 76 116.545 122.919 -6.374 1
1 836 . 14 1 1 A 77 77 ARG H H 77 9.216 9.111 0.105 1
1 837 . 14 1 1 A 77 77 ARG HA H 77 4.357 5.158 -0.801 1
1 845 . 14 1 1 A 77 77 ARG C C 77 169.998 174.022 -4.024 1
1 846 . 14 1 1 A 77 77 ARG CA C 77 52.414 54.918 -2.504 1
1 847 . 14 1 1 A 77 77 ARG CB C 77 30.794 33.982 -3.188 1
1 850 . 14 1 1 A 77 77 ARG N N 77 115.738 118.884 -3.146 1
1 852 . 14 1 1 A 78 78 VAL H H 78 8.135 8.740 -0.605 1
1 853 . 14 1 1 A 78 78 VAL HA H 78 4.884 4.856 0.028 1
1 861 . 14 1 1 A 78 78 VAL C C 78 171.098 174.638 -3.540 1
1 862 . 14 1 1 A 78 78 VAL CA C 78 57.566 60.753 -3.187 1
1 863 . 14 1 1 A 78 78 VAL CB C 78 33.146 33.355 -0.209 1
1 866 . 14 1 1 A 78 78 VAL N N 78 117.942 123.737 -5.795 1
1 867 . 14 1 1 A 79 79 LEU H H 79 9.167 8.647 0.520 1
1 868 . 14 1 1 A 79 79 LEU HA H 79 4.575 5.026 -0.451 1
1 878 . 14 1 1 A 79 79 LEU C C 79 171.447 175.025 -3.578 1
1 879 . 14 1 1 A 79 79 LEU CA C 79 51.642 53.591 -1.949 1
1 880 . 14 1 1 A 79 79 LEU CB C 79 42.776 45.929 -3.153 1
1 884 . 14 1 1 A 79 79 LEU N N 79 123.913 121.437 2.476 1
1 885 . 14 1 1 A 80 80 ALA H H 80 9.325 8.619 0.706 1
1 886 . 14 1 1 A 80 80 ALA HA H 80 4.654 4.266 0.388 1
1 890 . 14 1 1 A 80 80 ALA C C 80 172.070 176.546 -4.476 1
1 891 . 14 1 1 A 80 80 ALA CA C 80 48.169 50.925 -2.756 1
1 892 . 14 1 1 A 80 80 ALA CB C 80 20.366 20.239 0.127 1
1 893 . 14 1 1 A 80 80 ALA N N 80 124.135 122.418 1.717 1
1 894 . 14 1 1 A 81 81 VAL H H 81 7.953 8.044 -0.091 1
1 895 . 14 1 1 A 81 81 VAL HA H 81 4.293 4.926 -0.633 1
1 903 . 14 1 1 A 81 81 VAL C C 81 172.873 174.159 -1.286 1
1 904 . 14 1 1 A 81 81 VAL CA C 81 58.959 60.510 -1.551 1
1 905 . 14 1 1 A 81 81 VAL CB C 81 31.412 35.139 -3.727 1
1 908 . 14 1 1 A 81 81 VAL N N 81 118.503 120.625 -2.122 1
1 909 . 14 1 1 A 82 82 ASN H H 82 8.262 8.522 -0.260 1
1 910 . 14 1 1 A 82 82 ASN HA H 82 4.945 4.984 -0.039 1
1 915 . 14 1 1 A 82 82 ASN C C 82 173.273 175.393 -2.120 1
1 916 . 14 1 1 A 82 82 ASN CA C 82 48.714 51.564 -2.850 1
1 917 . 14 1 1 A 82 82 ASN CB C 82 36.796 40.141 -3.345 1
1 918 . 14 1 1 A 82 82 ASN N N 82 125.425 123.795 1.630 1
1 920 . 14 1 1 A 83 83 SER HA H 83 3.966 4.067 -0.101 1
1 923 . 14 1 1 A 83 83 SER C C 83 172.812 176.849 -4.037 1
1 924 . 14 1 1 A 83 83 SER CA C 83 59.047 62.387 -3.340 1
1 925 . 14 1 1 A 83 83 SER CB C 83 60.406 62.884 -2.478 1
1 926 . 14 1 1 A 84 84 ILE H H 84 7.803 7.915 -0.112 1
1 927 . 14 1 1 A 84 84 ILE HA H 84 3.862 3.743 0.119 1
1 937 . 14 1 1 A 84 84 ILE C C 84 174.481 176.160 -1.679 1
1 938 . 14 1 1 A 84 84 ILE CA C 84 59.188 64.830 -5.642 1
1 939 . 14 1 1 A 84 84 ILE CB C 84 34.677 38.231 -3.554 1
1 943 . 14 1 1 A 84 84 ILE N N 84 121.222 119.729 1.493 1
1 944 . 14 1 1 A 85 85 GLY H H 85 7.435 7.292 0.143 1
1 945 . 14 1 1 A 85 85 GLY HA2 H 85 4.149 4.054 0.095 1
1 946 . 14 1 1 A 85 85 GLY HA3 H 85 3.747 4.057 -0.310 1
1 947 . 14 1 1 A 85 85 GLY C C 85 168.589 171.990 -3.401 1
1 948 . 14 1 1 A 85 85 GLY CA C 85 42.931 45.481 -2.550 1
1 949 . 14 1 1 A 85 85 GLY N N 85 106.320 105.452 0.868 1
1 950 . 14 1 1 A 86 86 ARG H H 86 8.190 8.356 -0.166 1
1 951 . 14 1 1 A 86 86 ARG HA H 86 4.452 4.888 -0.436 1
1 958 . 14 1 1 A 86 86 ARG C C 86 175.286 176.147 -0.861 1
1 959 . 14 1 1 A 86 86 ARG CA C 86 53.223 55.202 -1.979 1
1 960 . 14 1 1 A 86 86 ARG CB C 86 29.517 31.233 -1.716 1
1 963 . 14 1 1 A 86 86 ARG N N 86 118.339 117.476 0.863 1
1 964 . 14 1 1 A 87 87 GLY H H 87 8.900 8.833 0.067 1
1 965 . 14 1 1 A 87 87 GLY HA2 H 87 4.211 4.008 0.203 1
1 966 . 14 1 1 A 87 87 GLY HA3 H 87 3.967 4.016 -0.049 1
1 967 . 14 1 1 A 87 87 GLY C C 87 168.101 172.790 -4.689 1
1 968 . 14 1 1 A 87 87 GLY CA C 87 42.281 44.190 -1.909 1
1 969 . 14 1 1 A 87 87 GLY N N 87 113.482 109.300 4.182 1
1 970 . 14 1 1 A 88 88 PRO HA H 88 4.563 4.582 -0.019 1
1 977 . 14 1 1 A 88 88 PRO CA C 88 60.994 62.104 -1.110 1
1 978 . 14 1 1 A 88 88 PRO CB C 88 29.873 31.722 -1.849 1
1 981 . 14 1 1 A 89 89 PRO HA H 89 4.490 4.462 0.028 1
1 987 . 14 1 1 A 89 89 PRO C C 89 174.543 176.119 -1.576 1
1 988 . 14 1 1 A 89 89 PRO CA C 89 59.435 62.415 -2.980 1
1 989 . 14 1 1 A 89 89 PRO CB C 89 29.805 31.668 -1.863 1
1 992 . 14 1 1 A 90 90 SER H H 90 8.808 8.508 0.300 1
1 993 . 14 1 1 A 90 90 SER HA H 90 4.202 4.562 -0.360 1
1 996 . 14 1 1 A 90 90 SER C C 90 171.870 173.963 -2.093 1
1 997 . 14 1 1 A 90 90 SER CA C 90 55.868 57.637 -1.769 1
1 998 . 14 1 1 A 90 90 SER CB C 90 64.504 64.018 0.486 1
1 999 . 14 1 1 A 90 90 SER N N 90 113.781 116.907 -3.126 1
1 1000 . 14 1 1 A 91 91 GLU H H 91 8.291 8.597 -0.306 1
1 1001 . 14 1 1 A 91 91 GLU HA H 91 4.131 4.172 -0.041 1
1 1006 . 14 1 1 A 91 91 GLU C C 91 174.882 176.409 -1.527 1
1 1007 . 14 1 1 A 91 91 GLU CA C 91 54.984 56.645 -1.661 1
1 1008 . 14 1 1 A 91 91 GLU CB C 91 27.643 29.128 -1.485 1
1 1010 . 14 1 1 A 91 91 GLU N N 91 117.930 123.886 -5.956 1
1 1011 . 14 1 1 A 92 92 ALA H H 92 8.605 8.312 0.293 1
1 1012 . 14 1 1 A 92 92 ALA HA H 92 5.068 4.552 0.516 1
1 1016 . 14 1 1 A 92 92 ALA C C 92 176.227 177.821 -1.594 1
1 1017 . 14 1 1 A 92 92 ALA CA C 92 48.997 52.960 -3.963 1
1 1018 . 14 1 1 A 92 92 ALA CB C 92 17.756 19.193 -1.437 1
1 1019 . 14 1 1 A 92 92 ALA N N 92 126.421 127.279 -0.858 1
1 1020 . 14 1 1 A 93 93 VAL H H 93 9.051 9.243 -0.192 1
1 1021 . 14 1 1 A 93 93 VAL HA H 93 4.642 4.980 -0.338 1
1 1029 . 14 1 1 A 93 93 VAL C C 93 172.010 174.159 -2.149 1
1 1030 . 14 1 1 A 93 93 VAL CA C 93 57.495 59.198 -1.703 1
1 1031 . 14 1 1 A 93 93 VAL CB C 93 32.774 34.908 -2.134 1
1 1034 . 14 1 1 A 93 93 VAL N N 93 117.322 117.070 0.252 1
1 1035 . 14 1 1 A 94 94 ARG H H 94 8.470 8.813 -0.343 1
1 1036 . 14 1 1 A 94 94 ARG HA H 94 5.692 5.183 0.509 1
1 1043 . 14 1 1 A 94 94 ARG C C 94 173.635 175.473 -1.838 1
1 1044 . 14 1 1 A 94 94 ARG CA C 94 52.038 54.657 -2.619 1
1 1045 . 14 1 1 A 94 94 ARG CB C 94 30.966 31.498 -0.532 1
1 1048 . 14 1 1 A 94 94 ARG N N 94 122.258 122.982 -0.724 1
1 1049 . 14 1 1 A 95 95 ALA H H 95 9.051 8.972 0.079 1
1 1050 . 14 1 1 A 95 95 ALA HA H 95 4.642 5.247 -0.605 1
1 1054 . 14 1 1 A 95 95 ALA C C 95 172.285 175.158 -2.873 1
1 1055 . 14 1 1 A 95 95 ALA CA C 95 49.191 50.809 -1.618 1
1 1056 . 14 1 1 A 95 95 ALA CB C 95 22.562 22.110 0.452 1
1 1057 . 14 1 1 A 95 95 ALA N N 95 121.931 126.954 -5.023 1
1 1058 . 14 1 1 A 96 96 ARG H H 96 8.550 8.815 -0.265 1
1 1059 . 14 1 1 A 96 96 ARG HA H 96 5.407 5.098 0.309 1
1 1066 . 14 1 1 A 96 96 ARG C C 96 174.547 176.224 -1.677 1
1 1067 . 14 1 1 A 96 96 ARG CA C 96 51.439 55.126 -3.687 1
1 1068 . 14 1 1 A 96 96 ARG CB C 96 30.708 31.883 -1.175 1
1 1071 . 14 1 1 A 96 96 ARG N N 96 121.155 124.626 -3.471 1
1 1072 . 14 1 1 A 97 97 THR H H 97 8.797 8.820 -0.023 1
1 1073 . 14 1 1 A 97 97 THR HA H 97 4.116 4.452 -0.336 1
1 1078 . 14 1 1 A 97 97 THR C C 97 173.577 174.828 -1.251 1
1 1079 . 14 1 1 A 97 97 THR CA C 97 58.800 61.598 -2.798 1
1 1080 . 14 1 1 A 97 97 THR CB C 97 67.461 69.866 -2.405 1
1 1082 . 14 1 1 A 97 97 THR N N 97 114.657 117.327 -2.670 1
1 1083 . 14 1 1 A 98 98 GLY H H 98 7.505 8.406 -0.901 1
1 1084 . 14 1 1 A 98 98 GLY HA2 H 98 3.866 4.169 -0.303 1
1 1085 . 14 1 1 A 98 98 GLY HA3 H 98 3.743 4.231 -0.488 1
1 1086 . 14 1 1 A 98 98 GLY C C 98 170.637 173.515 -2.878 1
1 1087 . 14 1 1 A 98 98 GLY CA C 98 42.332 44.745 -2.413 1
1 1088 . 14 1 1 A 98 98 GLY N N 98 106.172 108.049 -1.877 1
1 1089 . 14 1 1 A 99 99 GLU H H 99 8.145 9.019 -0.874 1
1 1090 . 14 1 1 A 99 99 GLU HA H 99 4.210 4.547 -0.337 1
1 1095 . 14 1 1 A 99 99 GLU C C 99 174.134 176.533 -2.399 1
1 1096 . 14 1 1 A 99 99 GLU CA C 99 53.828 55.601 -1.773 1
1 1097 . 14 1 1 A 99 99 GLU CB C 99 28.774 27.735 1.039 1
1 1099 . 14 1 1 A 99 99 GLU N N 99 117.634 119.813 -2.179 1
1 1100 . 14 1 1 A 100 100 GLN H H 100 8.647 8.160 0.487 1
1 1101 . 14 1 1 A 100 100 GLN HA H 100 4.247 4.304 -0.057 1
1 1108 . 14 1 1 A 100 100 GLN C C 100 173.348 176.238 -2.890 1
1 1109 . 14 1 1 A 100 100 GLN CA C 100 53.634 57.998 -4.364 1
1 1110 . 14 1 1 A 100 100 GLN CB C 100 27.392 29.535 -2.143 1
1 1112 . 14 1 1 A 100 100 GLN N N 100 121.960 121.539 0.421 1
1 1114 . 14 1 1 A 101 101 SER H H 101 8.416 8.200 0.216 1
1 1115 . 14 1 1 A 101 101 SER HA H 101 4.418 4.885 -0.467 1
1 1117 . 14 1 1 A 101 101 SER C C 101 172.148 173.244 -1.096 1
1 1118 . 14 1 1 A 101 101 SER CA C 101 55.926 56.342 -0.416 1
1 1119 . 14 1 1 A 101 101 SER CB C 101 61.617 65.791 -4.174 1
1 1120 . 14 1 1 A 101 101 SER N N 101 118.609 110.888 7.721 1
1 1121 . 14 1 1 A 102 102 GLY H H 102 8.233 8.523 -0.290 1
1 1122 . 14 1 1 A 102 102 GLY HA2 H 102 4.080 4.176 -0.096 1
1 1123 . 14 1 1 A 102 102 GLY HA3 H 102 3.981 4.184 -0.203 1
1 1124 . 14 1 1 A 102 102 GLY C C 102 169.461 173.980 -4.519 1
1 1125 . 14 1 1 A 102 102 GLY CA C 102 42.332 44.090 -1.758 1
1 1126 . 14 1 1 A 102 102 GLY N N 102 110.483 106.918 3.565 1
1 1127 . 14 1 1 A 103 103 PRO HA H 103 4.618 4.713 -0.095 1
1 1134 . 14 1 1 A 103 103 PRO CA C 103 57.843 62.557 -4.714 1
1 1135 . 14 1 1 A 103 103 PRO CB C 103 28.671 32.378 -3.707 1
1 1 . 15 1 1 A 6 6 SER HA H 6 4.492 5.076 -0.584 1
1 4 . 15 1 1 A 6 6 SER CA C 6 55.621 56.500 -0.879 1
1 5 . 15 1 1 A 6 6 SER CB C 6 62.104 65.100 -2.996 1
1 6 . 15 1 1 A 7 7 GLY H H 7 8.244 8.189 0.055 1
1 7 . 15 1 1 A 7 7 GLY HA2 H 7 3.873 4.144 -0.271 1
1 8 . 15 1 1 A 7 7 GLY HA3 H 7 3.737 4.152 -0.415 1
1 9 . 15 1 1 A 7 7 GLY CA C 7 41.743 44.877 -3.134 1
1 10 . 15 1 1 A 7 7 GLY N N 7 109.193 110.680 -1.487 1
1 11 . 15 1 1 A 8 8 PRO HA H 8 4.286 4.571 -0.285 1
1 18 . 15 1 1 A 8 8 PRO C C 8 173.841 175.590 -1.749 1
1 19 . 15 1 1 A 8 8 PRO CA C 8 60.528 62.542 -2.014 1
1 20 . 15 1 1 A 8 8 PRO CB C 8 30.299 32.972 -2.673 1
1 23 . 15 1 1 A 9 9 LYS H H 9 8.877 8.661 0.216 1
1 24 . 15 1 1 A 9 9 LYS HA H 9 4.360 4.807 -0.447 1
1 33 . 15 1 1 A 9 9 LYS C C 9 173.492 174.347 -0.855 1
1 34 . 15 1 1 A 9 9 LYS CA C 9 52.135 53.206 -1.071 1
1 35 . 15 1 1 A 9 9 LYS CB C 9 28.798 32.700 -3.902 1
1 39 . 15 1 1 A 9 9 LYS N N 9 120.404 120.709 -0.305 1
1 40 . 15 1 1 A 10 10 PRO HA H 10 4.284 4.620 -0.336 1
1 47 . 15 1 1 A 10 10 PRO CA C 10 59.326 61.631 -2.305 1
1 48 . 15 1 1 A 10 10 PRO CB C 10 28.825 31.597 -2.772 1
1 51 . 15 1 1 A 11 11 PRO HA H 11 4.468 4.790 -0.322 1
1 58 . 15 1 1 A 11 11 PRO C C 11 171.993 176.474 -4.481 1
1 59 . 15 1 1 A 11 11 PRO CA C 11 60.422 62.730 -2.308 1
1 60 . 15 1 1 A 11 11 PRO CB C 11 30.418 32.649 -2.231 1
1 63 . 15 1 1 A 12 12 ILE H H 12 7.554 7.989 -0.435 1
1 64 . 15 1 1 A 12 12 ILE HA H 12 4.676 4.663 0.013 1
1 74 . 15 1 1 A 12 12 ILE C C 12 171.721 174.826 -3.105 1
1 75 . 15 1 1 A 12 12 ILE CA C 12 56.843 58.772 -1.929 1
1 76 . 15 1 1 A 12 12 ILE CB C 12 40.560 40.844 -0.284 1
1 80 . 15 1 1 A 12 12 ILE N N 12 109.695 116.769 -7.074 1
1 81 . 15 1 1 A 13 13 ASP H H 13 8.435 8.801 -0.366 1
1 82 . 15 1 1 A 13 13 ASP HA H 13 4.094 4.165 -0.071 1
1 85 . 15 1 1 A 13 13 ASP C C 13 171.803 174.872 -3.069 1
1 86 . 15 1 1 A 13 13 ASP CA C 13 52.610 55.021 -2.411 1
1 87 . 15 1 1 A 13 13 ASP CB C 13 36.357 39.324 -2.967 1
1 88 . 15 1 1 A 13 13 ASP N N 13 116.219 120.239 -4.020 1
1 89 . 15 1 1 A 14 14 LEU H H 14 7.483 8.001 -0.518 1
1 90 . 15 1 1 A 14 14 LEU HA H 14 4.990 5.055 -0.065 1
1 100 . 15 1 1 A 14 14 LEU C C 14 174.702 175.318 -0.616 1
1 101 . 15 1 1 A 14 14 LEU CA C 14 53.811 55.230 -1.419 1
1 102 . 15 1 1 A 14 14 LEU CB C 14 40.148 42.208 -2.060 1
1 106 . 15 1 1 A 14 14 LEU N N 14 118.463 122.018 -3.555 1
1 107 . 15 1 1 A 15 15 VAL H H 15 9.209 8.650 0.559 1
1 108 . 15 1 1 A 15 15 VAL HA H 15 4.250 4.816 -0.566 1
1 116 . 15 1 1 A 15 15 VAL C C 15 172.080 173.484 -1.404 1
1 117 . 15 1 1 A 15 15 VAL CA C 15 58.570 60.508 -1.938 1
1 118 . 15 1 1 A 15 15 VAL CB C 15 34.146 36.144 -1.998 1
1 121 . 15 1 1 A 15 15 VAL N N 15 124.833 127.097 -2.264 1
1 122 . 15 1 1 A 16 16 VAL H H 16 8.390 8.702 -0.312 1
1 123 . 15 1 1 A 16 16 VAL HA H 16 4.343 4.979 -0.636 1
1 131 . 15 1 1 A 16 16 VAL C C 16 174.672 176.155 -1.483 1
1 132 . 15 1 1 A 16 16 VAL CA C 16 59.188 59.758 -0.570 1
1 133 . 15 1 1 A 16 16 VAL CB C 16 29.187 34.163 -4.976 1
1 136 . 15 1 1 A 16 16 VAL N N 16 124.654 125.314 -0.660 1
1 137 . 15 1 1 A 17 17 THR H H 17 8.638 8.333 0.305 1
1 138 . 15 1 1 A 17 17 THR HA H 17 4.195 4.406 -0.211 1
1 143 . 15 1 1 A 17 17 THR C C 17 172.661 173.520 -0.859 1
1 144 . 15 1 1 A 17 17 THR CA C 17 60.318 63.631 -3.313 1
1 145 . 15 1 1 A 17 17 THR CB C 17 66.420 70.538 -4.118 1
1 147 . 15 1 1 A 17 17 THR N N 17 120.942 121.924 -0.982 1
1 148 . 15 1 1 A 18 18 GLU H H 18 7.361 7.697 -0.336 1
1 149 . 15 1 1 A 18 18 GLU HA H 18 4.497 4.822 -0.325 1
1 154 . 15 1 1 A 18 18 GLU C C 18 171.691 175.289 -3.598 1
1 155 . 15 1 1 A 18 18 GLU CA C 18 53.687 54.892 -1.205 1
1 156 . 15 1 1 A 18 18 GLU CB C 18 30.802 33.014 -2.212 1
1 158 . 15 1 1 A 18 18 GLU N N 18 119.088 118.712 0.376 1
1 159 . 15 1 1 A 19 19 THR H H 19 8.164 8.744 -0.580 1
1 160 . 15 1 1 A 19 19 THR HA H 19 4.912 5.091 -0.179 1
1 165 . 15 1 1 A 19 19 THR C C 19 171.606 172.909 -1.303 1
1 166 . 15 1 1 A 19 19 THR CA C 19 58.473 60.613 -2.140 1
1 167 . 15 1 1 A 19 19 THR CB C 19 70.103 71.184 -1.081 1
1 169 . 15 1 1 A 19 19 THR N N 19 112.424 114.137 -1.713 1
1 170 . 15 1 1 A 20 20 THR H H 20 8.750 8.882 -0.132 1
1 171 . 15 1 1 A 20 20 THR HA H 20 4.710 4.750 -0.040 1
1 176 . 15 1 1 A 20 20 THR C C 20 172.785 175.859 -3.074 1
1 177 . 15 1 1 A 20 20 THR CA C 20 58.059 61.075 -3.016 1
1 178 . 15 1 1 A 20 20 THR CB C 20 68.782 70.834 -2.052 1
1 180 . 15 1 1 A 20 20 THR N N 20 113.438 121.352 -7.914 1
1 181 . 15 1 1 A 21 21 ALA H H 21 8.453 8.904 -0.451 1
1 182 . 15 1 1 A 21 21 ALA HA H 21 4.079 4.417 -0.338 1
1 186 . 15 1 1 A 21 21 ALA C C 21 174.130 177.698 -3.568 1
1 187 . 15 1 1 A 21 21 ALA CA C 21 52.680 54.764 -2.084 1
1 188 . 15 1 1 A 21 21 ALA CB C 21 16.893 18.777 -1.884 1
1 189 . 15 1 1 A 21 21 ALA N N 21 120.078 124.773 -4.695 1
1 190 . 15 1 1 A 22 22 THR H H 22 7.132 7.533 -0.401 1
1 191 . 15 1 1 A 22 22 THR HA H 22 4.433 4.944 -0.511 1
1 196 . 15 1 1 A 22 22 THR C C 22 171.434 173.555 -2.121 1
1 197 . 15 1 1 A 22 22 THR CA C 22 56.836 60.485 -3.649 1
1 198 . 15 1 1 A 22 22 THR CB C 22 68.772 69.713 -0.941 1
1 200 . 15 1 1 A 22 22 THR N N 22 95.772 104.119 -8.347 1
1 201 . 15 1 1 A 23 23 SER H H 23 7.326 7.741 -0.415 1
1 202 . 15 1 1 A 23 23 SER HA H 23 5.562 5.375 0.187 1
1 205 . 15 1 1 A 23 23 SER C C 23 169.267 172.588 -3.321 1
1 206 . 15 1 1 A 23 23 SER CA C 23 54.445 57.679 -3.234 1
1 207 . 15 1 1 A 23 23 SER CB C 23 65.905 68.014 -2.109 1
1 208 . 15 1 1 A 23 23 SER N N 23 115.757 116.155 -0.398 1
1 209 . 15 1 1 A 24 24 VAL H H 24 7.983 8.621 -0.638 1
1 210 . 15 1 1 A 24 24 VAL HA H 24 4.334 4.600 -0.266 1
1 218 . 15 1 1 A 24 24 VAL C C 24 171.917 174.516 -2.599 1
1 219 . 15 1 1 A 24 24 VAL CA C 24 58.642 60.571 -1.929 1
1 220 . 15 1 1 A 24 24 VAL CB C 24 34.254 36.041 -1.787 1
1 223 . 15 1 1 A 24 24 VAL N N 24 116.595 121.336 -4.741 1
1 224 . 15 1 1 A 25 25 THR H H 25 8.636 8.927 -0.291 1
1 225 . 15 1 1 A 25 25 THR HA H 25 4.833 4.823 0.010 1
1 230 . 15 1 1 A 25 25 THR C C 25 169.721 172.752 -3.031 1
1 231 . 15 1 1 A 25 25 THR CA C 25 59.699 62.065 -2.366 1
1 232 . 15 1 1 A 25 25 THR CB C 25 67.303 69.667 -2.364 1
1 234 . 15 1 1 A 25 25 THR N N 25 121.690 121.873 -0.183 1
1 235 . 15 1 1 A 26 26 LEU H H 26 8.629 8.857 -0.228 1
1 236 . 15 1 1 A 26 26 LEU HA H 26 5.315 5.223 0.092 1
1 246 . 15 1 1 A 26 26 LEU C C 26 173.182 175.580 -2.398 1
1 247 . 15 1 1 A 26 26 LEU CA C 26 50.643 53.232 -2.589 1
1 248 . 15 1 1 A 26 26 LEU CB C 26 43.976 45.711 -1.735 1
1 252 . 15 1 1 A 26 26 LEU N N 26 126.843 129.964 -3.121 1
1 253 . 15 1 1 A 27 27 THR H H 27 8.704 9.250 -0.546 1
1 254 . 15 1 1 A 27 27 THR HA H 27 4.822 5.250 -0.428 1
1 259 . 15 1 1 A 27 27 THR C C 27 169.840 173.245 -3.405 1
1 260 . 15 1 1 A 27 27 THR CA C 27 58.077 59.381 -1.304 1
1 261 . 15 1 1 A 27 27 THR CB C 27 69.666 72.077 -2.411 1
1 263 . 15 1 1 A 27 27 THR N N 27 111.513 114.926 -3.413 1
1 264 . 15 1 1 A 28 28 TRP H H 28 7.339 8.111 -0.772 1
1 265 . 15 1 1 A 28 28 TRP HA H 28 4.963 5.398 -0.435 1
1 274 . 15 1 1 A 28 28 TRP C C 28 170.637 172.405 -1.768 1
1 275 . 15 1 1 A 28 28 TRP CA C 28 54.438 55.680 -1.242 1
1 276 . 15 1 1 A 28 28 TRP CB C 28 27.497 31.291 -3.794 1
1 282 . 15 1 1 A 28 28 TRP N N 28 117.895 118.902 -1.007 1
1 284 . 15 1 1 A 29 29 ASP H H 29 8.696 9.245 -0.549 1
1 285 . 15 1 1 A 29 29 ASP HA H 29 4.971 5.120 -0.149 1
1 288 . 15 1 1 A 29 29 ASP C C 29 174.901 176.923 -2.022 1
1 289 . 15 1 1 A 29 29 ASP CA C 29 50.178 52.222 -2.044 1
1 290 . 15 1 1 A 29 29 ASP CB C 29 42.291 43.296 -1.005 1
1 291 . 15 1 1 A 29 29 ASP N N 29 117.477 121.789 -4.312 1
1 292 . 15 1 1 A 30 30 SER H H 30 8.800 8.893 -0.093 1
1 293 . 15 1 1 A 30 30 SER HA H 30 4.389 4.110 0.279 1
1 296 . 15 1 1 A 30 30 SER C C 30 174.032 175.079 -1.047 1
1 297 . 15 1 1 A 30 30 SER CA C 30 58.694 61.960 -3.266 1
1 298 . 15 1 1 A 30 30 SER CB C 30 62.428 63.404 -0.976 1
1 299 . 15 1 1 A 30 30 SER N N 30 118.275 120.146 -1.871 1
1 300 . 15 1 1 A 31 31 GLY H H 31 8.759 8.334 0.425 1
1 301 . 15 1 1 A 31 31 GLY HA2 H 31 4.239 4.028 0.211 1
1 302 . 15 1 1 A 31 31 GLY HA3 H 31 3.555 4.062 -0.507 1
1 303 . 15 1 1 A 31 31 GLY C C 31 171.325 173.948 -2.623 1
1 304 . 15 1 1 A 31 31 GLY CA C 31 43.637 45.443 -1.806 1
1 305 . 15 1 1 A 31 31 GLY N N 31 107.961 109.529 -1.568 1
1 306 . 15 1 1 A 32 32 ASN H H 32 8.173 8.037 0.136 1
1 307 . 15 1 1 A 32 32 ASN HA H 32 4.749 5.042 -0.293 1
1 312 . 15 1 1 A 32 32 ASN C C 32 171.355 175.342 -3.987 1
1 313 . 15 1 1 A 32 32 ASN CA C 32 50.795 52.887 -2.092 1
1 314 . 15 1 1 A 32 32 ASN CB C 32 41.508 39.699 1.809 1
1 315 . 15 1 1 A 32 32 ASN N N 32 117.781 119.724 -1.943 1
1 317 . 15 1 1 A 33 33 SER HA H 33 4.291 4.674 -0.383 1
1 320 . 15 1 1 A 33 33 SER C C 33 172.449 174.254 -1.805 1
1 321 . 15 1 1 A 33 33 SER CA C 33 56.733 58.683 -1.950 1
1 322 . 15 1 1 A 33 33 SER CB C 33 60.884 64.007 -3.123 1
1 323 . 15 1 1 A 34 34 GLU H H 34 7.731 7.576 0.155 1
1 324 . 15 1 1 A 34 34 GLU HA H 34 4.556 4.645 -0.089 1
1 329 . 15 1 1 A 34 34 GLU C C 34 171.792 174.079 -2.287 1
1 330 . 15 1 1 A 34 34 GLU CA C 34 51.818 53.526 -1.708 1
1 331 . 15 1 1 A 34 34 GLU CB C 34 26.891 30.003 -3.112 1
1 333 . 15 1 1 A 34 34 GLU N N 34 122.319 119.844 2.475 1
1 334 . 15 1 1 A 35 35 PRO HA H 35 4.165 4.780 -0.615 1
1 341 . 15 1 1 A 35 35 PRO C C 35 174.288 176.665 -2.377 1
1 342 . 15 1 1 A 35 35 PRO CA C 35 61.374 62.701 -1.327 1
1 343 . 15 1 1 A 35 35 PRO CB C 35 29.887 31.379 -1.492 1
1 346 . 15 1 1 A 36 36 VAL H H 36 8.348 8.599 -0.251 1
1 347 . 15 1 1 A 36 36 VAL HA H 36 3.899 4.219 -0.320 1
1 355 . 15 1 1 A 36 36 VAL C C 36 173.344 176.914 -3.570 1
1 356 . 15 1 1 A 36 36 VAL CA C 36 59.014 62.806 -3.792 1
1 357 . 15 1 1 A 36 36 VAL CB C 36 31.865 31.843 0.022 1
1 360 . 15 1 1 A 36 36 VAL N N 36 122.051 123.678 -1.627 1
1 361 . 15 1 1 A 37 37 THR H H 37 8.780 8.648 0.132 1
1 362 . 15 1 1 A 37 37 THR HA H 37 3.923 4.315 -0.392 1
1 367 . 15 1 1 A 37 37 THR C C 37 172.171 174.697 -2.526 1
1 368 . 15 1 1 A 37 37 THR CA C 37 63.155 64.260 -1.105 1
1 369 . 15 1 1 A 37 37 THR CB C 37 65.941 69.365 -3.424 1
1 371 . 15 1 1 A 37 37 THR N N 37 122.351 119.383 2.968 1
1 372 . 15 1 1 A 38 38 TYR H H 38 7.304 7.671 -0.367 1
1 373 . 15 1 1 A 38 38 TYR HA H 38 4.439 5.095 -0.656 1
1 380 . 15 1 1 A 38 38 TYR C C 38 168.385 172.828 -4.443 1
1 381 . 15 1 1 A 38 38 TYR CA C 38 54.101 56.568 -2.467 1
1 382 . 15 1 1 A 38 38 TYR CB C 38 35.874 39.947 -4.073 1
1 387 . 15 1 1 A 38 38 TYR N N 38 113.984 115.330 -1.346 1
1 388 . 15 1 1 A 39 39 TYR H H 39 9.445 8.850 0.595 1
1 389 . 15 1 1 A 39 39 TYR HA H 39 5.293 5.223 0.070 1
1 396 . 15 1 1 A 39 39 TYR C C 39 172.781 175.693 -2.912 1
1 397 . 15 1 1 A 39 39 TYR CA C 39 54.322 55.522 -1.200 1
1 398 . 15 1 1 A 39 39 TYR CB C 39 39.035 40.507 -1.472 1
1 401 . 15 1 1 A 39 39 TYR N N 39 115.092 118.536 -3.444 1
1 402 . 15 1 1 A 40 40 GLY H H 40 8.870 8.456 0.414 1
1 403 . 15 1 1 A 40 40 GLY HA2 H 40 5.137 4.088 1.049 1
1 404 . 15 1 1 A 40 40 GLY HA3 H 40 3.285 4.180 -0.895 1
1 405 . 15 1 1 A 40 40 GLY C C 40 169.688 172.936 -3.248 1
1 406 . 15 1 1 A 40 40 GLY CA C 40 41.415 44.680 -3.265 1
1 407 . 15 1 1 A 40 40 GLY N N 40 106.573 111.672 -5.099 1
1 408 . 15 1 1 A 41 41 ILE H H 41 8.917 8.580 0.337 1
1 409 . 15 1 1 A 41 41 ILE HA H 41 4.527 4.929 -0.402 1
1 419 . 15 1 1 A 41 41 ILE C C 41 172.692 174.669 -1.977 1
1 420 . 15 1 1 A 41 41 ILE CA C 41 57.597 59.982 -2.385 1
1 421 . 15 1 1 A 41 41 ILE CB C 41 37.840 42.181 -4.341 1
1 425 . 15 1 1 A 41 41 ILE N N 41 121.746 120.890 0.856 1
1 426 . 15 1 1 A 42 42 GLN H H 42 9.063 8.855 0.208 1
1 427 . 15 1 1 A 42 42 GLN HA H 42 5.655 5.639 0.016 1
1 434 . 15 1 1 A 42 42 GLN C C 42 172.841 174.495 -1.654 1
1 435 . 15 1 1 A 42 42 GLN CA C 42 50.789 54.318 -3.529 1
1 436 . 15 1 1 A 42 42 GLN CB C 42 28.898 32.943 -4.045 1
1 438 . 15 1 1 A 42 42 GLN N N 42 125.141 125.596 -0.455 1
1 440 . 15 1 1 A 43 43 TYR H H 43 9.066 8.871 0.195 1
1 441 . 15 1 1 A 43 43 TYR HA H 43 5.922 5.912 0.010 1
1 448 . 15 1 1 A 43 43 TYR C C 43 171.219 172.829 -1.610 1
1 449 . 15 1 1 A 43 43 TYR CA C 43 53.349 56.193 -2.844 1
1 450 . 15 1 1 A 43 43 TYR CB C 43 41.074 42.109 -1.035 1
1 455 . 15 1 1 A 43 43 TYR N N 43 118.018 119.097 -1.079 1
1 456 . 15 1 1 A 44 44 ARG H H 44 8.400 8.604 -0.204 1
1 457 . 15 1 1 A 44 44 ARG HA H 44 4.542 4.462 0.080 1
1 464 . 15 1 1 A 44 44 ARG C C 44 171.974 174.101 -2.127 1
1 465 . 15 1 1 A 44 44 ARG CA C 44 52.453 54.934 -2.481 1
1 466 . 15 1 1 A 44 44 ARG CB C 44 31.125 33.008 -1.883 1
1 469 . 15 1 1 A 44 44 ARG N N 44 115.214 120.544 -5.330 1
1 470 . 15 1 1 A 45 45 ALA H H 45 8.846 8.205 0.641 1
1 471 . 15 1 1 A 45 45 ALA HA H 45 3.894 2.293 1.601 1
1 475 . 15 1 1 A 45 45 ALA C C 45 175.721 177.030 -1.309 1
1 476 . 15 1 1 A 45 45 ALA CA C 45 50.372 51.851 -1.479 1
1 477 . 15 1 1 A 45 45 ALA CB C 45 15.732 18.836 -3.104 1
1 478 . 15 1 1 A 45 45 ALA N N 45 126.463 127.100 -0.637 1
1 479 . 15 1 1 A 46 46 ALA H H 46 8.282 8.004 0.278 1
1 480 . 15 1 1 A 46 46 ALA HA H 46 3.922 3.816 0.106 1
1 484 . 15 1 1 A 46 46 ALA C C 46 176.236 178.193 -1.957 1
1 485 . 15 1 1 A 46 46 ALA CA C 46 50.773 53.586 -2.813 1
1 486 . 15 1 1 A 46 46 ALA CB C 46 16.244 18.783 -2.539 1
1 487 . 15 1 1 A 46 46 ALA N N 46 126.301 125.249 1.052 1
1 488 . 15 1 1 A 47 47 GLY HA2 H 47 3.882 3.929 -0.047 1
1 489 . 15 1 1 A 47 47 GLY HA3 H 47 3.695 3.958 -0.263 1
1 490 . 15 1 1 A 47 47 GLY C C 47 171.795 174.546 -2.751 1
1 491 . 15 1 1 A 47 47 GLY CA C 47 43.327 45.887 -2.560 1
1 492 . 15 1 1 A 48 48 THR H H 48 7.145 7.880 -0.735 1
1 493 . 15 1 1 A 48 48 THR HA H 48 4.417 4.139 0.278 1
1 498 . 15 1 1 A 48 48 THR C C 48 171.325 174.709 -3.384 1
1 499 . 15 1 1 A 48 48 THR CA C 48 58.271 63.182 -4.911 1
1 500 . 15 1 1 A 48 48 THR CB C 48 68.846 69.095 -0.249 1
1 502 . 15 1 1 A 48 48 THR N N 48 110.190 116.459 -6.269 1
1 503 . 15 1 1 A 49 49 GLU H H 49 8.346 8.554 -0.208 1
1 504 . 15 1 1 A 49 49 GLU HA H 49 4.277 4.612 -0.335 1
1 509 . 15 1 1 A 49 49 GLU C C 49 174.109 175.914 -1.805 1
1 510 . 15 1 1 A 49 49 GLU CA C 49 52.909 55.771 -2.862 1
1 511 . 15 1 1 A 49 49 GLU CB C 49 27.845 28.498 -0.653 1
1 513 . 15 1 1 A 49 49 GLU N N 49 119.985 126.422 -6.437 1
1 514 . 15 1 1 A 50 50 GLY H H 50 7.617 8.500 -0.883 1
1 515 . 15 1 1 A 50 50 GLY HA2 H 50 3.935 4.192 -0.257 1
1 516 . 15 1 1 A 50 50 GLY HA3 H 50 3.935 4.225 -0.290 1
1 517 . 15 1 1 A 50 50 GLY C C 50 168.223 172.426 -4.203 1
1 518 . 15 1 1 A 50 50 GLY CA C 50 42.121 44.276 -2.155 1
1 519 . 15 1 1 A 50 50 GLY N N 50 108.670 111.202 -2.532 1
1 520 . 15 1 1 A 51 51 PRO HA H 51 4.298 4.698 -0.400 1
1 527 . 15 1 1 A 51 51 PRO C C 51 175.067 177.088 -2.021 1
1 528 . 15 1 1 A 51 51 PRO CA C 51 60.175 63.095 -2.920 1
1 529 . 15 1 1 A 51 51 PRO CB C 51 30.052 32.118 -2.066 1
1 532 . 15 1 1 A 52 52 PHE H H 52 8.442 8.691 -0.249 1
1 533 . 15 1 1 A 52 52 PHE HA H 52 3.981 4.661 -0.680 1
1 541 . 15 1 1 A 52 52 PHE C C 52 175.141 175.760 -0.619 1
1 542 . 15 1 1 A 52 52 PHE CA C 52 56.808 57.844 -1.036 1
1 543 . 15 1 1 A 52 52 PHE CB C 52 36.830 39.556 -2.726 1
1 549 . 15 1 1 A 52 52 PHE N N 52 118.707 122.506 -3.799 1
1 550 . 15 1 1 A 53 53 GLN H H 53 8.778 8.180 0.598 1
1 551 . 15 1 1 A 53 53 GLN HA H 53 4.149 4.262 -0.113 1
1 558 . 15 1 1 A 53 53 GLN C C 53 172.773 175.030 -2.257 1
1 559 . 15 1 1 A 53 53 GLN CA C 53 52.999 56.501 -3.502 1
1 560 . 15 1 1 A 53 53 GLN CB C 53 26.962 29.085 -2.123 1
1 562 . 15 1 1 A 53 53 GLN N N 53 122.164 121.583 0.581 1
1 564 . 15 1 1 A 54 54 GLU H H 54 8.432 8.581 -0.149 1
1 565 . 15 1 1 A 54 54 GLU HA H 54 5.533 5.299 0.234 1
1 570 . 15 1 1 A 54 54 GLU C C 54 173.930 174.938 -1.008 1
1 571 . 15 1 1 A 54 54 GLU CA C 54 52.981 55.022 -2.041 1
1 572 . 15 1 1 A 54 54 GLU CB C 54 31.712 33.455 -1.743 1
1 574 . 15 1 1 A 54 54 GLU N N 54 119.688 122.339 -2.651 1
1 575 . 15 1 1 A 55 55 VAL H H 55 9.077 8.748 0.329 1
1 576 . 15 1 1 A 55 55 VAL HA H 55 4.180 4.841 -0.661 1
1 584 . 15 1 1 A 55 55 VAL C C 55 171.811 174.199 -2.388 1
1 585 . 15 1 1 A 55 55 VAL CA C 55 59.664 61.162 -1.498 1
1 586 . 15 1 1 A 55 55 VAL CB C 55 31.827 34.877 -3.050 1
1 589 . 15 1 1 A 55 55 VAL N N 55 125.328 125.941 -0.613 1
1 590 . 15 1 1 A 56 56 ASP H H 56 8.639 8.933 -0.294 1
1 591 . 15 1 1 A 56 56 ASP HA H 56 5.250 5.254 -0.004 1
1 594 . 15 1 1 A 56 56 ASP C C 56 174.252 176.340 -2.088 1
1 595 . 15 1 1 A 56 56 ASP CA C 56 50.108 52.733 -2.625 1
1 596 . 15 1 1 A 56 56 ASP CB C 56 41.407 44.201 -2.794 1
1 597 . 15 1 1 A 56 56 ASP N N 56 125.773 125.659 0.114 1
1 598 . 15 1 1 A 57 57 GLY H H 57 7.222 8.584 -1.362 1
1 599 . 15 1 1 A 57 57 GLY HA2 H 57 3.479 3.855 -0.376 1
1 600 . 15 1 1 A 57 57 GLY HA3 H 57 2.719 3.923 -1.204 1
1 601 . 15 1 1 A 57 57 GLY C C 57 172.281 174.511 -2.230 1
1 602 . 15 1 1 A 57 57 GLY CA C 57 43.919 45.304 -1.385 1
1 603 . 15 1 1 A 57 57 GLY N N 57 105.564 110.719 -5.155 1
1 604 . 15 1 1 A 58 58 VAL H H 58 8.338 7.986 0.352 1
1 605 . 15 1 1 A 58 58 VAL HA H 58 3.860 4.247 -0.387 1
1 613 . 15 1 1 A 58 58 VAL C C 58 173.981 175.431 -1.450 1
1 614 . 15 1 1 A 58 58 VAL CA C 58 61.233 61.791 -0.558 1
1 615 . 15 1 1 A 58 58 VAL CB C 58 29.708 30.645 -0.937 1
1 618 . 15 1 1 A 58 58 VAL N N 58 121.466 121.821 -0.355 1
1 619 . 15 1 1 A 59 59 ALA H H 59 9.038 8.719 0.319 1
1 620 . 15 1 1 A 59 59 ALA HA H 59 4.676 4.536 0.140 1
1 624 . 15 1 1 A 59 59 ALA C C 59 175.105 176.757 -1.652 1
1 625 . 15 1 1 A 59 59 ALA CA C 59 50.866 52.273 -1.407 1
1 626 . 15 1 1 A 59 59 ALA CB C 59 17.647 19.202 -1.555 1
1 627 . 15 1 1 A 59 59 ALA N N 59 130.928 130.376 0.552 1
1 628 . 15 1 1 A 60 60 THR H H 60 7.445 7.742 -0.297 1
1 629 . 15 1 1 A 60 60 THR HA H 60 4.642 4.673 -0.031 1
1 634 . 15 1 1 A 60 60 THR C C 60 169.528 174.208 -4.680 1
1 635 . 15 1 1 A 60 60 THR CA C 60 57.101 59.190 -2.089 1
1 636 . 15 1 1 A 60 60 THR CB C 60 67.982 72.418 -4.436 1
1 638 . 15 1 1 A 60 60 THR N N 60 109.256 109.205 0.051 1
1 639 . 15 1 1 A 61 61 THR H H 61 7.325 8.420 -1.095 1
1 640 . 15 1 1 A 61 61 THR HA H 61 2.896 3.698 -0.802 1
1 645 . 15 1 1 A 61 61 THR C C 61 169.678 173.134 -3.456 1
1 646 . 15 1 1 A 61 61 THR CA C 61 57.246 61.545 -4.299 1
1 647 . 15 1 1 A 61 61 THR CB C 61 63.794 68.388 -4.594 1
1 649 . 15 1 1 A 61 61 THR N N 61 105.670 111.783 -6.113 1
1 650 . 15 1 1 A 62 62 ARG H H 62 6.490 7.094 -0.604 1
1 651 . 15 1 1 A 62 62 ARG HA H 62 4.698 4.185 0.513 1
1 658 . 15 1 1 A 62 62 ARG C C 62 172.881 173.380 -0.499 1
1 659 . 15 1 1 A 62 62 ARG CA C 62 52.276 55.069 -2.793 1
1 660 . 15 1 1 A 62 62 ARG CB C 62 30.774 33.498 -2.724 1
1 663 . 15 1 1 A 62 62 ARG N N 62 117.485 121.763 -4.278 1
1 664 . 15 1 1 A 63 63 TYR H H 63 8.891 8.466 0.425 1
1 665 . 15 1 1 A 63 63 TYR HA H 63 4.356 5.047 -0.691 1
1 672 . 15 1 1 A 63 63 TYR C C 63 170.393 173.985 -3.592 1
1 673 . 15 1 1 A 63 63 TYR CA C 63 57.284 57.792 -0.508 1
1 674 . 15 1 1 A 63 63 TYR CB C 63 41.467 42.224 -0.757 1
1 679 . 15 1 1 A 63 63 TYR N N 63 124.712 126.837 -2.125 1
1 680 . 15 1 1 A 64 64 SER H H 64 7.244 8.440 -1.196 1
1 681 . 15 1 1 A 64 64 SER HA H 64 5.077 5.506 -0.429 1
1 684 . 15 1 1 A 64 64 SER C C 64 169.712 173.362 -3.650 1
1 685 . 15 1 1 A 64 64 SER CA C 64 54.181 55.562 -1.381 1
1 686 . 15 1 1 A 64 64 SER CB C 64 61.122 64.914 -3.792 1
1 687 . 15 1 1 A 64 64 SER N N 64 120.593 120.310 0.283 1
1 688 . 15 1 1 A 65 65 ILE H H 65 8.686 8.958 -0.272 1
1 689 . 15 1 1 A 65 65 ILE HA H 65 3.937 4.848 -0.911 1
1 699 . 15 1 1 A 65 65 ILE C C 65 172.217 175.300 -3.083 1
1 700 . 15 1 1 A 65 65 ILE CA C 65 58.288 59.660 -1.372 1
1 701 . 15 1 1 A 65 65 ILE CB C 65 36.110 39.582 -3.472 1
1 705 . 15 1 1 A 65 65 ILE N N 65 127.792 125.459 2.333 1
1 706 . 15 1 1 A 66 66 GLY H H 66 7.883 8.564 -0.681 1
1 707 . 15 1 1 A 66 66 GLY HA2 H 66 4.799 4.313 0.486 1
1 708 . 15 1 1 A 66 66 GLY HA3 H 66 3.468 4.342 -0.874 1
1 709 . 15 1 1 A 66 66 GLY C C 66 171.983 174.013 -2.030 1
1 710 . 15 1 1 A 66 66 GLY CA C 66 40.534 44.909 -4.375 1
1 711 . 15 1 1 A 66 66 GLY N N 66 112.632 113.162 -0.530 1
1 712 . 15 1 1 A 67 67 GLY H H 67 8.483 8.569 -0.086 1
1 713 . 15 1 1 A 67 67 GLY HA2 H 67 3.836 3.975 -0.139 1
1 714 . 15 1 1 A 67 67 GLY HA3 H 67 3.682 4.001 -0.319 1
1 715 . 15 1 1 A 67 67 GLY C C 67 172.954 174.173 -1.219 1
1 716 . 15 1 1 A 67 67 GLY CA C 67 43.568 45.540 -1.972 1
1 717 . 15 1 1 A 67 67 GLY N N 67 104.625 110.805 -6.180 1
1 718 . 15 1 1 A 68 68 LEU H H 68 8.236 7.614 0.622 1
1 719 . 15 1 1 A 68 68 LEU HA H 68 4.154 4.657 -0.503 1
1 729 . 15 1 1 A 68 68 LEU C C 68 173.838 175.915 -2.077 1
1 730 . 15 1 1 A 68 68 LEU CA C 68 51.025 53.110 -2.085 1
1 731 . 15 1 1 A 68 68 LEU CB C 68 38.837 43.496 -4.659 1
1 735 . 15 1 1 A 68 68 LEU N N 68 118.919 121.377 -2.458 1
1 736 . 15 1 1 A 69 69 SER H H 69 8.284 8.614 -0.330 1
1 737 . 15 1 1 A 69 69 SER HA H 69 4.765 5.024 -0.259 1
1 740 . 15 1 1 A 69 69 SER C C 69 170.044 172.293 -2.249 1
1 741 . 15 1 1 A 69 69 SER CA C 69 54.639 56.731 -2.092 1
1 742 . 15 1 1 A 69 69 SER CB C 69 61.216 63.253 -2.037 1
1 743 . 15 1 1 A 69 69 SER N N 69 116.361 117.088 -0.727 1
1 744 . 15 1 1 A 70 70 PRO HA H 70 5.141 4.722 0.419 1
1 751 . 15 1 1 A 70 70 PRO C C 70 174.858 177.465 -2.607 1
1 752 . 15 1 1 A 70 70 PRO CA C 70 60.810 63.813 -3.003 1
1 753 . 15 1 1 A 70 70 PRO CB C 70 30.657 32.230 -1.573 1
1 756 . 15 1 1 A 71 71 PHE H H 71 8.139 9.291 -1.152 1
1 757 . 15 1 1 A 71 71 PHE HA H 71 4.202 4.258 -0.056 1
1 765 . 15 1 1 A 71 71 PHE C C 71 172.870 174.467 -1.597 1
1 766 . 15 1 1 A 71 71 PHE CA C 71 55.410 58.916 -3.506 1
1 767 . 15 1 1 A 71 71 PHE CB C 71 36.027 37.637 -1.610 1
1 773 . 15 1 1 A 71 71 PHE N N 71 125.409 123.307 2.102 1
1 774 . 15 1 1 A 72 72 SER H H 72 8.182 7.579 0.603 1
1 775 . 15 1 1 A 72 72 SER HA H 72 4.755 5.097 -0.342 1
1 778 . 15 1 1 A 72 72 SER C C 72 168.850 172.481 -3.631 1
1 779 . 15 1 1 A 72 72 SER CA C 72 55.926 56.456 -0.530 1
1 780 . 15 1 1 A 72 72 SER CB C 72 64.208 66.990 -2.782 1
1 781 . 15 1 1 A 72 72 SER N N 72 113.509 110.335 3.174 1
1 782 . 15 1 1 A 73 73 GLU H H 73 8.422 8.852 -0.430 1
1 783 . 15 1 1 A 73 73 GLU HA H 73 4.966 5.136 -0.170 1
1 788 . 15 1 1 A 73 73 GLU C C 73 173.192 174.720 -1.528 1
1 789 . 15 1 1 A 73 73 GLU CA C 73 52.815 54.982 -2.167 1
1 790 . 15 1 1 A 73 73 GLU CB C 73 29.416 32.125 -2.709 1
1 792 . 15 1 1 A 73 73 GLU N N 73 123.046 123.657 -0.611 1
1 793 . 15 1 1 A 74 74 TYR H H 74 9.205 8.724 0.481 1
1 794 . 15 1 1 A 74 74 TYR HA H 74 4.799 4.971 -0.172 1
1 801 . 15 1 1 A 74 74 TYR C C 74 170.775 174.203 -3.428 1
1 802 . 15 1 1 A 74 74 TYR CA C 74 55.291 56.667 -1.376 1
1 803 . 15 1 1 A 74 74 TYR CB C 74 42.943 42.583 0.360 1
1 808 . 15 1 1 A 74 74 TYR N N 74 125.351 124.346 1.005 1
1 809 . 15 1 1 A 75 75 ALA H H 75 8.639 8.212 0.427 1
1 810 . 15 1 1 A 75 75 ALA HA H 75 5.271 5.281 -0.010 1
1 814 . 15 1 1 A 75 75 ALA C C 75 173.698 175.977 -2.279 1
1 815 . 15 1 1 A 75 75 ALA CA C 75 47.904 50.336 -2.432 1
1 816 . 15 1 1 A 75 75 ALA CB C 75 19.634 20.573 -0.939 1
1 817 . 15 1 1 A 75 75 ALA N N 75 121.555 124.750 -3.195 1
1 818 . 15 1 1 A 76 76 PHE H H 76 9.066 9.494 -0.428 1
1 819 . 15 1 1 A 76 76 PHE HA H 76 5.496 5.252 0.244 1
1 827 . 15 1 1 A 76 76 PHE C C 76 172.268 175.489 -3.221 1
1 828 . 15 1 1 A 76 76 PHE CA C 76 54.216 56.996 -2.780 1
1 829 . 15 1 1 A 76 76 PHE CB C 76 41.901 41.466 0.435 1
1 835 . 15 1 1 A 76 76 PHE N N 76 116.545 123.317 -6.772 1
1 836 . 15 1 1 A 77 77 ARG H H 77 9.216 8.984 0.232 1
1 837 . 15 1 1 A 77 77 ARG HA H 77 4.357 5.192 -0.835 1
1 845 . 15 1 1 A 77 77 ARG C C 77 169.998 174.099 -4.101 1
1 846 . 15 1 1 A 77 77 ARG CA C 77 52.414 54.674 -2.260 1
1 847 . 15 1 1 A 77 77 ARG CB C 77 30.794 34.046 -3.252 1
1 850 . 15 1 1 A 77 77 ARG N N 77 115.738 119.285 -3.547 1
1 852 . 15 1 1 A 78 78 VAL H H 78 8.135 8.782 -0.647 1
1 853 . 15 1 1 A 78 78 VAL HA H 78 4.884 4.871 0.013 1
1 861 . 15 1 1 A 78 78 VAL C C 78 171.098 174.840 -3.742 1
1 862 . 15 1 1 A 78 78 VAL CA C 78 57.566 60.838 -3.272 1
1 863 . 15 1 1 A 78 78 VAL CB C 78 33.146 33.402 -0.256 1
1 866 . 15 1 1 A 78 78 VAL N N 78 117.942 123.550 -5.608 1
1 867 . 15 1 1 A 79 79 LEU H H 79 9.167 8.526 0.641 1
1 868 . 15 1 1 A 79 79 LEU HA H 79 4.575 4.982 -0.407 1
1 878 . 15 1 1 A 79 79 LEU C C 79 171.447 174.932 -3.485 1
1 879 . 15 1 1 A 79 79 LEU CA C 79 51.642 53.423 -1.781 1
1 880 . 15 1 1 A 79 79 LEU CB C 79 42.776 45.615 -2.839 1
1 884 . 15 1 1 A 79 79 LEU N N 79 123.913 120.200 3.713 1
1 885 . 15 1 1 A 80 80 ALA H H 80 9.325 8.524 0.801 1
1 886 . 15 1 1 A 80 80 ALA HA H 80 4.654 3.611 1.043 1
1 890 . 15 1 1 A 80 80 ALA C C 80 172.070 176.934 -4.864 1
1 891 . 15 1 1 A 80 80 ALA CA C 80 48.169 51.342 -3.173 1
1 892 . 15 1 1 A 80 80 ALA CB C 80 20.366 19.384 0.982 1
1 893 . 15 1 1 A 80 80 ALA N N 80 124.135 123.595 0.540 1
1 894 . 15 1 1 A 81 81 VAL H H 81 7.953 8.090 -0.137 1
1 895 . 15 1 1 A 81 81 VAL HA H 81 4.293 4.861 -0.568 1
1 903 . 15 1 1 A 81 81 VAL C C 81 172.873 174.262 -1.389 1
1 904 . 15 1 1 A 81 81 VAL CA C 81 58.959 60.437 -1.478 1
1 905 . 15 1 1 A 81 81 VAL CB C 81 31.412 35.171 -3.759 1
1 908 . 15 1 1 A 81 81 VAL N N 81 118.503 120.381 -1.878 1
1 909 . 15 1 1 A 82 82 ASN H H 82 8.262 8.325 -0.063 1
1 910 . 15 1 1 A 82 82 ASN HA H 82 4.945 5.384 -0.439 1
1 915 . 15 1 1 A 82 82 ASN C C 82 173.273 175.313 -2.040 1
1 916 . 15 1 1 A 82 82 ASN CA C 82 48.714 51.791 -3.077 1
1 917 . 15 1 1 A 82 82 ASN CB C 82 36.796 40.081 -3.285 1
1 918 . 15 1 1 A 82 82 ASN N N 82 125.425 123.713 1.712 1
1 920 . 15 1 1 A 83 83 SER HA H 83 3.966 4.089 -0.123 1
1 923 . 15 1 1 A 83 83 SER C C 83 172.812 176.854 -4.042 1
1 924 . 15 1 1 A 83 83 SER CA C 83 59.047 62.453 -3.406 1
1 925 . 15 1 1 A 83 83 SER CB C 83 60.406 62.852 -2.446 1
1 926 . 15 1 1 A 84 84 ILE H H 84 7.803 7.996 -0.193 1
1 927 . 15 1 1 A 84 84 ILE HA H 84 3.862 3.744 0.118 1
1 937 . 15 1 1 A 84 84 ILE C C 84 174.481 176.227 -1.746 1
1 938 . 15 1 1 A 84 84 ILE CA C 84 59.188 64.200 -5.012 1
1 939 . 15 1 1 A 84 84 ILE CB C 84 34.677 38.278 -3.601 1
1 943 . 15 1 1 A 84 84 ILE N N 84 121.222 119.879 1.343 1
1 944 . 15 1 1 A 85 85 GLY H H 85 7.435 7.082 0.353 1
1 945 . 15 1 1 A 85 85 GLY HA2 H 85 4.149 4.051 0.098 1
1 946 . 15 1 1 A 85 85 GLY HA3 H 85 3.747 4.060 -0.313 1
1 947 . 15 1 1 A 85 85 GLY C C 85 168.589 171.865 -3.276 1
1 948 . 15 1 1 A 85 85 GLY CA C 85 42.931 45.451 -2.520 1
1 949 . 15 1 1 A 85 85 GLY N N 85 106.320 105.791 0.529 1
1 950 . 15 1 1 A 86 86 ARG H H 86 8.190 8.330 -0.140 1
1 951 . 15 1 1 A 86 86 ARG HA H 86 4.452 4.394 0.058 1
1 958 . 15 1 1 A 86 86 ARG C C 86 175.286 176.873 -1.587 1
1 959 . 15 1 1 A 86 86 ARG CA C 86 53.223 55.066 -1.843 1
1 960 . 15 1 1 A 86 86 ARG CB C 86 29.517 31.002 -1.485 1
1 963 . 15 1 1 A 86 86 ARG N N 86 118.339 120.736 -2.397 1
1 964 . 15 1 1 A 87 87 GLY H H 87 8.900 8.795 0.105 1
1 965 . 15 1 1 A 87 87 GLY HA2 H 87 4.211 4.004 0.207 1
1 966 . 15 1 1 A 87 87 GLY HA3 H 87 3.967 4.023 -0.056 1
1 967 . 15 1 1 A 87 87 GLY C C 87 168.101 172.787 -4.686 1
1 968 . 15 1 1 A 87 87 GLY CA C 87 42.281 44.057 -1.776 1
1 969 . 15 1 1 A 87 87 GLY N N 87 113.482 111.748 1.734 1
1 970 . 15 1 1 A 88 88 PRO HA H 88 4.563 4.557 0.006 1
1 977 . 15 1 1 A 88 88 PRO CA C 88 60.994 62.132 -1.138 1
1 978 . 15 1 1 A 88 88 PRO CB C 88 29.873 31.716 -1.843 1
1 981 . 15 1 1 A 89 89 PRO HA H 89 4.490 4.417 0.073 1
1 987 . 15 1 1 A 89 89 PRO C C 89 174.543 176.500 -1.957 1
1 988 . 15 1 1 A 89 89 PRO CA C 89 59.435 62.651 -3.216 1
1 989 . 15 1 1 A 89 89 PRO CB C 89 29.805 32.133 -2.328 1
1 992 . 15 1 1 A 90 90 SER H H 90 8.808 8.663 0.145 1
1 993 . 15 1 1 A 90 90 SER HA H 90 4.202 4.566 -0.364 1
1 996 . 15 1 1 A 90 90 SER C C 90 171.870 174.076 -2.206 1
1 997 . 15 1 1 A 90 90 SER CA C 90 55.868 58.049 -2.181 1
1 998 . 15 1 1 A 90 90 SER CB C 90 64.504 63.934 0.570 1
1 999 . 15 1 1 A 90 90 SER N N 90 113.781 116.847 -3.066 1
1 1000 . 15 1 1 A 91 91 GLU H H 91 8.291 8.584 -0.293 1
1 1001 . 15 1 1 A 91 91 GLU HA H 91 4.131 4.194 -0.063 1
1 1006 . 15 1 1 A 91 91 GLU C C 91 174.882 176.324 -1.442 1
1 1007 . 15 1 1 A 91 91 GLU CA C 91 54.984 56.862 -1.878 1
1 1008 . 15 1 1 A 91 91 GLU CB C 91 27.643 29.680 -2.037 1
1 1010 . 15 1 1 A 91 91 GLU N N 91 117.930 123.070 -5.140 1
1 1011 . 15 1 1 A 92 92 ALA H H 92 8.605 8.310 0.295 1
1 1012 . 15 1 1 A 92 92 ALA HA H 92 5.068 4.388 0.680 1
1 1016 . 15 1 1 A 92 92 ALA C C 92 176.227 177.682 -1.455 1
1 1017 . 15 1 1 A 92 92 ALA CA C 92 48.997 52.739 -3.742 1
1 1018 . 15 1 1 A 92 92 ALA CB C 92 17.756 19.119 -1.363 1
1 1019 . 15 1 1 A 92 92 ALA N N 92 126.421 126.791 -0.370 1
1 1020 . 15 1 1 A 93 93 VAL H H 93 9.051 9.087 -0.036 1
1 1021 . 15 1 1 A 93 93 VAL HA H 93 4.642 5.003 -0.361 1
1 1029 . 15 1 1 A 93 93 VAL C C 93 172.010 174.623 -2.613 1
1 1030 . 15 1 1 A 93 93 VAL CA C 93 57.495 59.866 -2.371 1
1 1031 . 15 1 1 A 93 93 VAL CB C 93 32.774 34.572 -1.798 1
1 1034 . 15 1 1 A 93 93 VAL N N 93 117.322 118.142 -0.820 1
1 1035 . 15 1 1 A 94 94 ARG H H 94 8.470 9.055 -0.585 1
1 1036 . 15 1 1 A 94 94 ARG HA H 94 5.692 5.303 0.389 1
1 1043 . 15 1 1 A 94 94 ARG C C 94 173.635 175.362 -1.727 1
1 1044 . 15 1 1 A 94 94 ARG CA C 94 52.038 55.113 -3.075 1
1 1045 . 15 1 1 A 94 94 ARG CB C 94 30.966 31.396 -0.430 1
1 1048 . 15 1 1 A 94 94 ARG N N 94 122.258 125.222 -2.964 1
1 1049 . 15 1 1 A 95 95 ALA H H 95 9.051 9.200 -0.149 1
1 1050 . 15 1 1 A 95 95 ALA HA H 95 4.642 5.347 -0.705 1
1 1054 . 15 1 1 A 95 95 ALA C C 95 172.285 175.540 -3.255 1
1 1055 . 15 1 1 A 95 95 ALA CA C 95 49.191 50.300 -1.109 1
1 1056 . 15 1 1 A 95 95 ALA CB C 95 22.562 21.775 0.787 1
1 1057 . 15 1 1 A 95 95 ALA N N 95 121.931 127.665 -5.734 1
1 1058 . 15 1 1 A 96 96 ARG H H 96 8.550 8.739 -0.189 1
1 1059 . 15 1 1 A 96 96 ARG HA H 96 5.407 5.077 0.330 1
1 1066 . 15 1 1 A 96 96 ARG C C 96 174.547 176.047 -1.500 1
1 1067 . 15 1 1 A 96 96 ARG CA C 96 51.439 55.191 -3.752 1
1 1068 . 15 1 1 A 96 96 ARG CB C 96 30.708 31.441 -0.733 1
1 1071 . 15 1 1 A 96 96 ARG N N 96 121.155 124.790 -3.635 1
1 1072 . 15 1 1 A 97 97 THR H H 97 8.797 8.972 -0.175 1
1 1073 . 15 1 1 A 97 97 THR HA H 97 4.116 4.450 -0.334 1
1 1078 . 15 1 1 A 97 97 THR C C 97 173.577 174.962 -1.385 1
1 1079 . 15 1 1 A 97 97 THR CA C 97 58.800 61.638 -2.838 1
1 1080 . 15 1 1 A 97 97 THR CB C 97 67.461 69.767 -2.306 1
1 1082 . 15 1 1 A 97 97 THR N N 97 114.657 117.490 -2.833 1
1 1083 . 15 1 1 A 98 98 GLY H H 98 7.505 8.078 -0.573 1
1 1084 . 15 1 1 A 98 98 GLY HA2 H 98 3.866 4.132 -0.266 1
1 1085 . 15 1 1 A 98 98 GLY HA3 H 98 3.743 4.192 -0.449 1
1 1086 . 15 1 1 A 98 98 GLY C C 98 170.637 172.825 -2.188 1
1 1087 . 15 1 1 A 98 98 GLY CA C 98 42.332 44.500 -2.168 1
1 1088 . 15 1 1 A 98 98 GLY N N 98 106.172 107.959 -1.787 1
1 1089 . 15 1 1 A 99 99 GLU H H 99 8.145 8.668 -0.523 1
1 1090 . 15 1 1 A 99 99 GLU HA H 99 4.210 5.234 -1.024 1
1 1095 . 15 1 1 A 99 99 GLU C C 99 174.134 174.883 -0.749 1
1 1096 . 15 1 1 A 99 99 GLU CA C 99 53.828 55.300 -1.472 1
1 1097 . 15 1 1 A 99 99 GLU CB C 99 28.774 32.635 -3.861 1
1 1099 . 15 1 1 A 99 99 GLU N N 99 117.634 117.098 0.536 1
1 1100 . 15 1 1 A 100 100 GLN H H 100 8.647 8.634 0.013 1
1 1101 . 15 1 1 A 100 100 GLN HA H 100 4.247 4.600 -0.353 1
1 1108 . 15 1 1 A 100 100 GLN C C 100 173.348 174.329 -0.981 1
1 1109 . 15 1 1 A 100 100 GLN CA C 100 53.634 54.835 -1.201 1
1 1110 . 15 1 1 A 100 100 GLN CB C 100 27.392 32.993 -5.601 1
1 1112 . 15 1 1 A 100 100 GLN N N 100 121.960 120.643 1.317 1
1 1114 . 15 1 1 A 101 101 SER H H 101 8.416 8.576 -0.160 1
1 1115 . 15 1 1 A 101 101 SER HA H 101 4.418 4.296 0.122 1
1 1117 . 15 1 1 A 101 101 SER C C 101 172.148 174.051 -1.903 1
1 1118 . 15 1 1 A 101 101 SER CA C 101 55.926 59.426 -3.500 1
1 1119 . 15 1 1 A 101 101 SER CB C 101 61.617 63.340 -1.723 1
1 1120 . 15 1 1 A 101 101 SER N N 101 118.609 119.511 -0.902 1
1 1121 . 15 1 1 A 102 102 GLY H H 102 8.233 8.447 -0.214 1
1 1122 . 15 1 1 A 102 102 GLY HA2 H 102 4.080 4.202 -0.122 1
1 1123 . 15 1 1 A 102 102 GLY HA3 H 102 3.981 4.206 -0.225 1
1 1124 . 15 1 1 A 102 102 GLY C C 102 169.461 172.195 -2.734 1
1 1125 . 15 1 1 A 102 102 GLY CA C 102 42.332 46.213 -3.881 1
1 1126 . 15 1 1 A 102 102 GLY N N 102 110.483 113.681 -3.198 1
1 1127 . 15 1 1 A 103 103 PRO HA H 103 4.618 4.623 -0.005 1
1 1134 . 15 1 1 A 103 103 PRO CA C 103 57.843 62.751 -4.908 1
1 1135 . 15 1 1 A 103 103 PRO CB C 103 28.671 33.356 -4.685 1
1 1 . 16 1 1 A 6 6 SER HA H 6 4.492 4.920 -0.428 1
1 4 . 16 1 1 A 6 6 SER CA C 6 55.621 56.949 -1.328 1
1 5 . 16 1 1 A 6 6 SER CB C 6 62.104 65.684 -3.580 1
1 6 . 16 1 1 A 7 7 GLY H H 7 8.244 8.479 -0.235 1
1 7 . 16 1 1 A 7 7 GLY HA2 H 7 3.873 4.077 -0.204 1
1 8 . 16 1 1 A 7 7 GLY HA3 H 7 3.737 4.086 -0.349 1
1 9 . 16 1 1 A 7 7 GLY CA C 7 41.743 44.331 -2.588 1
1 10 . 16 1 1 A 7 7 GLY N N 7 109.193 116.375 -7.182 1
1 11 . 16 1 1 A 8 8 PRO HA H 8 4.286 4.529 -0.243 1
1 18 . 16 1 1 A 8 8 PRO C C 8 173.841 175.547 -1.706 1
1 19 . 16 1 1 A 8 8 PRO CA C 8 60.528 62.557 -2.029 1
1 20 . 16 1 1 A 8 8 PRO CB C 8 30.299 32.949 -2.650 1
1 23 . 16 1 1 A 9 9 LYS H H 9 8.877 8.577 0.300 1
1 24 . 16 1 1 A 9 9 LYS HA H 9 4.360 4.809 -0.449 1
1 33 . 16 1 1 A 9 9 LYS C C 9 173.492 174.267 -0.775 1
1 34 . 16 1 1 A 9 9 LYS CA C 9 52.135 53.300 -1.165 1
1 35 . 16 1 1 A 9 9 LYS CB C 9 28.798 32.602 -3.804 1
1 39 . 16 1 1 A 9 9 LYS N N 9 120.404 120.701 -0.297 1
1 40 . 16 1 1 A 10 10 PRO HA H 10 4.284 4.624 -0.340 1
1 47 . 16 1 1 A 10 10 PRO CA C 10 59.326 61.614 -2.288 1
1 48 . 16 1 1 A 10 10 PRO CB C 10 28.825 31.589 -2.764 1
1 51 . 16 1 1 A 11 11 PRO HA H 11 4.468 4.798 -0.330 1
1 58 . 16 1 1 A 11 11 PRO C C 11 171.993 176.419 -4.426 1
1 59 . 16 1 1 A 11 11 PRO CA C 11 60.422 62.602 -2.180 1
1 60 . 16 1 1 A 11 11 PRO CB C 11 30.418 32.667 -2.249 1
1 63 . 16 1 1 A 12 12 ILE H H 12 7.554 8.006 -0.452 1
1 64 . 16 1 1 A 12 12 ILE HA H 12 4.676 4.666 0.010 1
1 74 . 16 1 1 A 12 12 ILE C C 12 171.721 174.809 -3.088 1
1 75 . 16 1 1 A 12 12 ILE CA C 12 56.843 58.993 -2.150 1
1 76 . 16 1 1 A 12 12 ILE CB C 12 40.560 41.128 -0.568 1
1 80 . 16 1 1 A 12 12 ILE N N 12 109.695 116.656 -6.961 1
1 81 . 16 1 1 A 13 13 ASP H H 13 8.435 8.792 -0.357 1
1 82 . 16 1 1 A 13 13 ASP HA H 13 4.094 4.190 -0.096 1
1 85 . 16 1 1 A 13 13 ASP C C 13 171.803 174.820 -3.017 1
1 86 . 16 1 1 A 13 13 ASP CA C 13 52.610 55.013 -2.403 1
1 87 . 16 1 1 A 13 13 ASP CB C 13 36.357 39.296 -2.939 1
1 88 . 16 1 1 A 13 13 ASP N N 13 116.219 120.273 -4.054 1
1 89 . 16 1 1 A 14 14 LEU H H 14 7.483 8.008 -0.525 1
1 90 . 16 1 1 A 14 14 LEU HA H 14 4.990 4.778 0.212 1
1 100 . 16 1 1 A 14 14 LEU C C 14 174.702 175.367 -0.665 1
1 101 . 16 1 1 A 14 14 LEU CA C 14 53.811 55.176 -1.365 1
1 102 . 16 1 1 A 14 14 LEU CB C 14 40.148 42.333 -2.185 1
1 106 . 16 1 1 A 14 14 LEU N N 14 118.463 121.696 -3.233 1
1 107 . 16 1 1 A 15 15 VAL H H 15 9.209 8.611 0.598 1
1 108 . 16 1 1 A 15 15 VAL HA H 15 4.250 4.776 -0.526 1
1 116 . 16 1 1 A 15 15 VAL C C 15 172.080 174.188 -2.108 1
1 117 . 16 1 1 A 15 15 VAL CA C 15 58.570 60.406 -1.836 1
1 118 . 16 1 1 A 15 15 VAL CB C 15 34.146 36.078 -1.932 1
1 121 . 16 1 1 A 15 15 VAL N N 15 124.833 127.389 -2.556 1
1 122 . 16 1 1 A 16 16 VAL H H 16 8.390 8.874 -0.484 1
1 123 . 16 1 1 A 16 16 VAL HA H 16 4.343 4.539 -0.196 1
1 131 . 16 1 1 A 16 16 VAL C C 16 174.672 175.609 -0.937 1
1 132 . 16 1 1 A 16 16 VAL CA C 16 59.188 61.076 -1.888 1
1 133 . 16 1 1 A 16 16 VAL CB C 16 29.187 33.306 -4.119 1
1 136 . 16 1 1 A 16 16 VAL N N 16 124.654 125.200 -0.546 1
1 137 . 16 1 1 A 17 17 THR H H 17 8.638 8.745 -0.107 1
1 138 . 16 1 1 A 17 17 THR HA H 17 4.195 4.457 -0.262 1
1 143 . 16 1 1 A 17 17 THR C C 17 172.661 173.564 -0.903 1
1 144 . 16 1 1 A 17 17 THR CA C 17 60.318 62.998 -2.680 1
1 145 . 16 1 1 A 17 17 THR CB C 17 66.420 70.396 -3.976 1
1 147 . 16 1 1 A 17 17 THR N N 17 120.942 121.611 -0.669 1
1 148 . 16 1 1 A 18 18 GLU H H 18 7.361 7.634 -0.273 1
1 149 . 16 1 1 A 18 18 GLU HA H 18 4.497 4.717 -0.220 1
1 154 . 16 1 1 A 18 18 GLU C C 18 171.691 174.824 -3.133 1
1 155 . 16 1 1 A 18 18 GLU CA C 18 53.687 55.462 -1.775 1
1 156 . 16 1 1 A 18 18 GLU CB C 18 30.802 33.593 -2.791 1
1 158 . 16 1 1 A 18 18 GLU N N 18 119.088 118.968 0.120 1
1 159 . 16 1 1 A 19 19 THR H H 19 8.164 8.612 -0.448 1
1 160 . 16 1 1 A 19 19 THR HA H 19 4.912 5.056 -0.144 1
1 165 . 16 1 1 A 19 19 THR C C 19 171.606 172.866 -1.260 1
1 166 . 16 1 1 A 19 19 THR CA C 19 58.473 60.689 -2.216 1
1 167 . 16 1 1 A 19 19 THR CB C 19 70.103 71.068 -0.965 1
1 169 . 16 1 1 A 19 19 THR N N 19 112.424 114.151 -1.727 1
1 170 . 16 1 1 A 20 20 THR H H 20 8.750 8.952 -0.202 1
1 171 . 16 1 1 A 20 20 THR HA H 20 4.710 4.785 -0.075 1
1 176 . 16 1 1 A 20 20 THR C C 20 172.785 175.903 -3.118 1
1 177 . 16 1 1 A 20 20 THR CA C 20 58.059 61.109 -3.050 1
1 178 . 16 1 1 A 20 20 THR CB C 20 68.782 71.137 -2.355 1
1 180 . 16 1 1 A 20 20 THR N N 20 113.438 121.424 -7.986 1
1 181 . 16 1 1 A 21 21 ALA H H 21 8.453 8.928 -0.475 1
1 182 . 16 1 1 A 21 21 ALA HA H 21 4.079 4.443 -0.364 1
1 186 . 16 1 1 A 21 21 ALA C C 21 174.130 177.878 -3.748 1
1 187 . 16 1 1 A 21 21 ALA CA C 21 52.680 55.220 -2.540 1
1 188 . 16 1 1 A 21 21 ALA CB C 21 16.893 18.555 -1.662 1
1 189 . 16 1 1 A 21 21 ALA N N 21 120.078 125.490 -5.412 1
1 190 . 16 1 1 A 22 22 THR H H 22 7.132 7.507 -0.375 1
1 191 . 16 1 1 A 22 22 THR HA H 22 4.433 4.752 -0.319 1
1 196 . 16 1 1 A 22 22 THR C C 22 171.434 173.517 -2.083 1
1 197 . 16 1 1 A 22 22 THR CA C 22 56.836 60.463 -3.627 1
1 198 . 16 1 1 A 22 22 THR CB C 22 68.772 69.189 -0.417 1
1 200 . 16 1 1 A 22 22 THR N N 22 95.772 104.159 -8.387 1
1 201 . 16 1 1 A 23 23 SER H H 23 7.326 7.720 -0.394 1
1 202 . 16 1 1 A 23 23 SER HA H 23 5.562 5.262 0.300 1
1 205 . 16 1 1 A 23 23 SER C C 23 169.267 172.203 -2.936 1
1 206 . 16 1 1 A 23 23 SER CA C 23 54.445 57.673 -3.228 1
1 207 . 16 1 1 A 23 23 SER CB C 23 65.905 67.092 -1.187 1
1 208 . 16 1 1 A 23 23 SER N N 23 115.757 116.030 -0.273 1
1 209 . 16 1 1 A 24 24 VAL H H 24 7.983 8.563 -0.580 1
1 210 . 16 1 1 A 24 24 VAL HA H 24 4.334 4.530 -0.196 1
1 218 . 16 1 1 A 24 24 VAL C C 24 171.917 173.432 -1.515 1
1 219 . 16 1 1 A 24 24 VAL CA C 24 58.642 60.242 -1.600 1
1 220 . 16 1 1 A 24 24 VAL CB C 24 34.254 34.993 -0.739 1
1 223 . 16 1 1 A 24 24 VAL N N 24 116.595 120.708 -4.113 1
1 224 . 16 1 1 A 25 25 THR H H 25 8.636 8.905 -0.269 1
1 225 . 16 1 1 A 25 25 THR HA H 25 4.833 5.044 -0.211 1
1 230 . 16 1 1 A 25 25 THR C C 25 169.721 172.852 -3.131 1
1 231 . 16 1 1 A 25 25 THR CA C 25 59.699 61.253 -1.554 1
1 232 . 16 1 1 A 25 25 THR CB C 25 67.303 70.775 -3.472 1
1 234 . 16 1 1 A 25 25 THR N N 25 121.690 122.262 -0.572 1
1 235 . 16 1 1 A 26 26 LEU H H 26 8.629 9.301 -0.672 1
1 236 . 16 1 1 A 26 26 LEU HA H 26 5.315 5.190 0.125 1
1 246 . 16 1 1 A 26 26 LEU C C 26 173.182 175.147 -1.965 1
1 247 . 16 1 1 A 26 26 LEU CA C 26 50.643 53.583 -2.940 1
1 248 . 16 1 1 A 26 26 LEU CB C 26 43.976 46.844 -2.868 1
1 252 . 16 1 1 A 26 26 LEU N N 26 126.843 128.493 -1.650 1
1 253 . 16 1 1 A 27 27 THR H H 27 8.704 8.911 -0.207 1
1 254 . 16 1 1 A 27 27 THR HA H 27 4.822 5.206 -0.384 1
1 259 . 16 1 1 A 27 27 THR C C 27 169.840 173.489 -3.649 1
1 260 . 16 1 1 A 27 27 THR CA C 27 58.077 59.865 -1.788 1
1 261 . 16 1 1 A 27 27 THR CB C 27 69.666 71.554 -1.888 1
1 263 . 16 1 1 A 27 27 THR N N 27 111.513 114.942 -3.429 1
1 264 . 16 1 1 A 28 28 TRP H H 28 7.339 8.071 -0.732 1
1 265 . 16 1 1 A 28 28 TRP HA H 28 4.963 5.449 -0.486 1
1 274 . 16 1 1 A 28 28 TRP C C 28 170.637 172.378 -1.741 1
1 275 . 16 1 1 A 28 28 TRP CA C 28 54.438 55.621 -1.183 1
1 276 . 16 1 1 A 28 28 TRP CB C 28 27.497 31.453 -3.956 1
1 282 . 16 1 1 A 28 28 TRP N N 28 117.895 119.181 -1.286 1
1 284 . 16 1 1 A 29 29 ASP H H 29 8.696 9.077 -0.381 1
1 285 . 16 1 1 A 29 29 ASP HA H 29 4.971 5.120 -0.149 1
1 288 . 16 1 1 A 29 29 ASP C C 29 174.901 176.953 -2.052 1
1 289 . 16 1 1 A 29 29 ASP CA C 29 50.178 52.617 -2.439 1
1 290 . 16 1 1 A 29 29 ASP CB C 29 42.291 43.228 -0.937 1
1 291 . 16 1 1 A 29 29 ASP N N 29 117.477 121.733 -4.256 1
1 292 . 16 1 1 A 30 30 SER H H 30 8.800 8.882 -0.082 1
1 293 . 16 1 1 A 30 30 SER HA H 30 4.389 4.139 0.250 1
1 296 . 16 1 1 A 30 30 SER C C 30 174.032 175.140 -1.108 1
1 297 . 16 1 1 A 30 30 SER CA C 30 58.694 62.030 -3.336 1
1 298 . 16 1 1 A 30 30 SER CB C 30 62.428 63.315 -0.887 1
1 299 . 16 1 1 A 30 30 SER N N 30 118.275 120.500 -2.225 1
1 300 . 16 1 1 A 31 31 GLY H H 31 8.759 8.332 0.427 1
1 301 . 16 1 1 A 31 31 GLY HA2 H 31 4.239 4.021 0.218 1
1 302 . 16 1 1 A 31 31 GLY HA3 H 31 3.555 4.053 -0.498 1
1 303 . 16 1 1 A 31 31 GLY C C 31 171.325 174.366 -3.041 1
1 304 . 16 1 1 A 31 31 GLY CA C 31 43.637 45.457 -1.820 1
1 305 . 16 1 1 A 31 31 GLY N N 31 107.961 109.983 -2.022 1
1 306 . 16 1 1 A 32 32 ASN H H 32 8.173 8.124 0.049 1
1 307 . 16 1 1 A 32 32 ASN HA H 32 4.749 5.003 -0.254 1
1 312 . 16 1 1 A 32 32 ASN C C 32 171.355 175.545 -4.190 1
1 313 . 16 1 1 A 32 32 ASN CA C 32 50.795 53.088 -2.293 1
1 314 . 16 1 1 A 32 32 ASN CB C 32 41.508 39.910 1.598 1
1 315 . 16 1 1 A 32 32 ASN N N 32 117.781 119.493 -1.712 1
1 317 . 16 1 1 A 33 33 SER HA H 33 4.291 4.562 -0.271 1
1 320 . 16 1 1 A 33 33 SER C C 33 172.449 173.630 -1.181 1
1 321 . 16 1 1 A 33 33 SER CA C 33 56.733 58.842 -2.109 1
1 322 . 16 1 1 A 33 33 SER CB C 33 60.884 64.689 -3.805 1
1 323 . 16 1 1 A 34 34 GLU H H 34 7.731 7.850 -0.119 1
1 324 . 16 1 1 A 34 34 GLU HA H 34 4.556 4.667 -0.111 1
1 329 . 16 1 1 A 34 34 GLU C C 34 171.792 174.107 -2.315 1
1 330 . 16 1 1 A 34 34 GLU CA C 34 51.818 52.973 -1.155 1
1 331 . 16 1 1 A 34 34 GLU CB C 34 26.891 30.533 -3.642 1
1 333 . 16 1 1 A 34 34 GLU N N 34 122.319 120.337 1.982 1
1 334 . 16 1 1 A 35 35 PRO HA H 35 4.165 4.799 -0.634 1
1 341 . 16 1 1 A 35 35 PRO C C 35 174.288 176.970 -2.682 1
1 342 . 16 1 1 A 35 35 PRO CA C 35 61.374 62.746 -1.372 1
1 343 . 16 1 1 A 35 35 PRO CB C 35 29.887 31.728 -1.841 1
1 346 . 16 1 1 A 36 36 VAL H H 36 8.348 8.257 0.091 1
1 347 . 16 1 1 A 36 36 VAL HA H 36 3.899 4.379 -0.480 1
1 355 . 16 1 1 A 36 36 VAL C C 36 173.344 176.942 -3.598 1
1 356 . 16 1 1 A 36 36 VAL CA C 36 59.014 60.749 -1.735 1
1 357 . 16 1 1 A 36 36 VAL CB C 36 31.865 32.997 -1.132 1
1 360 . 16 1 1 A 36 36 VAL N N 36 122.051 118.188 3.863 1
1 361 . 16 1 1 A 37 37 THR H H 37 8.780 8.706 0.074 1
1 362 . 16 1 1 A 37 37 THR HA H 37 3.923 4.000 -0.077 1
1 367 . 16 1 1 A 37 37 THR C C 37 172.171 174.538 -2.367 1
1 368 . 16 1 1 A 37 37 THR CA C 37 63.155 65.921 -2.766 1
1 369 . 16 1 1 A 37 37 THR CB C 37 65.941 68.696 -2.755 1
1 371 . 16 1 1 A 37 37 THR N N 37 122.351 119.428 2.923 1
1 372 . 16 1 1 A 38 38 TYR H H 38 7.304 7.812 -0.508 1
1 373 . 16 1 1 A 38 38 TYR HA H 38 4.439 5.007 -0.568 1
1 380 . 16 1 1 A 38 38 TYR C C 38 168.385 172.809 -4.424 1
1 381 . 16 1 1 A 38 38 TYR CA C 38 54.101 56.575 -2.474 1
1 382 . 16 1 1 A 38 38 TYR CB C 38 35.874 40.066 -4.192 1
1 387 . 16 1 1 A 38 38 TYR N N 38 113.984 114.771 -0.787 1
1 388 . 16 1 1 A 39 39 TYR H H 39 9.445 8.955 0.490 1
1 389 . 16 1 1 A 39 39 TYR HA H 39 5.293 5.084 0.209 1
1 396 . 16 1 1 A 39 39 TYR C C 39 172.781 175.842 -3.061 1
1 397 . 16 1 1 A 39 39 TYR CA C 39 54.322 55.494 -1.172 1
1 398 . 16 1 1 A 39 39 TYR CB C 39 39.035 41.169 -2.134 1
1 401 . 16 1 1 A 39 39 TYR N N 39 115.092 118.098 -3.006 1
1 402 . 16 1 1 A 40 40 GLY H H 40 8.870 8.818 0.052 1
1 403 . 16 1 1 A 40 40 GLY HA2 H 40 5.137 4.123 1.014 1
1 404 . 16 1 1 A 40 40 GLY HA3 H 40 3.285 4.229 -0.944 1
1 405 . 16 1 1 A 40 40 GLY C C 40 169.688 172.857 -3.169 1
1 406 . 16 1 1 A 40 40 GLY CA C 40 41.415 44.638 -3.223 1
1 407 . 16 1 1 A 40 40 GLY N N 40 106.573 111.908 -5.335 1
1 408 . 16 1 1 A 41 41 ILE H H 41 8.917 8.304 0.613 1
1 409 . 16 1 1 A 41 41 ILE HA H 41 4.527 5.041 -0.514 1
1 419 . 16 1 1 A 41 41 ILE C C 41 172.692 174.473 -1.781 1
1 420 . 16 1 1 A 41 41 ILE CA C 41 57.597 60.121 -2.524 1
1 421 . 16 1 1 A 41 41 ILE CB C 41 37.840 42.073 -4.233 1
1 425 . 16 1 1 A 41 41 ILE N N 41 121.746 120.808 0.938 1
1 426 . 16 1 1 A 42 42 GLN H H 42 9.063 8.910 0.153 1
1 427 . 16 1 1 A 42 42 GLN HA H 42 5.655 5.253 0.402 1
1 434 . 16 1 1 A 42 42 GLN C C 42 172.841 174.591 -1.750 1
1 435 . 16 1 1 A 42 42 GLN CA C 42 50.789 54.255 -3.466 1
1 436 . 16 1 1 A 42 42 GLN CB C 42 28.898 32.820 -3.922 1
1 438 . 16 1 1 A 42 42 GLN N N 42 125.141 125.531 -0.390 1
1 440 . 16 1 1 A 43 43 TYR H H 43 9.066 8.922 0.144 1
1 441 . 16 1 1 A 43 43 TYR HA H 43 5.922 6.040 -0.118 1
1 448 . 16 1 1 A 43 43 TYR C C 43 171.219 173.143 -1.924 1
1 449 . 16 1 1 A 43 43 TYR CA C 43 53.349 56.274 -2.925 1
1 450 . 16 1 1 A 43 43 TYR CB C 43 41.074 42.297 -1.223 1
1 455 . 16 1 1 A 43 43 TYR N N 43 118.018 119.305 -1.287 1
1 456 . 16 1 1 A 44 44 ARG H H 44 8.400 8.607 -0.207 1
1 457 . 16 1 1 A 44 44 ARG HA H 44 4.542 4.484 0.058 1
1 464 . 16 1 1 A 44 44 ARG C C 44 171.974 174.167 -2.193 1
1 465 . 16 1 1 A 44 44 ARG CA C 44 52.453 55.259 -2.806 1
1 466 . 16 1 1 A 44 44 ARG CB C 44 31.125 32.961 -1.836 1
1 469 . 16 1 1 A 44 44 ARG N N 44 115.214 120.485 -5.271 1
1 470 . 16 1 1 A 45 45 ALA H H 45 8.846 8.282 0.564 1
1 471 . 16 1 1 A 45 45 ALA HA H 45 3.894 2.444 1.450 1
1 475 . 16 1 1 A 45 45 ALA C C 45 175.721 176.820 -1.099 1
1 476 . 16 1 1 A 45 45 ALA CA C 45 50.372 52.115 -1.743 1
1 477 . 16 1 1 A 45 45 ALA CB C 45 15.732 18.775 -3.043 1
1 478 . 16 1 1 A 45 45 ALA N N 45 126.463 126.615 -0.152 1
1 479 . 16 1 1 A 46 46 ALA H H 46 8.282 8.364 -0.082 1
1 480 . 16 1 1 A 46 46 ALA HA H 46 3.922 4.239 -0.317 1
1 484 . 16 1 1 A 46 46 ALA C C 46 176.236 177.327 -1.091 1
1 485 . 16 1 1 A 46 46 ALA CA C 46 50.773 51.908 -1.135 1
1 486 . 16 1 1 A 46 46 ALA CB C 46 16.244 17.574 -1.330 1
1 487 . 16 1 1 A 46 46 ALA N N 46 126.301 124.039 2.262 1
1 488 . 16 1 1 A 47 47 GLY HA2 H 47 3.882 4.019 -0.137 1
1 489 . 16 1 1 A 47 47 GLY HA3 H 47 3.695 4.044 -0.349 1
1 490 . 16 1 1 A 47 47 GLY C C 47 171.795 173.542 -1.747 1
1 491 . 16 1 1 A 47 47 GLY CA C 47 43.327 45.795 -2.468 1
1 492 . 16 1 1 A 48 48 THR H H 48 7.145 7.770 -0.625 1
1 493 . 16 1 1 A 48 48 THR HA H 48 4.417 4.834 -0.417 1
1 498 . 16 1 1 A 48 48 THR C C 48 171.325 172.118 -0.793 1
1 499 . 16 1 1 A 48 48 THR CA C 48 58.271 59.780 -1.509 1
1 500 . 16 1 1 A 48 48 THR CB C 48 68.846 70.739 -1.893 1
1 502 . 16 1 1 A 48 48 THR N N 48 110.190 113.795 -3.605 1
1 503 . 16 1 1 A 49 49 GLU H H 49 8.346 8.751 -0.405 1
1 504 . 16 1 1 A 49 49 GLU HA H 49 4.277 4.635 -0.358 1
1 509 . 16 1 1 A 49 49 GLU C C 49 174.109 174.851 -0.742 1
1 510 . 16 1 1 A 49 49 GLU CA C 49 52.909 55.239 -2.330 1
1 511 . 16 1 1 A 49 49 GLU CB C 49 27.845 29.972 -2.127 1
1 513 . 16 1 1 A 49 49 GLU N N 49 119.985 125.976 -5.991 1
1 514 . 16 1 1 A 50 50 GLY H H 50 7.617 8.164 -0.547 1
1 515 . 16 1 1 A 50 50 GLY HA2 H 50 3.935 4.263 -0.328 1
1 516 . 16 1 1 A 50 50 GLY HA3 H 50 3.935 4.296 -0.361 1
1 517 . 16 1 1 A 50 50 GLY C C 50 168.223 171.523 -3.300 1
1 518 . 16 1 1 A 50 50 GLY CA C 50 42.121 44.488 -2.367 1
1 519 . 16 1 1 A 50 50 GLY N N 50 108.670 110.518 -1.848 1
1 520 . 16 1 1 A 51 51 PRO HA H 51 4.298 4.676 -0.378 1
1 527 . 16 1 1 A 51 51 PRO C C 51 175.067 176.858 -1.791 1
1 528 . 16 1 1 A 51 51 PRO CA C 51 60.175 62.853 -2.678 1
1 529 . 16 1 1 A 51 51 PRO CB C 51 30.052 32.393 -2.341 1
1 532 . 16 1 1 A 52 52 PHE H H 52 8.442 8.709 -0.267 1
1 533 . 16 1 1 A 52 52 PHE HA H 52 3.981 4.493 -0.512 1
1 541 . 16 1 1 A 52 52 PHE C C 52 175.141 175.761 -0.620 1
1 542 . 16 1 1 A 52 52 PHE CA C 52 56.808 57.941 -1.133 1
1 543 . 16 1 1 A 52 52 PHE CB C 52 36.830 39.437 -2.607 1
1 549 . 16 1 1 A 52 52 PHE N N 52 118.707 122.003 -3.296 1
1 550 . 16 1 1 A 53 53 GLN H H 53 8.778 7.910 0.868 1
1 551 . 16 1 1 A 53 53 GLN HA H 53 4.149 4.194 -0.045 1
1 558 . 16 1 1 A 53 53 GLN C C 53 172.773 175.424 -2.651 1
1 559 . 16 1 1 A 53 53 GLN CA C 53 52.999 56.382 -3.383 1
1 560 . 16 1 1 A 53 53 GLN CB C 53 26.962 29.317 -2.355 1
1 562 . 16 1 1 A 53 53 GLN N N 53 122.164 122.301 -0.137 1
1 564 . 16 1 1 A 54 54 GLU H H 54 8.432 8.584 -0.152 1
1 565 . 16 1 1 A 54 54 GLU HA H 54 5.533 5.092 0.441 1
1 570 . 16 1 1 A 54 54 GLU C C 54 173.930 174.698 -0.768 1
1 571 . 16 1 1 A 54 54 GLU CA C 54 52.981 55.379 -2.398 1
1 572 . 16 1 1 A 54 54 GLU CB C 54 31.712 33.505 -1.793 1
1 574 . 16 1 1 A 54 54 GLU N N 54 119.688 120.528 -0.840 1
1 575 . 16 1 1 A 55 55 VAL H H 55 9.077 8.380 0.697 1
1 576 . 16 1 1 A 55 55 VAL HA H 55 4.180 4.871 -0.691 1
1 584 . 16 1 1 A 55 55 VAL C C 55 171.811 174.369 -2.558 1
1 585 . 16 1 1 A 55 55 VAL CA C 55 59.664 61.242 -1.578 1
1 586 . 16 1 1 A 55 55 VAL CB C 55 31.827 34.808 -2.981 1
1 589 . 16 1 1 A 55 55 VAL N N 55 125.328 125.704 -0.376 1
1 590 . 16 1 1 A 56 56 ASP H H 56 8.639 8.903 -0.264 1
1 591 . 16 1 1 A 56 56 ASP HA H 56 5.250 5.724 -0.474 1
1 594 . 16 1 1 A 56 56 ASP C C 56 174.252 176.010 -1.758 1
1 595 . 16 1 1 A 56 56 ASP CA C 56 50.108 52.360 -2.252 1
1 596 . 16 1 1 A 56 56 ASP CB C 56 41.407 43.445 -2.038 1
1 597 . 16 1 1 A 56 56 ASP N N 56 125.773 124.987 0.786 1
1 598 . 16 1 1 A 57 57 GLY H H 57 7.222 8.573 -1.351 1
1 599 . 16 1 1 A 57 57 GLY HA2 H 57 3.479 3.910 -0.431 1
1 600 . 16 1 1 A 57 57 GLY HA3 H 57 2.719 3.985 -1.266 1
1 601 . 16 1 1 A 57 57 GLY C C 57 172.281 174.418 -2.137 1
1 602 . 16 1 1 A 57 57 GLY CA C 57 43.919 44.916 -0.997 1
1 603 . 16 1 1 A 57 57 GLY N N 57 105.564 111.148 -5.584 1
1 604 . 16 1 1 A 58 58 VAL H H 58 8.338 7.976 0.362 1
1 605 . 16 1 1 A 58 58 VAL HA H 58 3.860 4.343 -0.483 1
1 613 . 16 1 1 A 58 58 VAL C C 58 173.981 175.431 -1.450 1
1 614 . 16 1 1 A 58 58 VAL CA C 58 61.233 61.968 -0.735 1
1 615 . 16 1 1 A 58 58 VAL CB C 58 29.708 30.742 -1.034 1
1 618 . 16 1 1 A 58 58 VAL N N 58 121.466 122.174 -0.708 1
1 619 . 16 1 1 A 59 59 ALA H H 59 9.038 8.731 0.307 1
1 620 . 16 1 1 A 59 59 ALA HA H 59 4.676 4.729 -0.053 1
1 624 . 16 1 1 A 59 59 ALA C C 59 175.105 176.838 -1.733 1
1 625 . 16 1 1 A 59 59 ALA CA C 59 50.866 51.991 -1.125 1
1 626 . 16 1 1 A 59 59 ALA CB C 59 17.647 19.323 -1.676 1
1 627 . 16 1 1 A 59 59 ALA N N 59 130.928 130.002 0.926 1
1 628 . 16 1 1 A 60 60 THR H H 60 7.445 7.694 -0.249 1
1 629 . 16 1 1 A 60 60 THR HA H 60 4.642 4.636 0.006 1
1 634 . 16 1 1 A 60 60 THR C C 60 169.528 174.332 -4.804 1
1 635 . 16 1 1 A 60 60 THR CA C 60 57.101 59.439 -2.338 1
1 636 . 16 1 1 A 60 60 THR CB C 60 67.982 72.473 -4.491 1
1 638 . 16 1 1 A 60 60 THR N N 60 109.256 109.473 -0.217 1
1 639 . 16 1 1 A 61 61 THR H H 61 7.325 8.288 -0.963 1
1 640 . 16 1 1 A 61 61 THR HA H 61 2.896 3.314 -0.418 1
1 645 . 16 1 1 A 61 61 THR C C 61 169.678 172.906 -3.228 1
1 646 . 16 1 1 A 61 61 THR CA C 61 57.246 62.090 -4.844 1
1 647 . 16 1 1 A 61 61 THR CB C 61 63.794 68.587 -4.793 1
1 649 . 16 1 1 A 61 61 THR N N 61 105.670 111.353 -5.683 1
1 650 . 16 1 1 A 62 62 ARG H H 62 6.490 7.245 -0.755 1
1 651 . 16 1 1 A 62 62 ARG HA H 62 4.698 4.830 -0.132 1
1 658 . 16 1 1 A 62 62 ARG C C 62 172.881 174.326 -1.445 1
1 659 . 16 1 1 A 62 62 ARG CA C 62 52.276 54.230 -1.954 1
1 660 . 16 1 1 A 62 62 ARG CB C 62 30.774 32.799 -2.025 1
1 663 . 16 1 1 A 62 62 ARG N N 62 117.485 122.217 -4.732 1
1 664 . 16 1 1 A 63 63 TYR H H 63 8.891 8.786 0.105 1
1 665 . 16 1 1 A 63 63 TYR HA H 63 4.356 5.344 -0.988 1
1 672 . 16 1 1 A 63 63 TYR C C 63 170.393 173.740 -3.347 1
1 673 . 16 1 1 A 63 63 TYR CA C 63 57.284 56.969 0.315 1
1 674 . 16 1 1 A 63 63 TYR CB C 63 41.467 42.724 -1.257 1
1 679 . 16 1 1 A 63 63 TYR N N 63 124.712 127.518 -2.806 1
1 680 . 16 1 1 A 64 64 SER H H 64 7.244 8.459 -1.215 1
1 681 . 16 1 1 A 64 64 SER HA H 64 5.077 5.754 -0.677 1
1 684 . 16 1 1 A 64 64 SER C C 64 169.712 173.553 -3.841 1
1 685 . 16 1 1 A 64 64 SER CA C 64 54.181 55.602 -1.421 1
1 686 . 16 1 1 A 64 64 SER CB C 64 61.122 65.809 -4.687 1
1 687 . 16 1 1 A 64 64 SER N N 64 120.593 121.245 -0.652 1
1 688 . 16 1 1 A 65 65 ILE H H 65 8.686 9.002 -0.316 1
1 689 . 16 1 1 A 65 65 ILE HA H 65 3.937 4.950 -1.013 1
1 699 . 16 1 1 A 65 65 ILE C C 65 172.217 175.225 -3.008 1
1 700 . 16 1 1 A 65 65 ILE CA C 65 58.288 59.657 -1.369 1
1 701 . 16 1 1 A 65 65 ILE CB C 65 36.110 40.440 -4.330 1
1 705 . 16 1 1 A 65 65 ILE N N 65 127.792 124.408 3.384 1
1 706 . 16 1 1 A 66 66 GLY H H 66 7.883 8.585 -0.702 1
1 707 . 16 1 1 A 66 66 GLY HA2 H 66 4.799 4.177 0.622 1
1 708 . 16 1 1 A 66 66 GLY HA3 H 66 3.468 4.195 -0.727 1
1 709 . 16 1 1 A 66 66 GLY C C 66 171.983 174.098 -2.115 1
1 710 . 16 1 1 A 66 66 GLY CA C 66 40.534 44.487 -3.953 1
1 711 . 16 1 1 A 66 66 GLY N N 66 112.632 114.703 -2.071 1
1 712 . 16 1 1 A 67 67 GLY H H 67 8.483 8.195 0.288 1
1 713 . 16 1 1 A 67 67 GLY HA2 H 67 3.836 3.981 -0.145 1
1 714 . 16 1 1 A 67 67 GLY HA3 H 67 3.682 4.003 -0.321 1
1 715 . 16 1 1 A 67 67 GLY C C 67 172.954 174.293 -1.339 1
1 716 . 16 1 1 A 67 67 GLY CA C 67 43.568 45.937 -2.369 1
1 717 . 16 1 1 A 67 67 GLY N N 67 104.625 108.943 -4.318 1
1 718 . 16 1 1 A 68 68 LEU H H 68 8.236 8.000 0.236 1
1 719 . 16 1 1 A 68 68 LEU HA H 68 4.154 4.648 -0.494 1
1 729 . 16 1 1 A 68 68 LEU C C 68 173.838 175.975 -2.137 1
1 730 . 16 1 1 A 68 68 LEU CA C 68 51.025 53.400 -2.375 1
1 731 . 16 1 1 A 68 68 LEU CB C 68 38.837 42.483 -3.646 1
1 735 . 16 1 1 A 68 68 LEU N N 68 118.919 121.906 -2.987 1
1 736 . 16 1 1 A 69 69 SER H H 69 8.284 8.790 -0.506 1
1 737 . 16 1 1 A 69 69 SER HA H 69 4.765 5.031 -0.266 1
1 740 . 16 1 1 A 69 69 SER C C 69 170.044 172.222 -2.178 1
1 741 . 16 1 1 A 69 69 SER CA C 69 54.639 56.106 -1.467 1
1 742 . 16 1 1 A 69 69 SER CB C 69 61.216 64.102 -2.886 1
1 743 . 16 1 1 A 69 69 SER N N 69 116.361 117.450 -1.089 1
1 744 . 16 1 1 A 70 70 PRO HA H 70 5.141 4.624 0.517 1
1 751 . 16 1 1 A 70 70 PRO C C 70 174.858 177.487 -2.629 1
1 752 . 16 1 1 A 70 70 PRO CA C 70 60.810 64.002 -3.192 1
1 753 . 16 1 1 A 70 70 PRO CB C 70 30.657 31.859 -1.202 1
1 756 . 16 1 1 A 71 71 PHE H H 71 8.139 9.233 -1.094 1
1 757 . 16 1 1 A 71 71 PHE HA H 71 4.202 4.277 -0.075 1
1 765 . 16 1 1 A 71 71 PHE C C 71 172.870 174.410 -1.540 1
1 766 . 16 1 1 A 71 71 PHE CA C 71 55.410 59.004 -3.594 1
1 767 . 16 1 1 A 71 71 PHE CB C 71 36.027 37.600 -1.573 1
1 773 . 16 1 1 A 71 71 PHE N N 71 125.409 123.304 2.105 1
1 774 . 16 1 1 A 72 72 SER H H 72 8.182 7.491 0.691 1
1 775 . 16 1 1 A 72 72 SER HA H 72 4.755 5.058 -0.303 1
1 778 . 16 1 1 A 72 72 SER C C 72 168.850 172.766 -3.916 1
1 779 . 16 1 1 A 72 72 SER CA C 72 55.926 56.513 -0.587 1
1 780 . 16 1 1 A 72 72 SER CB C 72 64.208 67.077 -2.869 1
1 781 . 16 1 1 A 72 72 SER N N 72 113.509 110.353 3.156 1
1 782 . 16 1 1 A 73 73 GLU H H 73 8.422 8.758 -0.336 1
1 783 . 16 1 1 A 73 73 GLU HA H 73 4.966 5.231 -0.265 1
1 788 . 16 1 1 A 73 73 GLU C C 73 173.192 174.732 -1.540 1
1 789 . 16 1 1 A 73 73 GLU CA C 73 52.815 54.834 -2.019 1
1 790 . 16 1 1 A 73 73 GLU CB C 73 29.416 32.905 -3.489 1
1 792 . 16 1 1 A 73 73 GLU N N 73 123.046 122.218 0.828 1
1 793 . 16 1 1 A 74 74 TYR H H 74 9.205 8.791 0.414 1
1 794 . 16 1 1 A 74 74 TYR HA H 74 4.799 5.078 -0.279 1
1 801 . 16 1 1 A 74 74 TYR C C 74 170.775 174.030 -3.255 1
1 802 . 16 1 1 A 74 74 TYR CA C 74 55.291 56.528 -1.237 1
1 803 . 16 1 1 A 74 74 TYR CB C 74 42.943 42.851 0.092 1
1 808 . 16 1 1 A 74 74 TYR N N 74 125.351 124.112 1.239 1
1 809 . 16 1 1 A 75 75 ALA H H 75 8.639 8.443 0.196 1
1 810 . 16 1 1 A 75 75 ALA HA H 75 5.271 5.260 0.011 1
1 814 . 16 1 1 A 75 75 ALA C C 75 173.698 175.963 -2.265 1
1 815 . 16 1 1 A 75 75 ALA CA C 75 47.904 50.356 -2.452 1
1 816 . 16 1 1 A 75 75 ALA CB C 75 19.634 21.086 -1.452 1
1 817 . 16 1 1 A 75 75 ALA N N 75 121.555 123.472 -1.917 1
1 818 . 16 1 1 A 76 76 PHE H H 76 9.066 9.286 -0.220 1
1 819 . 16 1 1 A 76 76 PHE HA H 76 5.496 5.389 0.107 1
1 827 . 16 1 1 A 76 76 PHE C C 76 172.268 175.116 -2.848 1
1 828 . 16 1 1 A 76 76 PHE CA C 76 54.216 57.388 -3.172 1
1 829 . 16 1 1 A 76 76 PHE CB C 76 41.901 41.383 0.518 1
1 835 . 16 1 1 A 76 76 PHE N N 76 116.545 122.910 -6.365 1
1 836 . 16 1 1 A 77 77 ARG H H 77 9.216 8.914 0.302 1
1 837 . 16 1 1 A 77 77 ARG HA H 77 4.357 5.152 -0.795 1
1 845 . 16 1 1 A 77 77 ARG C C 77 169.998 174.104 -4.106 1
1 846 . 16 1 1 A 77 77 ARG CA C 77 52.414 54.689 -2.275 1
1 847 . 16 1 1 A 77 77 ARG CB C 77 30.794 33.987 -3.193 1
1 850 . 16 1 1 A 77 77 ARG N N 77 115.738 119.056 -3.318 1
1 852 . 16 1 1 A 78 78 VAL H H 78 8.135 8.856 -0.721 1
1 853 . 16 1 1 A 78 78 VAL HA H 78 4.884 4.714 0.170 1
1 861 . 16 1 1 A 78 78 VAL C C 78 171.098 174.828 -3.730 1
1 862 . 16 1 1 A 78 78 VAL CA C 78 57.566 60.771 -3.205 1
1 863 . 16 1 1 A 78 78 VAL CB C 78 33.146 33.133 0.013 1
1 866 . 16 1 1 A 78 78 VAL N N 78 117.942 124.088 -6.146 1
1 867 . 16 1 1 A 79 79 LEU H H 79 9.167 8.525 0.642 1
1 868 . 16 1 1 A 79 79 LEU HA H 79 4.575 4.985 -0.410 1
1 878 . 16 1 1 A 79 79 LEU C C 79 171.447 174.988 -3.541 1
1 879 . 16 1 1 A 79 79 LEU CA C 79 51.642 53.472 -1.830 1
1 880 . 16 1 1 A 79 79 LEU CB C 79 42.776 45.493 -2.717 1
1 884 . 16 1 1 A 79 79 LEU N N 79 123.913 121.744 2.169 1
1 885 . 16 1 1 A 80 80 ALA H H 80 9.325 8.572 0.753 1
1 886 . 16 1 1 A 80 80 ALA HA H 80 4.654 3.745 0.909 1
1 890 . 16 1 1 A 80 80 ALA C C 80 172.070 177.212 -5.142 1
1 891 . 16 1 1 A 80 80 ALA CA C 80 48.169 51.906 -3.737 1
1 892 . 16 1 1 A 80 80 ALA CB C 80 20.366 19.202 1.164 1
1 893 . 16 1 1 A 80 80 ALA N N 80 124.135 124.347 -0.212 1
1 894 . 16 1 1 A 81 81 VAL H H 81 7.953 8.209 -0.256 1
1 895 . 16 1 1 A 81 81 VAL HA H 81 4.293 4.812 -0.519 1
1 903 . 16 1 1 A 81 81 VAL C C 81 172.873 174.266 -1.393 1
1 904 . 16 1 1 A 81 81 VAL CA C 81 58.959 60.385 -1.426 1
1 905 . 16 1 1 A 81 81 VAL CB C 81 31.412 35.141 -3.729 1
1 908 . 16 1 1 A 81 81 VAL N N 81 118.503 120.728 -2.225 1
1 909 . 16 1 1 A 82 82 ASN H H 82 8.262 8.299 -0.037 1
1 910 . 16 1 1 A 82 82 ASN HA H 82 4.945 4.988 -0.043 1
1 915 . 16 1 1 A 82 82 ASN C C 82 173.273 175.274 -2.001 1
1 916 . 16 1 1 A 82 82 ASN CA C 82 48.714 51.769 -3.055 1
1 917 . 16 1 1 A 82 82 ASN CB C 82 36.796 39.938 -3.142 1
1 918 . 16 1 1 A 82 82 ASN N N 82 125.425 123.705 1.720 1
1 920 . 16 1 1 A 83 83 SER HA H 83 3.966 4.086 -0.120 1
1 923 . 16 1 1 A 83 83 SER C C 83 172.812 176.721 -3.909 1
1 924 . 16 1 1 A 83 83 SER CA C 83 59.047 62.444 -3.397 1
1 925 . 16 1 1 A 83 83 SER CB C 83 60.406 62.849 -2.443 1
1 926 . 16 1 1 A 84 84 ILE H H 84 7.803 7.957 -0.154 1
1 927 . 16 1 1 A 84 84 ILE HA H 84 3.862 3.731 0.131 1
1 937 . 16 1 1 A 84 84 ILE C C 84 174.481 176.227 -1.746 1
1 938 . 16 1 1 A 84 84 ILE CA C 84 59.188 64.045 -4.857 1
1 939 . 16 1 1 A 84 84 ILE CB C 84 34.677 38.207 -3.530 1
1 943 . 16 1 1 A 84 84 ILE N N 84 121.222 119.206 2.016 1
1 944 . 16 1 1 A 85 85 GLY H H 85 7.435 7.093 0.342 1
1 945 . 16 1 1 A 85 85 GLY HA2 H 85 4.149 4.042 0.107 1
1 946 . 16 1 1 A 85 85 GLY HA3 H 85 3.747 4.044 -0.297 1
1 947 . 16 1 1 A 85 85 GLY C C 85 168.589 172.282 -3.693 1
1 948 . 16 1 1 A 85 85 GLY CA C 85 42.931 45.177 -2.246 1
1 949 . 16 1 1 A 85 85 GLY N N 85 106.320 105.903 0.417 1
1 950 . 16 1 1 A 86 86 ARG H H 86 8.190 8.431 -0.241 1
1 951 . 16 1 1 A 86 86 ARG HA H 86 4.452 4.688 -0.236 1
1 958 . 16 1 1 A 86 86 ARG C C 86 175.286 176.252 -0.966 1
1 959 . 16 1 1 A 86 86 ARG CA C 86 53.223 55.195 -1.972 1
1 960 . 16 1 1 A 86 86 ARG CB C 86 29.517 30.768 -1.251 1
1 963 . 16 1 1 A 86 86 ARG N N 86 118.339 117.262 1.077 1
1 964 . 16 1 1 A 87 87 GLY H H 87 8.900 8.739 0.161 1
1 965 . 16 1 1 A 87 87 GLY HA2 H 87 4.211 3.987 0.224 1
1 966 . 16 1 1 A 87 87 GLY HA3 H 87 3.967 4.000 -0.033 1
1 967 . 16 1 1 A 87 87 GLY C C 87 168.101 172.847 -4.746 1
1 968 . 16 1 1 A 87 87 GLY CA C 87 42.281 44.105 -1.824 1
1 969 . 16 1 1 A 87 87 GLY N N 87 113.482 109.278 4.204 1
1 970 . 16 1 1 A 88 88 PRO HA H 88 4.563 4.546 0.017 1
1 977 . 16 1 1 A 88 88 PRO CA C 88 60.994 62.102 -1.108 1
1 978 . 16 1 1 A 88 88 PRO CB C 88 29.873 31.550 -1.677 1
1 981 . 16 1 1 A 89 89 PRO HA H 89 4.490 4.474 0.016 1
1 987 . 16 1 1 A 89 89 PRO C C 89 174.543 176.058 -1.515 1
1 988 . 16 1 1 A 89 89 PRO CA C 89 59.435 62.393 -2.958 1
1 989 . 16 1 1 A 89 89 PRO CB C 89 29.805 32.006 -2.201 1
1 992 . 16 1 1 A 90 90 SER H H 90 8.808 8.421 0.387 1
1 993 . 16 1 1 A 90 90 SER HA H 90 4.202 4.621 -0.419 1
1 996 . 16 1 1 A 90 90 SER C C 90 171.870 173.840 -1.970 1
1 997 . 16 1 1 A 90 90 SER CA C 90 55.868 57.089 -1.221 1
1 998 . 16 1 1 A 90 90 SER CB C 90 64.504 64.777 -0.273 1
1 999 . 16 1 1 A 90 90 SER N N 90 113.781 116.717 -2.936 1
1 1000 . 16 1 1 A 91 91 GLU H H 91 8.291 8.572 -0.281 1
1 1001 . 16 1 1 A 91 91 GLU HA H 91 4.131 4.161 -0.030 1
1 1006 . 16 1 1 A 91 91 GLU C C 91 174.882 176.413 -1.531 1
1 1007 . 16 1 1 A 91 91 GLU CA C 91 54.984 56.677 -1.693 1
1 1008 . 16 1 1 A 91 91 GLU CB C 91 27.643 29.563 -1.920 1
1 1010 . 16 1 1 A 91 91 GLU N N 91 117.930 123.424 -5.494 1
1 1011 . 16 1 1 A 92 92 ALA H H 92 8.605 8.325 0.280 1
1 1012 . 16 1 1 A 92 92 ALA HA H 92 5.068 4.740 0.328 1
1 1016 . 16 1 1 A 92 92 ALA C C 92 176.227 177.901 -1.674 1
1 1017 . 16 1 1 A 92 92 ALA CA C 92 48.997 52.992 -3.995 1
1 1018 . 16 1 1 A 92 92 ALA CB C 92 17.756 19.188 -1.432 1
1 1019 . 16 1 1 A 92 92 ALA N N 92 126.421 127.378 -0.957 1
1 1020 . 16 1 1 A 93 93 VAL H H 93 9.051 8.822 0.229 1
1 1021 . 16 1 1 A 93 93 VAL HA H 93 4.642 4.922 -0.280 1
1 1029 . 16 1 1 A 93 93 VAL C C 93 172.010 174.768 -2.758 1
1 1030 . 16 1 1 A 93 93 VAL CA C 93 57.495 60.010 -2.515 1
1 1031 . 16 1 1 A 93 93 VAL CB C 93 32.774 34.276 -1.502 1
1 1034 . 16 1 1 A 93 93 VAL N N 93 117.322 118.565 -1.243 1
1 1035 . 16 1 1 A 94 94 ARG H H 94 8.470 8.916 -0.446 1
1 1036 . 16 1 1 A 94 94 ARG HA H 94 5.692 5.393 0.299 1
1 1043 . 16 1 1 A 94 94 ARG C C 94 173.635 175.532 -1.897 1
1 1044 . 16 1 1 A 94 94 ARG CA C 94 52.038 55.150 -3.112 1
1 1045 . 16 1 1 A 94 94 ARG CB C 94 30.966 31.664 -0.698 1
1 1048 . 16 1 1 A 94 94 ARG N N 94 122.258 124.305 -2.047 1
1 1049 . 16 1 1 A 95 95 ALA H H 95 9.051 9.049 0.002 1
1 1050 . 16 1 1 A 95 95 ALA HA H 95 4.642 5.260 -0.618 1
1 1054 . 16 1 1 A 95 95 ALA C C 95 172.285 175.163 -2.878 1
1 1055 . 16 1 1 A 95 95 ALA CA C 95 49.191 50.648 -1.457 1
1 1056 . 16 1 1 A 95 95 ALA CB C 95 22.562 22.252 0.310 1
1 1057 . 16 1 1 A 95 95 ALA N N 95 121.931 127.005 -5.074 1
1 1058 . 16 1 1 A 96 96 ARG H H 96 8.550 8.624 -0.074 1
1 1059 . 16 1 1 A 96 96 ARG HA H 96 5.407 5.174 0.233 1
1 1066 . 16 1 1 A 96 96 ARG C C 96 174.547 176.033 -1.486 1
1 1067 . 16 1 1 A 96 96 ARG CA C 96 51.439 55.396 -3.957 1
1 1068 . 16 1 1 A 96 96 ARG CB C 96 30.708 31.500 -0.792 1
1 1071 . 16 1 1 A 96 96 ARG N N 96 121.155 124.567 -3.412 1
1 1072 . 16 1 1 A 97 97 THR H H 97 8.797 8.961 -0.164 1
1 1073 . 16 1 1 A 97 97 THR HA H 97 4.116 4.455 -0.339 1
1 1078 . 16 1 1 A 97 97 THR C C 97 173.577 175.032 -1.455 1
1 1079 . 16 1 1 A 97 97 THR CA C 97 58.800 61.751 -2.951 1
1 1080 . 16 1 1 A 97 97 THR CB C 97 67.461 69.631 -2.170 1
1 1082 . 16 1 1 A 97 97 THR N N 97 114.657 118.026 -3.369 1
1 1083 . 16 1 1 A 98 98 GLY H H 98 7.505 8.516 -1.011 1
1 1084 . 16 1 1 A 98 98 GLY HA2 H 98 3.866 4.104 -0.238 1
1 1085 . 16 1 1 A 98 98 GLY HA3 H 98 3.743 4.154 -0.411 1
1 1086 . 16 1 1 A 98 98 GLY C C 98 170.637 172.683 -2.046 1
1 1087 . 16 1 1 A 98 98 GLY CA C 98 42.332 44.599 -2.267 1
1 1088 . 16 1 1 A 98 98 GLY N N 98 106.172 108.109 -1.937 1
1 1089 . 16 1 1 A 99 99 GLU H H 99 8.145 8.365 -0.220 1
1 1090 . 16 1 1 A 99 99 GLU HA H 99 4.210 5.109 -0.899 1
1 1095 . 16 1 1 A 99 99 GLU C C 99 174.134 175.752 -1.618 1
1 1096 . 16 1 1 A 99 99 GLU CA C 99 53.828 55.162 -1.334 1
1 1097 . 16 1 1 A 99 99 GLU CB C 99 28.774 32.684 -3.910 1
1 1099 . 16 1 1 A 99 99 GLU N N 99 117.634 118.042 -0.408 1
1 1100 . 16 1 1 A 100 100 GLN H H 100 8.647 9.060 -0.413 1
1 1101 . 16 1 1 A 100 100 GLN HA H 100 4.247 4.493 -0.246 1
1 1108 . 16 1 1 A 100 100 GLN C C 100 173.348 174.980 -1.632 1
1 1109 . 16 1 1 A 100 100 GLN CA C 100 53.634 57.576 -3.942 1
1 1110 . 16 1 1 A 100 100 GLN CB C 100 27.392 31.811 -4.419 1
1 1112 . 16 1 1 A 100 100 GLN N N 100 121.960 122.215 -0.255 1
1 1114 . 16 1 1 A 101 101 SER H H 101 8.416 7.849 0.567 1
1 1115 . 16 1 1 A 101 101 SER HA H 101 4.418 4.810 -0.392 1
1 1117 . 16 1 1 A 101 101 SER C C 101 172.148 173.543 -1.395 1
1 1118 . 16 1 1 A 101 101 SER CA C 101 55.926 56.671 -0.745 1
1 1119 . 16 1 1 A 101 101 SER CB C 101 61.617 66.416 -4.799 1
1 1120 . 16 1 1 A 101 101 SER N N 101 118.609 113.314 5.295 1
1 1121 . 16 1 1 A 102 102 GLY H H 102 8.233 8.636 -0.403 1
1 1122 . 16 1 1 A 102 102 GLY HA2 H 102 4.080 3.992 0.088 1
1 1123 . 16 1 1 A 102 102 GLY HA3 H 102 3.981 4.005 -0.024 1
1 1124 . 16 1 1 A 102 102 GLY C C 102 169.461 174.529 -5.068 1
1 1125 . 16 1 1 A 102 102 GLY CA C 102 42.332 45.229 -2.897 1
1 1126 . 16 1 1 A 102 102 GLY N N 102 110.483 115.113 -4.630 1
1 1127 . 16 1 1 A 103 103 PRO HA H 103 4.618 4.399 0.219 1
1 1134 . 16 1 1 A 103 103 PRO CA C 103 57.843 64.865 -7.022 1
1 1135 . 16 1 1 A 103 103 PRO CB C 103 28.671 32.005 -3.334 1
1 1 . 17 1 1 A 6 6 SER HA H 6 4.492 5.358 -0.866 1
1 4 . 17 1 1 A 6 6 SER CA C 6 55.621 56.730 -1.109 1
1 5 . 17 1 1 A 6 6 SER CB C 6 62.104 64.800 -2.696 1
1 6 . 17 1 1 A 7 7 GLY H H 7 8.244 8.298 -0.054 1
1 7 . 17 1 1 A 7 7 GLY HA2 H 7 3.873 4.045 -0.172 1
1 8 . 17 1 1 A 7 7 GLY HA3 H 7 3.737 4.052 -0.315 1
1 9 . 17 1 1 A 7 7 GLY CA C 7 41.743 44.056 -2.313 1
1 10 . 17 1 1 A 7 7 GLY N N 7 109.193 110.116 -0.923 1
1 11 . 17 1 1 A 8 8 PRO HA H 8 4.286 4.603 -0.317 1
1 18 . 17 1 1 A 8 8 PRO C C 8 173.841 175.452 -1.611 1
1 19 . 17 1 1 A 8 8 PRO CA C 8 60.528 62.591 -2.063 1
1 20 . 17 1 1 A 8 8 PRO CB C 8 30.299 33.164 -2.865 1
1 23 . 17 1 1 A 9 9 LYS H H 9 8.877 8.333 0.544 1
1 24 . 17 1 1 A 9 9 LYS HA H 9 4.360 4.803 -0.443 1
1 33 . 17 1 1 A 9 9 LYS C C 9 173.492 174.278 -0.786 1
1 34 . 17 1 1 A 9 9 LYS CA C 9 52.135 53.107 -0.972 1
1 35 . 17 1 1 A 9 9 LYS CB C 9 28.798 33.195 -4.397 1
1 39 . 17 1 1 A 9 9 LYS N N 9 120.404 120.636 -0.232 1
1 40 . 17 1 1 A 10 10 PRO HA H 10 4.284 4.622 -0.338 1
1 47 . 17 1 1 A 10 10 PRO CA C 10 59.326 61.627 -2.301 1
1 48 . 17 1 1 A 10 10 PRO CB C 10 28.825 31.550 -2.725 1
1 51 . 17 1 1 A 11 11 PRO HA H 11 4.468 4.753 -0.285 1
1 58 . 17 1 1 A 11 11 PRO C C 11 171.993 176.339 -4.346 1
1 59 . 17 1 1 A 11 11 PRO CA C 11 60.422 62.703 -2.281 1
1 60 . 17 1 1 A 11 11 PRO CB C 11 30.418 32.412 -1.994 1
1 63 . 17 1 1 A 12 12 ILE H H 12 7.554 8.067 -0.513 1
1 64 . 17 1 1 A 12 12 ILE HA H 12 4.676 4.682 -0.006 1
1 74 . 17 1 1 A 12 12 ILE C C 12 171.721 175.159 -3.438 1
1 75 . 17 1 1 A 12 12 ILE CA C 12 56.843 59.083 -2.240 1
1 76 . 17 1 1 A 12 12 ILE CB C 12 40.560 40.953 -0.393 1
1 80 . 17 1 1 A 12 12 ILE N N 12 109.695 117.075 -7.380 1
1 81 . 17 1 1 A 13 13 ASP H H 13 8.435 9.041 -0.606 1
1 82 . 17 1 1 A 13 13 ASP HA H 13 4.094 4.233 -0.139 1
1 85 . 17 1 1 A 13 13 ASP C C 13 171.803 176.092 -4.289 1
1 86 . 17 1 1 A 13 13 ASP CA C 13 52.610 55.260 -2.650 1
1 87 . 17 1 1 A 13 13 ASP CB C 13 36.357 40.600 -4.243 1
1 88 . 17 1 1 A 13 13 ASP N N 13 116.219 121.966 -5.747 1
1 89 . 17 1 1 A 14 14 LEU H H 14 7.483 8.038 -0.555 1
1 90 . 17 1 1 A 14 14 LEU HA H 14 4.990 4.729 0.261 1
1 100 . 17 1 1 A 14 14 LEU C C 14 174.702 175.360 -0.658 1
1 101 . 17 1 1 A 14 14 LEU CA C 14 53.811 55.260 -1.449 1
1 102 . 17 1 1 A 14 14 LEU CB C 14 40.148 42.362 -2.214 1
1 106 . 17 1 1 A 14 14 LEU N N 14 118.463 121.097 -2.634 1
1 107 . 17 1 1 A 15 15 VAL H H 15 9.209 8.626 0.583 1
1 108 . 17 1 1 A 15 15 VAL HA H 15 4.250 4.777 -0.527 1
1 116 . 17 1 1 A 15 15 VAL C C 15 172.080 174.255 -2.175 1
1 117 . 17 1 1 A 15 15 VAL CA C 15 58.570 60.422 -1.852 1
1 118 . 17 1 1 A 15 15 VAL CB C 15 34.146 36.067 -1.921 1
1 121 . 17 1 1 A 15 15 VAL N N 15 124.833 127.379 -2.546 1
1 122 . 17 1 1 A 16 16 VAL H H 16 8.390 8.903 -0.513 1
1 123 . 17 1 1 A 16 16 VAL HA H 16 4.343 4.513 -0.170 1
1 131 . 17 1 1 A 16 16 VAL C C 16 174.672 175.739 -1.067 1
1 132 . 17 1 1 A 16 16 VAL CA C 16 59.188 61.312 -2.124 1
1 133 . 17 1 1 A 16 16 VAL CB C 16 29.187 33.864 -4.677 1
1 136 . 17 1 1 A 16 16 VAL N N 16 124.654 124.981 -0.327 1
1 137 . 17 1 1 A 17 17 THR H H 17 8.638 8.894 -0.256 1
1 138 . 17 1 1 A 17 17 THR HA H 17 4.195 4.472 -0.277 1
1 143 . 17 1 1 A 17 17 THR C C 17 172.661 172.984 -0.323 1
1 144 . 17 1 1 A 17 17 THR CA C 17 60.318 63.165 -2.847 1
1 145 . 17 1 1 A 17 17 THR CB C 17 66.420 71.423 -5.003 1
1 147 . 17 1 1 A 17 17 THR N N 17 120.942 120.711 0.231 1
1 148 . 17 1 1 A 18 18 GLU H H 18 7.361 7.720 -0.359 1
1 149 . 17 1 1 A 18 18 GLU HA H 18 4.497 4.793 -0.296 1
1 154 . 17 1 1 A 18 18 GLU C C 18 171.691 175.209 -3.518 1
1 155 . 17 1 1 A 18 18 GLU CA C 18 53.687 55.032 -1.345 1
1 156 . 17 1 1 A 18 18 GLU CB C 18 30.802 33.700 -2.898 1
1 158 . 17 1 1 A 18 18 GLU N N 18 119.088 118.256 0.832 1
1 159 . 17 1 1 A 19 19 THR H H 19 8.164 8.636 -0.472 1
1 160 . 17 1 1 A 19 19 THR HA H 19 4.912 5.095 -0.183 1
1 165 . 17 1 1 A 19 19 THR C C 19 171.606 172.902 -1.296 1
1 166 . 17 1 1 A 19 19 THR CA C 19 58.473 60.596 -2.123 1
1 167 . 17 1 1 A 19 19 THR CB C 19 70.103 71.326 -1.223 1
1 169 . 17 1 1 A 19 19 THR N N 19 112.424 113.533 -1.109 1
1 170 . 17 1 1 A 20 20 THR H H 20 8.750 9.044 -0.294 1
1 171 . 17 1 1 A 20 20 THR HA H 20 4.710 4.822 -0.112 1
1 176 . 17 1 1 A 20 20 THR C C 20 172.785 175.788 -3.003 1
1 177 . 17 1 1 A 20 20 THR CA C 20 58.059 60.547 -2.488 1
1 178 . 17 1 1 A 20 20 THR CB C 20 68.782 71.668 -2.886 1
1 180 . 17 1 1 A 20 20 THR N N 20 113.438 120.567 -7.129 1
1 181 . 17 1 1 A 21 21 ALA H H 21 8.453 8.955 -0.502 1
1 182 . 17 1 1 A 21 21 ALA HA H 21 4.079 4.297 -0.218 1
1 186 . 17 1 1 A 21 21 ALA C C 21 174.130 177.860 -3.730 1
1 187 . 17 1 1 A 21 21 ALA CA C 21 52.680 54.886 -2.206 1
1 188 . 17 1 1 A 21 21 ALA CB C 21 16.893 18.509 -1.616 1
1 189 . 17 1 1 A 21 21 ALA N N 21 120.078 125.484 -5.406 1
1 190 . 17 1 1 A 22 22 THR H H 22 7.132 7.545 -0.413 1
1 191 . 17 1 1 A 22 22 THR HA H 22 4.433 4.695 -0.262 1
1 196 . 17 1 1 A 22 22 THR C C 22 171.434 173.456 -2.022 1
1 197 . 17 1 1 A 22 22 THR CA C 22 56.836 60.508 -3.672 1
1 198 . 17 1 1 A 22 22 THR CB C 22 68.772 69.479 -0.707 1
1 200 . 17 1 1 A 22 22 THR N N 22 95.772 104.070 -8.298 1
1 201 . 17 1 1 A 23 23 SER H H 23 7.326 7.740 -0.414 1
1 202 . 17 1 1 A 23 23 SER HA H 23 5.562 5.336 0.226 1
1 205 . 17 1 1 A 23 23 SER C C 23 169.267 172.110 -2.843 1
1 206 . 17 1 1 A 23 23 SER CA C 23 54.445 57.687 -3.242 1
1 207 . 17 1 1 A 23 23 SER CB C 23 65.905 67.516 -1.611 1
1 208 . 17 1 1 A 23 23 SER N N 23 115.757 115.819 -0.062 1
1 209 . 17 1 1 A 24 24 VAL H H 24 7.983 8.456 -0.473 1
1 210 . 17 1 1 A 24 24 VAL HA H 24 4.334 4.485 -0.151 1
1 218 . 17 1 1 A 24 24 VAL C C 24 171.917 173.403 -1.486 1
1 219 . 17 1 1 A 24 24 VAL CA C 24 58.642 60.400 -1.758 1
1 220 . 17 1 1 A 24 24 VAL CB C 24 34.254 34.672 -0.418 1
1 223 . 17 1 1 A 24 24 VAL N N 24 116.595 120.693 -4.098 1
1 224 . 17 1 1 A 25 25 THR H H 25 8.636 8.908 -0.272 1
1 225 . 17 1 1 A 25 25 THR HA H 25 4.833 5.013 -0.180 1
1 230 . 17 1 1 A 25 25 THR C C 25 169.721 173.015 -3.294 1
1 231 . 17 1 1 A 25 25 THR CA C 25 59.699 61.085 -1.386 1
1 232 . 17 1 1 A 25 25 THR CB C 25 67.303 71.061 -3.758 1
1 234 . 17 1 1 A 25 25 THR N N 25 121.690 122.153 -0.463 1
1 235 . 17 1 1 A 26 26 LEU H H 26 8.629 9.076 -0.447 1
1 236 . 17 1 1 A 26 26 LEU HA H 26 5.315 5.066 0.249 1
1 246 . 17 1 1 A 26 26 LEU C C 26 173.182 175.051 -1.869 1
1 247 . 17 1 1 A 26 26 LEU CA C 26 50.643 53.841 -3.198 1
1 248 . 17 1 1 A 26 26 LEU CB C 26 43.976 46.414 -2.438 1
1 252 . 17 1 1 A 26 26 LEU N N 26 126.843 126.753 0.090 1
1 253 . 17 1 1 A 27 27 THR H H 27 8.704 9.116 -0.412 1
1 254 . 17 1 1 A 27 27 THR HA H 27 4.822 5.275 -0.453 1
1 259 . 17 1 1 A 27 27 THR C C 27 169.840 173.331 -3.491 1
1 260 . 17 1 1 A 27 27 THR CA C 27 58.077 59.467 -1.390 1
1 261 . 17 1 1 A 27 27 THR CB C 27 69.666 71.742 -2.076 1
1 263 . 17 1 1 A 27 27 THR N N 27 111.513 115.651 -4.138 1
1 264 . 17 1 1 A 28 28 TRP H H 28 7.339 8.051 -0.712 1
1 265 . 17 1 1 A 28 28 TRP HA H 28 4.963 5.412 -0.449 1
1 274 . 17 1 1 A 28 28 TRP C C 28 170.637 172.359 -1.722 1
1 275 . 17 1 1 A 28 28 TRP CA C 28 54.438 55.652 -1.214 1
1 276 . 17 1 1 A 28 28 TRP CB C 28 27.497 31.299 -3.802 1
1 282 . 17 1 1 A 28 28 TRP N N 28 117.895 119.169 -1.274 1
1 284 . 17 1 1 A 29 29 ASP H H 29 8.696 9.348 -0.652 1
1 285 . 17 1 1 A 29 29 ASP HA H 29 4.971 5.104 -0.133 1
1 288 . 17 1 1 A 29 29 ASP C C 29 174.901 176.951 -2.050 1
1 289 . 17 1 1 A 29 29 ASP CA C 29 50.178 52.781 -2.603 1
1 290 . 17 1 1 A 29 29 ASP CB C 29 42.291 43.180 -0.889 1
1 291 . 17 1 1 A 29 29 ASP N N 29 117.477 121.917 -4.440 1
1 292 . 17 1 1 A 30 30 SER H H 30 8.800 8.974 -0.174 1
1 293 . 17 1 1 A 30 30 SER HA H 30 4.389 4.039 0.350 1
1 296 . 17 1 1 A 30 30 SER C C 30 174.032 175.094 -1.062 1
1 297 . 17 1 1 A 30 30 SER CA C 30 58.694 62.009 -3.315 1
1 298 . 17 1 1 A 30 30 SER CB C 30 62.428 63.306 -0.878 1
1 299 . 17 1 1 A 30 30 SER N N 30 118.275 120.476 -2.201 1
1 300 . 17 1 1 A 31 31 GLY H H 31 8.759 8.626 0.133 1
1 301 . 17 1 1 A 31 31 GLY HA2 H 31 4.239 3.975 0.264 1
1 302 . 17 1 1 A 31 31 GLY HA3 H 31 3.555 4.003 -0.448 1
1 303 . 17 1 1 A 31 31 GLY C C 31 171.325 173.567 -2.242 1
1 304 . 17 1 1 A 31 31 GLY CA C 31 43.637 45.501 -1.864 1
1 305 . 17 1 1 A 31 31 GLY N N 31 107.961 109.305 -1.344 1
1 306 . 17 1 1 A 32 32 ASN H H 32 8.173 7.909 0.264 1
1 307 . 17 1 1 A 32 32 ASN HA H 32 4.749 5.232 -0.483 1
1 312 . 17 1 1 A 32 32 ASN C C 32 171.355 174.926 -3.571 1
1 313 . 17 1 1 A 32 32 ASN CA C 32 50.795 51.657 -0.862 1
1 314 . 17 1 1 A 32 32 ASN CB C 32 41.508 41.191 0.317 1
1 315 . 17 1 1 A 32 32 ASN N N 32 117.781 118.719 -0.938 1
1 317 . 17 1 1 A 33 33 SER HA H 33 4.291 4.603 -0.312 1
1 320 . 17 1 1 A 33 33 SER C C 33 172.449 174.500 -2.051 1
1 321 . 17 1 1 A 33 33 SER CA C 33 56.733 59.691 -2.958 1
1 322 . 17 1 1 A 33 33 SER CB C 33 60.884 64.565 -3.681 1
1 323 . 17 1 1 A 34 34 GLU H H 34 7.731 7.603 0.128 1
1 324 . 17 1 1 A 34 34 GLU HA H 34 4.556 4.613 -0.057 1
1 329 . 17 1 1 A 34 34 GLU C C 34 171.792 175.269 -3.477 1
1 330 . 17 1 1 A 34 34 GLU CA C 34 51.818 54.785 -2.967 1
1 331 . 17 1 1 A 34 34 GLU CB C 34 26.891 30.066 -3.175 1
1 333 . 17 1 1 A 34 34 GLU N N 34 122.319 119.538 2.781 1
1 334 . 17 1 1 A 35 35 PRO HA H 35 4.165 4.769 -0.604 1
1 341 . 17 1 1 A 35 35 PRO C C 35 174.288 176.898 -2.610 1
1 342 . 17 1 1 A 35 35 PRO CA C 35 61.374 62.362 -0.988 1
1 343 . 17 1 1 A 35 35 PRO CB C 35 29.887 29.835 0.052 1
1 346 . 17 1 1 A 36 36 VAL H H 36 8.348 8.132 0.216 1
1 347 . 17 1 1 A 36 36 VAL HA H 36 3.899 4.237 -0.338 1
1 355 . 17 1 1 A 36 36 VAL C C 36 173.344 177.122 -3.778 1
1 356 . 17 1 1 A 36 36 VAL CA C 36 59.014 63.226 -4.212 1
1 357 . 17 1 1 A 36 36 VAL CB C 36 31.865 31.861 0.004 1
1 360 . 17 1 1 A 36 36 VAL N N 36 122.051 123.655 -1.604 1
1 361 . 17 1 1 A 37 37 THR H H 37 8.780 8.379 0.401 1
1 362 . 17 1 1 A 37 37 THR HA H 37 3.923 4.232 -0.309 1
1 367 . 17 1 1 A 37 37 THR C C 37 172.171 174.569 -2.398 1
1 368 . 17 1 1 A 37 37 THR CA C 37 63.155 64.549 -1.394 1
1 369 . 17 1 1 A 37 37 THR CB C 37 65.941 69.367 -3.426 1
1 371 . 17 1 1 A 37 37 THR N N 37 122.351 118.850 3.501 1
1 372 . 17 1 1 A 38 38 TYR H H 38 7.304 7.365 -0.061 1
1 373 . 17 1 1 A 38 38 TYR HA H 38 4.439 5.074 -0.635 1
1 380 . 17 1 1 A 38 38 TYR C C 38 168.385 172.370 -3.985 1
1 381 . 17 1 1 A 38 38 TYR CA C 38 54.101 56.373 -2.272 1
1 382 . 17 1 1 A 38 38 TYR CB C 38 35.874 40.278 -4.404 1
1 387 . 17 1 1 A 38 38 TYR N N 38 113.984 115.056 -1.072 1
1 388 . 17 1 1 A 39 39 TYR H H 39 9.445 8.722 0.723 1
1 389 . 17 1 1 A 39 39 TYR HA H 39 5.293 5.293 0.000 1
1 396 . 17 1 1 A 39 39 TYR C C 39 172.781 175.905 -3.124 1
1 397 . 17 1 1 A 39 39 TYR CA C 39 54.322 55.571 -1.249 1
1 398 . 17 1 1 A 39 39 TYR CB C 39 39.035 40.211 -1.176 1
1 401 . 17 1 1 A 39 39 TYR N N 39 115.092 118.794 -3.702 1
1 402 . 17 1 1 A 40 40 GLY H H 40 8.870 8.096 0.774 1
1 403 . 17 1 1 A 40 40 GLY HA2 H 40 5.137 4.039 1.098 1
1 404 . 17 1 1 A 40 40 GLY HA3 H 40 3.285 4.164 -0.879 1
1 405 . 17 1 1 A 40 40 GLY C C 40 169.688 172.945 -3.257 1
1 406 . 17 1 1 A 40 40 GLY CA C 40 41.415 44.563 -3.148 1
1 407 . 17 1 1 A 40 40 GLY N N 40 106.573 111.239 -4.666 1
1 408 . 17 1 1 A 41 41 ILE H H 41 8.917 8.323 0.594 1
1 409 . 17 1 1 A 41 41 ILE HA H 41 4.527 4.789 -0.262 1
1 419 . 17 1 1 A 41 41 ILE C C 41 172.692 174.674 -1.982 1
1 420 . 17 1 1 A 41 41 ILE CA C 41 57.597 60.083 -2.486 1
1 421 . 17 1 1 A 41 41 ILE CB C 41 37.840 42.130 -4.290 1
1 425 . 17 1 1 A 41 41 ILE N N 41 121.746 120.737 1.009 1
1 426 . 17 1 1 A 42 42 GLN H H 42 9.063 8.612 0.451 1
1 427 . 17 1 1 A 42 42 GLN HA H 42 5.655 5.308 0.347 1
1 434 . 17 1 1 A 42 42 GLN C C 42 172.841 174.377 -1.536 1
1 435 . 17 1 1 A 42 42 GLN CA C 42 50.789 54.570 -3.781 1
1 436 . 17 1 1 A 42 42 GLN CB C 42 28.898 32.251 -3.353 1
1 438 . 17 1 1 A 42 42 GLN N N 42 125.141 125.591 -0.450 1
1 440 . 17 1 1 A 43 43 TYR H H 43 9.066 8.905 0.161 1
1 441 . 17 1 1 A 43 43 TYR HA H 43 5.922 6.046 -0.124 1
1 448 . 17 1 1 A 43 43 TYR C C 43 171.219 173.018 -1.799 1
1 449 . 17 1 1 A 43 43 TYR CA C 43 53.349 55.941 -2.592 1
1 450 . 17 1 1 A 43 43 TYR CB C 43 41.074 42.732 -1.658 1
1 455 . 17 1 1 A 43 43 TYR N N 43 118.018 120.013 -1.995 1
1 456 . 17 1 1 A 44 44 ARG H H 44 8.400 8.525 -0.125 1
1 457 . 17 1 1 A 44 44 ARG HA H 44 4.542 4.348 0.194 1
1 464 . 17 1 1 A 44 44 ARG C C 44 171.974 173.993 -2.019 1
1 465 . 17 1 1 A 44 44 ARG CA C 44 52.453 54.810 -2.357 1
1 466 . 17 1 1 A 44 44 ARG CB C 44 31.125 32.502 -1.377 1
1 469 . 17 1 1 A 44 44 ARG N N 44 115.214 120.211 -4.997 1
1 470 . 17 1 1 A 45 45 ALA H H 45 8.846 8.047 0.799 1
1 471 . 17 1 1 A 45 45 ALA HA H 45 3.894 2.875 1.019 1
1 475 . 17 1 1 A 45 45 ALA C C 45 175.721 177.109 -1.388 1
1 476 . 17 1 1 A 45 45 ALA CA C 45 50.372 52.130 -1.758 1
1 477 . 17 1 1 A 45 45 ALA CB C 45 15.732 18.759 -3.027 1
1 478 . 17 1 1 A 45 45 ALA N N 45 126.463 127.403 -0.940 1
1 479 . 17 1 1 A 46 46 ALA H H 46 8.282 8.269 0.013 1
1 480 . 17 1 1 A 46 46 ALA HA H 46 3.922 3.881 0.041 1
1 484 . 17 1 1 A 46 46 ALA C C 46 176.236 178.167 -1.931 1
1 485 . 17 1 1 A 46 46 ALA CA C 46 50.773 53.783 -3.010 1
1 486 . 17 1 1 A 46 46 ALA CB C 46 16.244 18.447 -2.203 1
1 487 . 17 1 1 A 46 46 ALA N N 46 126.301 125.357 0.944 1
1 488 . 17 1 1 A 47 47 GLY HA2 H 47 3.882 3.935 -0.053 1
1 489 . 17 1 1 A 47 47 GLY HA3 H 47 3.695 3.961 -0.266 1
1 490 . 17 1 1 A 47 47 GLY C C 47 171.795 175.990 -4.195 1
1 491 . 17 1 1 A 47 47 GLY CA C 47 43.327 45.363 -2.036 1
1 492 . 17 1 1 A 48 48 THR H H 48 7.145 7.871 -0.726 1
1 493 . 17 1 1 A 48 48 THR HA H 48 4.417 3.879 0.538 1
1 498 . 17 1 1 A 48 48 THR C C 48 171.325 174.509 -3.184 1
1 499 . 17 1 1 A 48 48 THR CA C 48 58.271 66.561 -8.290 1
1 500 . 17 1 1 A 48 48 THR CB C 48 68.846 68.413 0.433 1
1 502 . 17 1 1 A 48 48 THR N N 48 110.190 115.401 -5.211 1
1 503 . 17 1 1 A 49 49 GLU H H 49 8.346 7.955 0.391 1
1 504 . 17 1 1 A 49 49 GLU HA H 49 4.277 3.975 0.302 1
1 509 . 17 1 1 A 49 49 GLU C C 49 174.109 175.714 -1.605 1
1 510 . 17 1 1 A 49 49 GLU CA C 49 52.909 57.742 -4.833 1
1 511 . 17 1 1 A 49 49 GLU CB C 49 27.845 27.208 0.637 1
1 513 . 17 1 1 A 49 49 GLU N N 49 119.985 118.027 1.958 1
1 514 . 17 1 1 A 50 50 GLY H H 50 7.617 8.131 -0.514 1
1 515 . 17 1 1 A 50 50 GLY HA2 H 50 3.935 4.072 -0.137 1
1 516 . 17 1 1 A 50 50 GLY HA3 H 50 3.935 4.107 -0.172 1
1 517 . 17 1 1 A 50 50 GLY C C 50 168.223 172.765 -4.542 1
1 518 . 17 1 1 A 50 50 GLY CA C 50 42.121 44.222 -2.101 1
1 519 . 17 1 1 A 50 50 GLY N N 50 108.670 107.702 0.968 1
1 520 . 17 1 1 A 51 51 PRO HA H 51 4.298 4.661 -0.363 1
1 527 . 17 1 1 A 51 51 PRO C C 51 175.067 177.106 -2.039 1
1 528 . 17 1 1 A 51 51 PRO CA C 51 60.175 62.885 -2.710 1
1 529 . 17 1 1 A 51 51 PRO CB C 51 30.052 31.668 -1.616 1
1 532 . 17 1 1 A 52 52 PHE H H 52 8.442 8.613 -0.171 1
1 533 . 17 1 1 A 52 52 PHE HA H 52 3.981 4.610 -0.629 1
1 541 . 17 1 1 A 52 52 PHE C C 52 175.141 175.725 -0.584 1
1 542 . 17 1 1 A 52 52 PHE CA C 52 56.808 57.688 -0.880 1
1 543 . 17 1 1 A 52 52 PHE CB C 52 36.830 39.582 -2.752 1
1 549 . 17 1 1 A 52 52 PHE N N 52 118.707 122.923 -4.216 1
1 550 . 17 1 1 A 53 53 GLN H H 53 8.778 7.913 0.865 1
1 551 . 17 1 1 A 53 53 GLN HA H 53 4.149 4.215 -0.066 1
1 558 . 17 1 1 A 53 53 GLN C C 53 172.773 175.503 -2.730 1
1 559 . 17 1 1 A 53 53 GLN CA C 53 52.999 56.272 -3.273 1
1 560 . 17 1 1 A 53 53 GLN CB C 53 26.962 29.203 -2.241 1
1 562 . 17 1 1 A 53 53 GLN N N 53 122.164 121.465 0.699 1
1 564 . 17 1 1 A 54 54 GLU H H 54 8.432 8.580 -0.148 1
1 565 . 17 1 1 A 54 54 GLU HA H 54 5.533 4.941 0.592 1
1 570 . 17 1 1 A 54 54 GLU C C 54 173.930 174.729 -0.799 1
1 571 . 17 1 1 A 54 54 GLU CA C 54 52.981 55.614 -2.633 1
1 572 . 17 1 1 A 54 54 GLU CB C 54 31.712 33.177 -1.465 1
1 574 . 17 1 1 A 54 54 GLU N N 54 119.688 120.569 -0.881 1
1 575 . 17 1 1 A 55 55 VAL H H 55 9.077 8.474 0.603 1
1 576 . 17 1 1 A 55 55 VAL HA H 55 4.180 4.909 -0.729 1
1 584 . 17 1 1 A 55 55 VAL C C 55 171.811 174.489 -2.678 1
1 585 . 17 1 1 A 55 55 VAL CA C 55 59.664 61.137 -1.473 1
1 586 . 17 1 1 A 55 55 VAL CB C 55 31.827 34.724 -2.897 1
1 589 . 17 1 1 A 55 55 VAL N N 55 125.328 125.948 -0.620 1
1 590 . 17 1 1 A 56 56 ASP H H 56 8.639 8.894 -0.255 1
1 591 . 17 1 1 A 56 56 ASP HA H 56 5.250 5.696 -0.446 1
1 594 . 17 1 1 A 56 56 ASP C C 56 174.252 176.004 -1.752 1
1 595 . 17 1 1 A 56 56 ASP CA C 56 50.108 52.272 -2.164 1
1 596 . 17 1 1 A 56 56 ASP CB C 56 41.407 44.200 -2.793 1
1 597 . 17 1 1 A 56 56 ASP N N 56 125.773 125.158 0.615 1
1 598 . 17 1 1 A 57 57 GLY H H 57 7.222 8.718 -1.496 1
1 599 . 17 1 1 A 57 57 GLY HA2 H 57 3.479 3.898 -0.419 1
1 600 . 17 1 1 A 57 57 GLY HA3 H 57 2.719 3.963 -1.244 1
1 601 . 17 1 1 A 57 57 GLY C C 57 172.281 174.477 -2.196 1
1 602 . 17 1 1 A 57 57 GLY CA C 57 43.919 45.593 -1.674 1
1 603 . 17 1 1 A 57 57 GLY N N 57 105.564 110.936 -5.372 1
1 604 . 17 1 1 A 58 58 VAL H H 58 8.338 8.111 0.227 1
1 605 . 17 1 1 A 58 58 VAL HA H 58 3.860 4.357 -0.497 1
1 613 . 17 1 1 A 58 58 VAL C C 58 173.981 175.476 -1.495 1
1 614 . 17 1 1 A 58 58 VAL CA C 58 61.233 61.560 -0.327 1
1 615 . 17 1 1 A 58 58 VAL CB C 58 29.708 31.507 -1.799 1
1 618 . 17 1 1 A 58 58 VAL N N 58 121.466 120.996 0.470 1
1 619 . 17 1 1 A 59 59 ALA H H 59 9.038 8.710 0.328 1
1 620 . 17 1 1 A 59 59 ALA HA H 59 4.676 4.515 0.161 1
1 624 . 17 1 1 A 59 59 ALA C C 59 175.105 177.016 -1.911 1
1 625 . 17 1 1 A 59 59 ALA CA C 59 50.866 52.413 -1.547 1
1 626 . 17 1 1 A 59 59 ALA CB C 59 17.647 18.904 -1.257 1
1 627 . 17 1 1 A 59 59 ALA N N 59 130.928 130.587 0.341 1
1 628 . 17 1 1 A 60 60 THR H H 60 7.445 7.735 -0.290 1
1 629 . 17 1 1 A 60 60 THR HA H 60 4.642 4.673 -0.031 1
1 634 . 17 1 1 A 60 60 THR C C 60 169.528 174.106 -4.578 1
1 635 . 17 1 1 A 60 60 THR CA C 60 57.101 59.758 -2.657 1
1 636 . 17 1 1 A 60 60 THR CB C 60 67.982 71.638 -3.656 1
1 638 . 17 1 1 A 60 60 THR N N 60 109.256 109.439 -0.183 1
1 639 . 17 1 1 A 61 61 THR H H 61 7.325 8.351 -1.026 1
1 640 . 17 1 1 A 61 61 THR HA H 61 2.896 3.704 -0.808 1
1 645 . 17 1 1 A 61 61 THR C C 61 169.678 172.922 -3.244 1
1 646 . 17 1 1 A 61 61 THR CA C 61 57.246 61.565 -4.319 1
1 647 . 17 1 1 A 61 61 THR CB C 61 63.794 69.073 -5.279 1
1 649 . 17 1 1 A 61 61 THR N N 61 105.670 110.352 -4.682 1
1 650 . 17 1 1 A 62 62 ARG H H 62 6.490 7.176 -0.686 1
1 651 . 17 1 1 A 62 62 ARG HA H 62 4.698 4.764 -0.066 1
1 658 . 17 1 1 A 62 62 ARG C C 62 172.881 173.689 -0.808 1
1 659 . 17 1 1 A 62 62 ARG CA C 62 52.276 54.235 -1.959 1
1 660 . 17 1 1 A 62 62 ARG CB C 62 30.774 33.260 -2.486 1
1 663 . 17 1 1 A 62 62 ARG N N 62 117.485 122.079 -4.594 1
1 664 . 17 1 1 A 63 63 TYR H H 63 8.891 8.877 0.014 1
1 665 . 17 1 1 A 63 63 TYR HA H 63 4.356 5.328 -0.972 1
1 672 . 17 1 1 A 63 63 TYR C C 63 170.393 173.943 -3.550 1
1 673 . 17 1 1 A 63 63 TYR CA C 63 57.284 56.645 0.639 1
1 674 . 17 1 1 A 63 63 TYR CB C 63 41.467 42.815 -1.348 1
1 679 . 17 1 1 A 63 63 TYR N N 63 124.712 127.193 -2.481 1
1 680 . 17 1 1 A 64 64 SER H H 64 7.244 8.281 -1.037 1
1 681 . 17 1 1 A 64 64 SER HA H 64 5.077 5.611 -0.534 1
1 684 . 17 1 1 A 64 64 SER C C 64 169.712 173.513 -3.801 1
1 685 . 17 1 1 A 64 64 SER CA C 64 54.181 55.624 -1.443 1
1 686 . 17 1 1 A 64 64 SER CB C 64 61.122 65.877 -4.755 1
1 687 . 17 1 1 A 64 64 SER N N 64 120.593 119.250 1.343 1
1 688 . 17 1 1 A 65 65 ILE H H 65 8.686 8.879 -0.193 1
1 689 . 17 1 1 A 65 65 ILE HA H 65 3.937 4.912 -0.975 1
1 699 . 17 1 1 A 65 65 ILE C C 65 172.217 175.165 -2.948 1
1 700 . 17 1 1 A 65 65 ILE CA C 65 58.288 59.620 -1.332 1
1 701 . 17 1 1 A 65 65 ILE CB C 65 36.110 40.569 -4.459 1
1 705 . 17 1 1 A 65 65 ILE N N 65 127.792 124.338 3.454 1
1 706 . 17 1 1 A 66 66 GLY H H 66 7.883 8.565 -0.682 1
1 707 . 17 1 1 A 66 66 GLY HA2 H 66 4.799 4.171 0.628 1
1 708 . 17 1 1 A 66 66 GLY HA3 H 66 3.468 4.197 -0.729 1
1 709 . 17 1 1 A 66 66 GLY C C 66 171.983 174.109 -2.126 1
1 710 . 17 1 1 A 66 66 GLY CA C 66 40.534 44.497 -3.963 1
1 711 . 17 1 1 A 66 66 GLY N N 66 112.632 114.331 -1.699 1
1 712 . 17 1 1 A 67 67 GLY H H 67 8.483 8.216 0.267 1
1 713 . 17 1 1 A 67 67 GLY HA2 H 67 3.836 3.947 -0.111 1
1 714 . 17 1 1 A 67 67 GLY HA3 H 67 3.682 3.967 -0.285 1
1 715 . 17 1 1 A 67 67 GLY C C 67 172.954 174.400 -1.446 1
1 716 . 17 1 1 A 67 67 GLY CA C 67 43.568 45.951 -2.383 1
1 717 . 17 1 1 A 67 67 GLY N N 67 104.625 109.167 -4.542 1
1 718 . 17 1 1 A 68 68 LEU H H 68 8.236 7.939 0.297 1
1 719 . 17 1 1 A 68 68 LEU HA H 68 4.154 4.681 -0.527 1
1 729 . 17 1 1 A 68 68 LEU C C 68 173.838 175.816 -1.978 1
1 730 . 17 1 1 A 68 68 LEU CA C 68 51.025 53.427 -2.402 1
1 731 . 17 1 1 A 68 68 LEU CB C 68 38.837 42.832 -3.995 1
1 735 . 17 1 1 A 68 68 LEU N N 68 118.919 121.958 -3.039 1
1 736 . 17 1 1 A 69 69 SER H H 69 8.284 8.821 -0.537 1
1 737 . 17 1 1 A 69 69 SER HA H 69 4.765 5.119 -0.354 1
1 740 . 17 1 1 A 69 69 SER C C 69 170.044 172.654 -2.610 1
1 741 . 17 1 1 A 69 69 SER CA C 69 54.639 54.881 -0.242 1
1 742 . 17 1 1 A 69 69 SER CB C 69 61.216 64.223 -3.007 1
1 743 . 17 1 1 A 69 69 SER N N 69 116.361 116.778 -0.417 1
1 744 . 17 1 1 A 70 70 PRO HA H 70 5.141 4.553 0.588 1
1 751 . 17 1 1 A 70 70 PRO C C 70 174.858 177.471 -2.613 1
1 752 . 17 1 1 A 70 70 PRO CA C 70 60.810 64.005 -3.195 1
1 753 . 17 1 1 A 70 70 PRO CB C 70 30.657 31.854 -1.197 1
1 756 . 17 1 1 A 71 71 PHE H H 71 8.139 8.868 -0.729 1
1 757 . 17 1 1 A 71 71 PHE HA H 71 4.202 4.220 -0.018 1
1 765 . 17 1 1 A 71 71 PHE C C 71 172.870 174.350 -1.480 1
1 766 . 17 1 1 A 71 71 PHE CA C 71 55.410 59.044 -3.634 1
1 767 . 17 1 1 A 71 71 PHE CB C 71 36.027 37.668 -1.641 1
1 773 . 17 1 1 A 71 71 PHE N N 71 125.409 123.143 2.266 1
1 774 . 17 1 1 A 72 72 SER H H 72 8.182 7.275 0.907 1
1 775 . 17 1 1 A 72 72 SER HA H 72 4.755 5.071 -0.316 1
1 778 . 17 1 1 A 72 72 SER C C 72 168.850 172.564 -3.714 1
1 779 . 17 1 1 A 72 72 SER CA C 72 55.926 56.450 -0.524 1
1 780 . 17 1 1 A 72 72 SER CB C 72 64.208 67.018 -2.810 1
1 781 . 17 1 1 A 72 72 SER N N 72 113.509 110.403 3.106 1
1 782 . 17 1 1 A 73 73 GLU H H 73 8.422 8.798 -0.376 1
1 783 . 17 1 1 A 73 73 GLU HA H 73 4.966 5.143 -0.177 1
1 788 . 17 1 1 A 73 73 GLU C C 73 173.192 174.641 -1.449 1
1 789 . 17 1 1 A 73 73 GLU CA C 73 52.815 54.919 -2.104 1
1 790 . 17 1 1 A 73 73 GLU CB C 73 29.416 32.408 -2.992 1
1 792 . 17 1 1 A 73 73 GLU N N 73 123.046 123.226 -0.180 1
1 793 . 17 1 1 A 74 74 TYR H H 74 9.205 8.895 0.310 1
1 794 . 17 1 1 A 74 74 TYR HA H 74 4.799 5.086 -0.287 1
1 801 . 17 1 1 A 74 74 TYR C C 74 170.775 174.240 -3.465 1
1 802 . 17 1 1 A 74 74 TYR CA C 74 55.291 56.846 -1.555 1
1 803 . 17 1 1 A 74 74 TYR CB C 74 42.943 42.544 0.399 1
1 808 . 17 1 1 A 74 74 TYR N N 74 125.351 124.743 0.608 1
1 809 . 17 1 1 A 75 75 ALA H H 75 8.639 8.337 0.302 1
1 810 . 17 1 1 A 75 75 ALA HA H 75 5.271 5.283 -0.012 1
1 814 . 17 1 1 A 75 75 ALA C C 75 173.698 175.995 -2.297 1
1 815 . 17 1 1 A 75 75 ALA CA C 75 47.904 50.430 -2.526 1
1 816 . 17 1 1 A 75 75 ALA CB C 75 19.634 20.433 -0.799 1
1 817 . 17 1 1 A 75 75 ALA N N 75 121.555 124.673 -3.118 1
1 818 . 17 1 1 A 76 76 PHE H H 76 9.066 9.538 -0.472 1
1 819 . 17 1 1 A 76 76 PHE HA H 76 5.496 5.256 0.240 1
1 827 . 17 1 1 A 76 76 PHE C C 76 172.268 175.279 -3.011 1
1 828 . 17 1 1 A 76 76 PHE CA C 76 54.216 57.313 -3.097 1
1 829 . 17 1 1 A 76 76 PHE CB C 76 41.901 41.522 0.379 1
1 835 . 17 1 1 A 76 76 PHE N N 76 116.545 123.095 -6.550 1
1 836 . 17 1 1 A 77 77 ARG H H 77 9.216 9.112 0.104 1
1 837 . 17 1 1 A 77 77 ARG HA H 77 4.357 5.131 -0.774 1
1 845 . 17 1 1 A 77 77 ARG C C 77 169.998 174.157 -4.159 1
1 846 . 17 1 1 A 77 77 ARG CA C 77 52.414 54.824 -2.410 1
1 847 . 17 1 1 A 77 77 ARG CB C 77 30.794 33.915 -3.121 1
1 850 . 17 1 1 A 77 77 ARG N N 77 115.738 119.155 -3.417 1
1 852 . 17 1 1 A 78 78 VAL H H 78 8.135 8.726 -0.591 1
1 853 . 17 1 1 A 78 78 VAL HA H 78 4.884 4.480 0.404 1
1 861 . 17 1 1 A 78 78 VAL C C 78 171.098 175.062 -3.964 1
1 862 . 17 1 1 A 78 78 VAL CA C 78 57.566 61.208 -3.642 1
1 863 . 17 1 1 A 78 78 VAL CB C 78 33.146 32.235 0.911 1
1 866 . 17 1 1 A 78 78 VAL N N 78 117.942 124.786 -6.844 1
1 867 . 17 1 1 A 79 79 LEU H H 79 9.167 8.375 0.792 1
1 868 . 17 1 1 A 79 79 LEU HA H 79 4.575 4.918 -0.343 1
1 878 . 17 1 1 A 79 79 LEU C C 79 171.447 174.943 -3.496 1
1 879 . 17 1 1 A 79 79 LEU CA C 79 51.642 53.594 -1.952 1
1 880 . 17 1 1 A 79 79 LEU CB C 79 42.776 45.922 -3.146 1
1 884 . 17 1 1 A 79 79 LEU N N 79 123.913 119.883 4.030 1
1 885 . 17 1 1 A 80 80 ALA H H 80 9.325 8.524 0.801 1
1 886 . 17 1 1 A 80 80 ALA HA H 80 4.654 3.927 0.727 1
1 890 . 17 1 1 A 80 80 ALA C C 80 172.070 176.702 -4.632 1
1 891 . 17 1 1 A 80 80 ALA CA C 80 48.169 50.880 -2.711 1
1 892 . 17 1 1 A 80 80 ALA CB C 80 20.366 19.817 0.549 1
1 893 . 17 1 1 A 80 80 ALA N N 80 124.135 122.170 1.965 1
1 894 . 17 1 1 A 81 81 VAL H H 81 7.953 8.078 -0.125 1
1 895 . 17 1 1 A 81 81 VAL HA H 81 4.293 4.621 -0.328 1
1 903 . 17 1 1 A 81 81 VAL C C 81 172.873 174.294 -1.421 1
1 904 . 17 1 1 A 81 81 VAL CA C 81 58.959 60.480 -1.521 1
1 905 . 17 1 1 A 81 81 VAL CB C 81 31.412 34.883 -3.471 1
1 908 . 17 1 1 A 81 81 VAL N N 81 118.503 120.885 -2.382 1
1 909 . 17 1 1 A 82 82 ASN H H 82 8.262 8.272 -0.010 1
1 910 . 17 1 1 A 82 82 ASN HA H 82 4.945 5.280 -0.335 1
1 915 . 17 1 1 A 82 82 ASN C C 82 173.273 175.482 -2.209 1
1 916 . 17 1 1 A 82 82 ASN CA C 82 48.714 51.683 -2.969 1
1 917 . 17 1 1 A 82 82 ASN CB C 82 36.796 40.190 -3.394 1
1 918 . 17 1 1 A 82 82 ASN N N 82 125.425 123.855 1.570 1
1 920 . 17 1 1 A 83 83 SER HA H 83 3.966 4.156 -0.190 1
1 923 . 17 1 1 A 83 83 SER C C 83 172.812 176.782 -3.970 1
1 924 . 17 1 1 A 83 83 SER CA C 83 59.047 61.904 -2.857 1
1 925 . 17 1 1 A 83 83 SER CB C 83 60.406 63.010 -2.604 1
1 926 . 17 1 1 A 84 84 ILE H H 84 7.803 8.010 -0.207 1
1 927 . 17 1 1 A 84 84 ILE HA H 84 3.862 3.857 0.005 1
1 937 . 17 1 1 A 84 84 ILE C C 84 174.481 176.154 -1.673 1
1 938 . 17 1 1 A 84 84 ILE CA C 84 59.188 63.535 -4.347 1
1 939 . 17 1 1 A 84 84 ILE CB C 84 34.677 38.577 -3.900 1
1 943 . 17 1 1 A 84 84 ILE N N 84 121.222 118.932 2.290 1
1 944 . 17 1 1 A 85 85 GLY H H 85 7.435 7.566 -0.131 1
1 945 . 17 1 1 A 85 85 GLY HA2 H 85 4.149 4.039 0.110 1
1 946 . 17 1 1 A 85 85 GLY HA3 H 85 3.747 4.047 -0.300 1
1 947 . 17 1 1 A 85 85 GLY C C 85 168.589 171.723 -3.134 1
1 948 . 17 1 1 A 85 85 GLY CA C 85 42.931 45.207 -2.276 1
1 949 . 17 1 1 A 85 85 GLY N N 85 106.320 106.152 0.168 1
1 950 . 17 1 1 A 86 86 ARG H H 86 8.190 8.327 -0.137 1
1 951 . 17 1 1 A 86 86 ARG HA H 86 4.452 4.438 0.014 1
1 958 . 17 1 1 A 86 86 ARG C C 86 175.286 176.839 -1.553 1
1 959 . 17 1 1 A 86 86 ARG CA C 86 53.223 55.038 -1.815 1
1 960 . 17 1 1 A 86 86 ARG CB C 86 29.517 31.092 -1.575 1
1 963 . 17 1 1 A 86 86 ARG N N 86 118.339 119.696 -1.357 1
1 964 . 17 1 1 A 87 87 GLY H H 87 8.900 8.630 0.270 1
1 965 . 17 1 1 A 87 87 GLY HA2 H 87 4.211 4.014 0.197 1
1 966 . 17 1 1 A 87 87 GLY HA3 H 87 3.967 4.028 -0.061 1
1 967 . 17 1 1 A 87 87 GLY C C 87 168.101 172.809 -4.708 1
1 968 . 17 1 1 A 87 87 GLY CA C 87 42.281 44.062 -1.781 1
1 969 . 17 1 1 A 87 87 GLY N N 87 113.482 111.410 2.072 1
1 970 . 17 1 1 A 88 88 PRO HA H 88 4.563 4.568 -0.005 1
1 977 . 17 1 1 A 88 88 PRO CA C 88 60.994 62.109 -1.115 1
1 978 . 17 1 1 A 88 88 PRO CB C 88 29.873 31.590 -1.717 1
1 981 . 17 1 1 A 89 89 PRO HA H 89 4.490 4.451 0.039 1
1 987 . 17 1 1 A 89 89 PRO C C 89 174.543 176.080 -1.537 1
1 988 . 17 1 1 A 89 89 PRO CA C 89 59.435 62.270 -2.835 1
1 989 . 17 1 1 A 89 89 PRO CB C 89 29.805 32.180 -2.375 1
1 992 . 17 1 1 A 90 90 SER H H 90 8.808 8.247 0.561 1
1 993 . 17 1 1 A 90 90 SER HA H 90 4.202 4.627 -0.425 1
1 996 . 17 1 1 A 90 90 SER C C 90 171.870 173.926 -2.056 1
1 997 . 17 1 1 A 90 90 SER CA C 90 55.868 57.540 -1.672 1
1 998 . 17 1 1 A 90 90 SER CB C 90 64.504 64.644 -0.140 1
1 999 . 17 1 1 A 90 90 SER N N 90 113.781 116.390 -2.609 1
1 1000 . 17 1 1 A 91 91 GLU H H 91 8.291 8.547 -0.256 1
1 1001 . 17 1 1 A 91 91 GLU HA H 91 4.131 4.174 -0.043 1
1 1006 . 17 1 1 A 91 91 GLU C C 91 174.882 176.426 -1.544 1
1 1007 . 17 1 1 A 91 91 GLU CA C 91 54.984 56.848 -1.864 1
1 1008 . 17 1 1 A 91 91 GLU CB C 91 27.643 29.293 -1.650 1
1 1010 . 17 1 1 A 91 91 GLU N N 91 117.930 123.516 -5.586 1
1 1011 . 17 1 1 A 92 92 ALA H H 92 8.605 8.286 0.319 1
1 1012 . 17 1 1 A 92 92 ALA HA H 92 5.068 4.400 0.668 1
1 1016 . 17 1 1 A 92 92 ALA C C 92 176.227 177.813 -1.586 1
1 1017 . 17 1 1 A 92 92 ALA CA C 92 48.997 53.034 -4.037 1
1 1018 . 17 1 1 A 92 92 ALA CB C 92 17.756 19.074 -1.318 1
1 1019 . 17 1 1 A 92 92 ALA N N 92 126.421 127.286 -0.865 1
1 1020 . 17 1 1 A 93 93 VAL H H 93 9.051 9.382 -0.331 1
1 1021 . 17 1 1 A 93 93 VAL HA H 93 4.642 4.975 -0.333 1
1 1029 . 17 1 1 A 93 93 VAL C C 93 172.010 174.619 -2.609 1
1 1030 . 17 1 1 A 93 93 VAL CA C 93 57.495 59.923 -2.428 1
1 1031 . 17 1 1 A 93 93 VAL CB C 93 32.774 34.553 -1.779 1
1 1034 . 17 1 1 A 93 93 VAL N N 93 117.322 117.874 -0.552 1
1 1035 . 17 1 1 A 94 94 ARG H H 94 8.470 9.013 -0.543 1
1 1036 . 17 1 1 A 94 94 ARG HA H 94 5.692 5.309 0.383 1
1 1043 . 17 1 1 A 94 94 ARG C C 94 173.635 175.444 -1.809 1
1 1044 . 17 1 1 A 94 94 ARG CA C 94 52.038 55.227 -3.189 1
1 1045 . 17 1 1 A 94 94 ARG CB C 94 30.966 31.428 -0.462 1
1 1048 . 17 1 1 A 94 94 ARG N N 94 122.258 125.269 -3.011 1
1 1049 . 17 1 1 A 95 95 ALA H H 95 9.051 9.317 -0.266 1
1 1050 . 17 1 1 A 95 95 ALA HA H 95 4.642 5.262 -0.620 1
1 1054 . 17 1 1 A 95 95 ALA C C 95 172.285 175.234 -2.949 1
1 1055 . 17 1 1 A 95 95 ALA CA C 95 49.191 50.682 -1.491 1
1 1056 . 17 1 1 A 95 95 ALA CB C 95 22.562 22.123 0.439 1
1 1057 . 17 1 1 A 95 95 ALA N N 95 121.931 127.209 -5.278 1
1 1058 . 17 1 1 A 96 96 ARG H H 96 8.550 8.782 -0.232 1
1 1059 . 17 1 1 A 96 96 ARG HA H 96 5.407 5.175 0.232 1
1 1066 . 17 1 1 A 96 96 ARG C C 96 174.547 175.994 -1.447 1
1 1067 . 17 1 1 A 96 96 ARG CA C 96 51.439 55.046 -3.607 1
1 1068 . 17 1 1 A 96 96 ARG CB C 96 30.708 31.715 -1.007 1
1 1071 . 17 1 1 A 96 96 ARG N N 96 121.155 124.770 -3.615 1
1 1072 . 17 1 1 A 97 97 THR H H 97 8.797 8.771 0.026 1
1 1073 . 17 1 1 A 97 97 THR HA H 97 4.116 4.557 -0.441 1
1 1078 . 17 1 1 A 97 97 THR C C 97 173.577 174.966 -1.389 1
1 1079 . 17 1 1 A 97 97 THR CA C 97 58.800 61.233 -2.433 1
1 1080 . 17 1 1 A 97 97 THR CB C 97 67.461 69.613 -2.152 1
1 1082 . 17 1 1 A 97 97 THR N N 97 114.657 117.193 -2.536 1
1 1083 . 17 1 1 A 98 98 GLY H H 98 7.505 8.460 -0.955 1
1 1084 . 17 1 1 A 98 98 GLY HA2 H 98 3.866 4.122 -0.256 1
1 1085 . 17 1 1 A 98 98 GLY HA3 H 98 3.743 4.155 -0.412 1
1 1086 . 17 1 1 A 98 98 GLY C C 98 170.637 172.803 -2.166 1
1 1087 . 17 1 1 A 98 98 GLY CA C 98 42.332 44.481 -2.149 1
1 1088 . 17 1 1 A 98 98 GLY N N 98 106.172 107.814 -1.642 1
1 1089 . 17 1 1 A 99 99 GLU H H 99 8.145 8.788 -0.643 1
1 1090 . 17 1 1 A 99 99 GLU HA H 99 4.210 5.301 -1.091 1
1 1095 . 17 1 1 A 99 99 GLU C C 99 174.134 174.976 -0.842 1
1 1096 . 17 1 1 A 99 99 GLU CA C 99 53.828 55.175 -1.347 1
1 1097 . 17 1 1 A 99 99 GLU CB C 99 28.774 32.826 -4.052 1
1 1099 . 17 1 1 A 99 99 GLU N N 99 117.634 117.090 0.544 1
1 1100 . 17 1 1 A 100 100 GLN H H 100 8.647 8.831 -0.184 1
1 1101 . 17 1 1 A 100 100 GLN HA H 100 4.247 4.460 -0.213 1
1 1108 . 17 1 1 A 100 100 GLN C C 100 173.348 174.999 -1.651 1
1 1109 . 17 1 1 A 100 100 GLN CA C 100 53.634 55.781 -2.147 1
1 1110 . 17 1 1 A 100 100 GLN CB C 100 27.392 31.767 -4.375 1
1 1112 . 17 1 1 A 100 100 GLN N N 100 121.960 121.180 0.780 1
1 1114 . 17 1 1 A 101 101 SER H H 101 8.416 9.199 -0.783 1
1 1115 . 17 1 1 A 101 101 SER HA H 101 4.418 4.099 0.319 1
1 1117 . 17 1 1 A 101 101 SER C C 101 172.148 173.539 -1.391 1
1 1118 . 17 1 1 A 101 101 SER CA C 101 55.926 59.230 -3.304 1
1 1119 . 17 1 1 A 101 101 SER CB C 101 61.617 62.210 -0.593 1
1 1120 . 17 1 1 A 101 101 SER N N 101 118.609 121.369 -2.760 1
1 1121 . 17 1 1 A 102 102 GLY H H 102 8.233 7.888 0.345 1
1 1122 . 17 1 1 A 102 102 GLY HA2 H 102 4.080 4.130 -0.050 1
1 1123 . 17 1 1 A 102 102 GLY HA3 H 102 3.981 4.135 -0.154 1
1 1124 . 17 1 1 A 102 102 GLY C C 102 169.461 171.922 -2.461 1
1 1125 . 17 1 1 A 102 102 GLY CA C 102 42.332 45.976 -3.644 1
1 1126 . 17 1 1 A 102 102 GLY N N 102 110.483 107.063 3.420 1
1 1127 . 17 1 1 A 103 103 PRO HA H 103 4.618 4.580 0.038 1
1 1134 . 17 1 1 A 103 103 PRO CA C 103 57.843 62.622 -4.779 1
1 1135 . 17 1 1 A 103 103 PRO CB C 103 28.671 32.898 -4.227 1
1 1 . 18 1 1 A 6 6 SER HA H 6 4.492 5.099 -0.607 1
1 4 . 18 1 1 A 6 6 SER CA C 6 55.621 56.749 -1.128 1
1 5 . 18 1 1 A 6 6 SER CB C 6 62.104 64.225 -2.121 1
1 6 . 18 1 1 A 7 7 GLY H H 7 8.244 8.713 -0.469 1
1 7 . 18 1 1 A 7 7 GLY HA2 H 7 3.873 4.064 -0.191 1
1 8 . 18 1 1 A 7 7 GLY HA3 H 7 3.737 4.074 -0.337 1
1 9 . 18 1 1 A 7 7 GLY CA C 7 41.743 44.410 -2.667 1
1 10 . 18 1 1 A 7 7 GLY N N 7 109.193 113.081 -3.888 1
1 11 . 18 1 1 A 8 8 PRO HA H 8 4.286 4.543 -0.257 1
1 18 . 18 1 1 A 8 8 PRO C C 8 173.841 175.630 -1.789 1
1 19 . 18 1 1 A 8 8 PRO CA C 8 60.528 62.564 -2.036 1
1 20 . 18 1 1 A 8 8 PRO CB C 8 30.299 32.859 -2.560 1
1 23 . 18 1 1 A 9 9 LYS H H 9 8.877 8.368 0.509 1
1 24 . 18 1 1 A 9 9 LYS HA H 9 4.360 4.821 -0.461 1
1 33 . 18 1 1 A 9 9 LYS C C 9 173.492 174.390 -0.898 1
1 34 . 18 1 1 A 9 9 LYS CA C 9 52.135 53.195 -1.060 1
1 35 . 18 1 1 A 9 9 LYS CB C 9 28.798 32.622 -3.824 1
1 39 . 18 1 1 A 9 9 LYS N N 9 120.404 120.729 -0.325 1
1 40 . 18 1 1 A 10 10 PRO HA H 10 4.284 4.617 -0.333 1
1 47 . 18 1 1 A 10 10 PRO CA C 10 59.326 61.587 -2.261 1
1 48 . 18 1 1 A 10 10 PRO CB C 10 28.825 31.572 -2.747 1
1 51 . 18 1 1 A 11 11 PRO HA H 11 4.468 4.780 -0.312 1
1 58 . 18 1 1 A 11 11 PRO C C 11 171.993 176.352 -4.359 1
1 59 . 18 1 1 A 11 11 PRO CA C 11 60.422 62.552 -2.130 1
1 60 . 18 1 1 A 11 11 PRO CB C 11 30.418 32.733 -2.315 1
1 63 . 18 1 1 A 12 12 ILE H H 12 7.554 8.095 -0.541 1
1 64 . 18 1 1 A 12 12 ILE HA H 12 4.676 4.668 0.008 1
1 74 . 18 1 1 A 12 12 ILE C C 12 171.721 175.041 -3.320 1
1 75 . 18 1 1 A 12 12 ILE CA C 12 56.843 58.748 -1.905 1
1 76 . 18 1 1 A 12 12 ILE CB C 12 40.560 41.067 -0.507 1
1 80 . 18 1 1 A 12 12 ILE N N 12 109.695 116.499 -6.804 1
1 81 . 18 1 1 A 13 13 ASP H H 13 8.435 9.066 -0.631 1
1 82 . 18 1 1 A 13 13 ASP HA H 13 4.094 4.239 -0.145 1
1 85 . 18 1 1 A 13 13 ASP C C 13 171.803 176.181 -4.378 1
1 86 . 18 1 1 A 13 13 ASP CA C 13 52.610 54.890 -2.280 1
1 87 . 18 1 1 A 13 13 ASP CB C 13 36.357 39.690 -3.333 1
1 88 . 18 1 1 A 13 13 ASP N N 13 116.219 122.047 -5.828 1
1 89 . 18 1 1 A 14 14 LEU H H 14 7.483 7.949 -0.466 1
1 90 . 18 1 1 A 14 14 LEU HA H 14 4.990 5.177 -0.187 1
1 100 . 18 1 1 A 14 14 LEU C C 14 174.702 175.410 -0.708 1
1 101 . 18 1 1 A 14 14 LEU CA C 14 53.811 54.918 -1.107 1
1 102 . 18 1 1 A 14 14 LEU CB C 14 40.148 42.385 -2.237 1
1 106 . 18 1 1 A 14 14 LEU N N 14 118.463 120.948 -2.485 1
1 107 . 18 1 1 A 15 15 VAL H H 15 9.209 8.556 0.653 1
1 108 . 18 1 1 A 15 15 VAL HA H 15 4.250 4.705 -0.455 1
1 116 . 18 1 1 A 15 15 VAL C C 15 172.080 174.295 -2.215 1
1 117 . 18 1 1 A 15 15 VAL CA C 15 58.570 60.598 -2.028 1
1 118 . 18 1 1 A 15 15 VAL CB C 15 34.146 36.086 -1.940 1
1 121 . 18 1 1 A 15 15 VAL N N 15 124.833 127.379 -2.546 1
1 122 . 18 1 1 A 16 16 VAL H H 16 8.390 9.000 -0.610 1
1 123 . 18 1 1 A 16 16 VAL HA H 16 4.343 4.398 -0.055 1
1 131 . 18 1 1 A 16 16 VAL C C 16 174.672 175.830 -1.158 1
1 132 . 18 1 1 A 16 16 VAL CA C 16 59.188 62.056 -2.868 1
1 133 . 18 1 1 A 16 16 VAL CB C 16 29.187 32.492 -3.305 1
1 136 . 18 1 1 A 16 16 VAL N N 16 124.654 126.131 -1.477 1
1 137 . 18 1 1 A 17 17 THR H H 17 8.638 8.423 0.215 1
1 138 . 18 1 1 A 17 17 THR HA H 17 4.195 4.440 -0.245 1
1 143 . 18 1 1 A 17 17 THR C C 17 172.661 173.519 -0.858 1
1 144 . 18 1 1 A 17 17 THR CA C 17 60.318 63.030 -2.712 1
1 145 . 18 1 1 A 17 17 THR CB C 17 66.420 70.563 -4.143 1
1 147 . 18 1 1 A 17 17 THR N N 17 120.942 121.539 -0.597 1
1 148 . 18 1 1 A 18 18 GLU H H 18 7.361 7.604 -0.243 1
1 149 . 18 1 1 A 18 18 GLU HA H 18 4.497 4.715 -0.218 1
1 154 . 18 1 1 A 18 18 GLU C C 18 171.691 174.906 -3.215 1
1 155 . 18 1 1 A 18 18 GLU CA C 18 53.687 55.192 -1.505 1
1 156 . 18 1 1 A 18 18 GLU CB C 18 30.802 33.945 -3.143 1
1 158 . 18 1 1 A 18 18 GLU N N 18 119.088 118.821 0.267 1
1 159 . 18 1 1 A 19 19 THR H H 19 8.164 8.615 -0.451 1
1 160 . 18 1 1 A 19 19 THR HA H 19 4.912 5.081 -0.169 1
1 165 . 18 1 1 A 19 19 THR C C 19 171.606 172.907 -1.301 1
1 166 . 18 1 1 A 19 19 THR CA C 19 58.473 60.693 -2.220 1
1 167 . 18 1 1 A 19 19 THR CB C 19 70.103 71.181 -1.078 1
1 169 . 18 1 1 A 19 19 THR N N 19 112.424 114.190 -1.766 1
1 170 . 18 1 1 A 20 20 THR H H 20 8.750 8.979 -0.229 1
1 171 . 18 1 1 A 20 20 THR HA H 20 4.710 4.815 -0.105 1
1 176 . 18 1 1 A 20 20 THR C C 20 172.785 175.802 -3.017 1
1 177 . 18 1 1 A 20 20 THR CA C 20 58.059 61.067 -3.008 1
1 178 . 18 1 1 A 20 20 THR CB C 20 68.782 71.261 -2.479 1
1 180 . 18 1 1 A 20 20 THR N N 20 113.438 120.548 -7.110 1
1 181 . 18 1 1 A 21 21 ALA H H 21 8.453 8.976 -0.523 1
1 182 . 18 1 1 A 21 21 ALA HA H 21 4.079 4.352 -0.273 1
1 186 . 18 1 1 A 21 21 ALA C C 21 174.130 177.873 -3.743 1
1 187 . 18 1 1 A 21 21 ALA CA C 21 52.680 54.967 -2.287 1
1 188 . 18 1 1 A 21 21 ALA CB C 21 16.893 18.520 -1.627 1
1 189 . 18 1 1 A 21 21 ALA N N 21 120.078 125.263 -5.185 1
1 190 . 18 1 1 A 22 22 THR H H 22 7.132 7.546 -0.414 1
1 191 . 18 1 1 A 22 22 THR HA H 22 4.433 4.704 -0.271 1
1 196 . 18 1 1 A 22 22 THR C C 22 171.434 173.487 -2.053 1
1 197 . 18 1 1 A 22 22 THR CA C 22 56.836 60.477 -3.641 1
1 198 . 18 1 1 A 22 22 THR CB C 22 68.772 69.262 -0.490 1
1 200 . 18 1 1 A 22 22 THR N N 22 95.772 104.122 -8.350 1
1 201 . 18 1 1 A 23 23 SER H H 23 7.326 7.706 -0.380 1
1 202 . 18 1 1 A 23 23 SER HA H 23 5.562 5.029 0.533 1
1 205 . 18 1 1 A 23 23 SER C C 23 169.267 172.389 -3.122 1
1 206 . 18 1 1 A 23 23 SER CA C 23 54.445 57.715 -3.270 1
1 207 . 18 1 1 A 23 23 SER CB C 23 65.905 66.672 -0.767 1
1 208 . 18 1 1 A 23 23 SER N N 23 115.757 115.808 -0.051 1
1 209 . 18 1 1 A 24 24 VAL H H 24 7.983 8.637 -0.654 1
1 210 . 18 1 1 A 24 24 VAL HA H 24 4.334 4.547 -0.213 1
1 218 . 18 1 1 A 24 24 VAL C C 24 171.917 174.475 -2.558 1
1 219 . 18 1 1 A 24 24 VAL CA C 24 58.642 60.230 -1.588 1
1 220 . 18 1 1 A 24 24 VAL CB C 24 34.254 35.591 -1.337 1
1 223 . 18 1 1 A 24 24 VAL N N 24 116.595 120.964 -4.369 1
1 224 . 18 1 1 A 25 25 THR H H 25 8.636 8.898 -0.262 1
1 225 . 18 1 1 A 25 25 THR HA H 25 4.833 4.956 -0.123 1
1 230 . 18 1 1 A 25 25 THR C C 25 169.721 172.861 -3.140 1
1 231 . 18 1 1 A 25 25 THR CA C 25 59.699 61.625 -1.926 1
1 232 . 18 1 1 A 25 25 THR CB C 25 67.303 70.299 -2.996 1
1 234 . 18 1 1 A 25 25 THR N N 25 121.690 119.604 2.086 1
1 235 . 18 1 1 A 26 26 LEU H H 26 8.629 9.314 -0.685 1
1 236 . 18 1 1 A 26 26 LEU HA H 26 5.315 5.317 -0.002 1
1 246 . 18 1 1 A 26 26 LEU C C 26 173.182 175.390 -2.208 1
1 247 . 18 1 1 A 26 26 LEU CA C 26 50.643 53.115 -2.472 1
1 248 . 18 1 1 A 26 26 LEU CB C 26 43.976 45.386 -1.410 1
1 252 . 18 1 1 A 26 26 LEU N N 26 126.843 130.324 -3.481 1
1 253 . 18 1 1 A 27 27 THR H H 27 8.704 8.923 -0.219 1
1 254 . 18 1 1 A 27 27 THR HA H 27 4.822 5.263 -0.441 1
1 259 . 18 1 1 A 27 27 THR C C 27 169.840 173.423 -3.583 1
1 260 . 18 1 1 A 27 27 THR CA C 27 58.077 59.186 -1.109 1
1 261 . 18 1 1 A 27 27 THR CB C 27 69.666 72.049 -2.383 1
1 263 . 18 1 1 A 27 27 THR N N 27 111.513 116.360 -4.847 1
1 264 . 18 1 1 A 28 28 TRP H H 28 7.339 8.361 -1.022 1
1 265 . 18 1 1 A 28 28 TRP HA H 28 4.963 5.506 -0.543 1
1 274 . 18 1 1 A 28 28 TRP C C 28 170.637 172.406 -1.769 1
1 275 . 18 1 1 A 28 28 TRP CA C 28 54.438 55.664 -1.226 1
1 276 . 18 1 1 A 28 28 TRP CB C 28 27.497 31.331 -3.834 1
1 282 . 18 1 1 A 28 28 TRP N N 28 117.895 119.078 -1.183 1
1 284 . 18 1 1 A 29 29 ASP H H 29 8.696 8.943 -0.247 1
1 285 . 18 1 1 A 29 29 ASP HA H 29 4.971 5.190 -0.219 1
1 288 . 18 1 1 A 29 29 ASP C C 29 174.901 177.579 -2.678 1
1 289 . 18 1 1 A 29 29 ASP CA C 29 50.178 52.628 -2.450 1
1 290 . 18 1 1 A 29 29 ASP CB C 29 42.291 43.763 -1.472 1
1 291 . 18 1 1 A 29 29 ASP N N 29 117.477 121.241 -3.764 1
1 292 . 18 1 1 A 30 30 SER H H 30 8.800 8.947 -0.147 1
1 293 . 18 1 1 A 30 30 SER HA H 30 4.389 4.213 0.176 1
1 296 . 18 1 1 A 30 30 SER C C 30 174.032 175.783 -1.751 1
1 297 . 18 1 1 A 30 30 SER CA C 30 58.694 60.786 -2.092 1
1 298 . 18 1 1 A 30 30 SER CB C 30 62.428 63.378 -0.950 1
1 299 . 18 1 1 A 30 30 SER N N 30 118.275 120.413 -2.138 1
1 300 . 18 1 1 A 31 31 GLY H H 31 8.759 7.978 0.781 1
1 301 . 18 1 1 A 31 31 GLY HA2 H 31 4.239 4.012 0.227 1
1 302 . 18 1 1 A 31 31 GLY HA3 H 31 3.555 4.036 -0.481 1
1 303 . 18 1 1 A 31 31 GLY C C 31 171.325 174.203 -2.878 1
1 304 . 18 1 1 A 31 31 GLY CA C 31 43.637 45.661 -2.024 1
1 305 . 18 1 1 A 31 31 GLY N N 31 107.961 111.123 -3.162 1
1 306 . 18 1 1 A 32 32 ASN H H 32 8.173 8.310 -0.137 1
1 307 . 18 1 1 A 32 32 ASN HA H 32 4.749 4.962 -0.213 1
1 312 . 18 1 1 A 32 32 ASN C C 32 171.355 175.453 -4.098 1
1 313 . 18 1 1 A 32 32 ASN CA C 32 50.795 52.406 -1.611 1
1 314 . 18 1 1 A 32 32 ASN CB C 32 41.508 39.744 1.764 1
1 315 . 18 1 1 A 32 32 ASN N N 32 117.781 118.317 -0.536 1
1 317 . 18 1 1 A 33 33 SER HA H 33 4.291 4.456 -0.165 1
1 320 . 18 1 1 A 33 33 SER C C 33 172.449 174.414 -1.965 1
1 321 . 18 1 1 A 33 33 SER CA C 33 56.733 59.481 -2.748 1
1 322 . 18 1 1 A 33 33 SER CB C 33 60.884 64.235 -3.351 1
1 323 . 18 1 1 A 34 34 GLU H H 34 7.731 7.603 0.128 1
1 324 . 18 1 1 A 34 34 GLU HA H 34 4.556 4.517 0.039 1
1 329 . 18 1 1 A 34 34 GLU C C 34 171.792 174.938 -3.146 1
1 330 . 18 1 1 A 34 34 GLU CA C 34 51.818 54.979 -3.161 1
1 331 . 18 1 1 A 34 34 GLU CB C 34 26.891 29.038 -2.147 1
1 333 . 18 1 1 A 34 34 GLU N N 34 122.319 121.224 1.095 1
1 334 . 18 1 1 A 35 35 PRO HA H 35 4.165 4.758 -0.593 1
1 341 . 18 1 1 A 35 35 PRO C C 35 174.288 176.522 -2.234 1
1 342 . 18 1 1 A 35 35 PRO CA C 35 61.374 62.377 -1.003 1
1 343 . 18 1 1 A 35 35 PRO CB C 35 29.887 29.872 0.015 1
1 346 . 18 1 1 A 36 36 VAL H H 36 8.348 8.249 0.099 1
1 347 . 18 1 1 A 36 36 VAL HA H 36 3.899 4.066 -0.167 1
1 355 . 18 1 1 A 36 36 VAL C C 36 173.344 176.256 -2.912 1
1 356 . 18 1 1 A 36 36 VAL CA C 36 59.014 62.536 -3.522 1
1 357 . 18 1 1 A 36 36 VAL CB C 36 31.865 31.456 0.409 1
1 360 . 18 1 1 A 36 36 VAL N N 36 122.051 123.756 -1.705 1
1 361 . 18 1 1 A 37 37 THR H H 37 8.780 8.502 0.278 1
1 362 . 18 1 1 A 37 37 THR HA H 37 3.923 4.234 -0.311 1
1 367 . 18 1 1 A 37 37 THR C C 37 172.171 174.528 -2.357 1
1 368 . 18 1 1 A 37 37 THR CA C 37 63.155 64.483 -1.328 1
1 369 . 18 1 1 A 37 37 THR CB C 37 65.941 69.295 -3.354 1
1 371 . 18 1 1 A 37 37 THR N N 37 122.351 120.662 1.689 1
1 372 . 18 1 1 A 38 38 TYR H H 38 7.304 7.396 -0.092 1
1 373 . 18 1 1 A 38 38 TYR HA H 38 4.439 5.167 -0.728 1
1 380 . 18 1 1 A 38 38 TYR C C 38 168.385 172.755 -4.370 1
1 381 . 18 1 1 A 38 38 TYR CA C 38 54.101 56.182 -2.081 1
1 382 . 18 1 1 A 38 38 TYR CB C 38 35.874 40.494 -4.620 1
1 387 . 18 1 1 A 38 38 TYR N N 38 113.984 115.372 -1.388 1
1 388 . 18 1 1 A 39 39 TYR H H 39 9.445 8.723 0.722 1
1 389 . 18 1 1 A 39 39 TYR HA H 39 5.293 5.246 0.047 1
1 396 . 18 1 1 A 39 39 TYR C C 39 172.781 175.842 -3.061 1
1 397 . 18 1 1 A 39 39 TYR CA C 39 54.322 55.517 -1.195 1
1 398 . 18 1 1 A 39 39 TYR CB C 39 39.035 40.510 -1.475 1
1 401 . 18 1 1 A 39 39 TYR N N 39 115.092 117.579 -2.487 1
1 402 . 18 1 1 A 40 40 GLY H H 40 8.870 8.153 0.717 1
1 403 . 18 1 1 A 40 40 GLY HA2 H 40 5.137 4.095 1.042 1
1 404 . 18 1 1 A 40 40 GLY HA3 H 40 3.285 4.189 -0.904 1
1 405 . 18 1 1 A 40 40 GLY C C 40 169.688 173.026 -3.338 1
1 406 . 18 1 1 A 40 40 GLY CA C 40 41.415 44.699 -3.284 1
1 407 . 18 1 1 A 40 40 GLY N N 40 106.573 111.329 -4.756 1
1 408 . 18 1 1 A 41 41 ILE H H 41 8.917 8.516 0.401 1
1 409 . 18 1 1 A 41 41 ILE HA H 41 4.527 4.770 -0.243 1
1 419 . 18 1 1 A 41 41 ILE C C 41 172.692 174.488 -1.796 1
1 420 . 18 1 1 A 41 41 ILE CA C 41 57.597 60.179 -2.582 1
1 421 . 18 1 1 A 41 41 ILE CB C 41 37.840 41.870 -4.030 1
1 425 . 18 1 1 A 41 41 ILE N N 41 121.746 120.709 1.037 1
1 426 . 18 1 1 A 42 42 GLN H H 42 9.063 9.023 0.040 1
1 427 . 18 1 1 A 42 42 GLN HA H 42 5.655 5.364 0.291 1
1 434 . 18 1 1 A 42 42 GLN C C 42 172.841 174.612 -1.771 1
1 435 . 18 1 1 A 42 42 GLN CA C 42 50.789 54.343 -3.554 1
1 436 . 18 1 1 A 42 42 GLN CB C 42 28.898 32.034 -3.136 1
1 438 . 18 1 1 A 42 42 GLN N N 42 125.141 125.713 -0.572 1
1 440 . 18 1 1 A 43 43 TYR H H 43 9.066 8.983 0.083 1
1 441 . 18 1 1 A 43 43 TYR HA H 43 5.922 5.747 0.175 1
1 448 . 18 1 1 A 43 43 TYR C C 43 171.219 173.624 -2.405 1
1 449 . 18 1 1 A 43 43 TYR CA C 43 53.349 56.289 -2.940 1
1 450 . 18 1 1 A 43 43 TYR CB C 43 41.074 41.798 -0.724 1
1 455 . 18 1 1 A 43 43 TYR N N 43 118.018 119.698 -1.680 1
1 456 . 18 1 1 A 44 44 ARG H H 44 8.400 8.114 0.286 1
1 457 . 18 1 1 A 44 44 ARG HA H 44 4.542 4.410 0.132 1
1 464 . 18 1 1 A 44 44 ARG C C 44 171.974 173.564 -1.590 1
1 465 . 18 1 1 A 44 44 ARG CA C 44 52.453 55.114 -2.661 1
1 466 . 18 1 1 A 44 44 ARG CB C 44 31.125 34.103 -2.978 1
1 469 . 18 1 1 A 44 44 ARG N N 44 115.214 119.948 -4.734 1
1 470 . 18 1 1 A 45 45 ALA H H 45 8.846 7.844 1.002 1
1 471 . 18 1 1 A 45 45 ALA HA H 45 3.894 2.951 0.943 1
1 475 . 18 1 1 A 45 45 ALA C C 45 175.721 178.418 -2.697 1
1 476 . 18 1 1 A 45 45 ALA CA C 45 50.372 52.223 -1.851 1
1 477 . 18 1 1 A 45 45 ALA CB C 45 15.732 19.443 -3.711 1
1 478 . 18 1 1 A 45 45 ALA N N 45 126.463 126.751 -0.288 1
1 479 . 18 1 1 A 46 46 ALA H H 46 8.282 8.405 -0.123 1
1 480 . 18 1 1 A 46 46 ALA HA H 46 3.922 3.731 0.191 1
1 484 . 18 1 1 A 46 46 ALA C C 46 176.236 178.953 -2.717 1
1 485 . 18 1 1 A 46 46 ALA CA C 46 50.773 55.359 -4.586 1
1 486 . 18 1 1 A 46 46 ALA CB C 46 16.244 18.561 -2.317 1
1 487 . 18 1 1 A 46 46 ALA N N 46 126.301 126.874 -0.573 1
1 488 . 18 1 1 A 47 47 GLY HA2 H 47 3.882 3.845 0.037 1
1 489 . 18 1 1 A 47 47 GLY HA3 H 47 3.695 3.859 -0.164 1
1 490 . 18 1 1 A 47 47 GLY C C 47 171.795 173.055 -1.260 1
1 491 . 18 1 1 A 47 47 GLY CA C 47 43.327 46.916 -3.589 1
1 492 . 18 1 1 A 48 48 THR H H 48 7.145 8.158 -1.013 1
1 493 . 18 1 1 A 48 48 THR HA H 48 4.417 4.607 -0.190 1
1 498 . 18 1 1 A 48 48 THR C C 48 171.325 174.600 -3.275 1
1 499 . 18 1 1 A 48 48 THR CA C 48 58.271 59.539 -1.268 1
1 500 . 18 1 1 A 48 48 THR CB C 48 68.846 71.104 -2.258 1
1 502 . 18 1 1 A 48 48 THR N N 48 110.190 118.029 -7.839 1
1 503 . 18 1 1 A 49 49 GLU H H 49 8.346 8.770 -0.424 1
1 504 . 18 1 1 A 49 49 GLU HA H 49 4.277 4.197 0.080 1
1 509 . 18 1 1 A 49 49 GLU C C 49 174.109 176.595 -2.486 1
1 510 . 18 1 1 A 49 49 GLU CA C 49 52.909 57.478 -4.569 1
1 511 . 18 1 1 A 49 49 GLU CB C 49 27.845 30.562 -2.717 1
1 513 . 18 1 1 A 49 49 GLU N N 49 119.985 123.888 -3.903 1
1 514 . 18 1 1 A 50 50 GLY H H 50 7.617 7.519 0.098 1
1 515 . 18 1 1 A 50 50 GLY HA2 H 50 3.935 4.034 -0.099 1
1 516 . 18 1 1 A 50 50 GLY HA3 H 50 3.935 4.071 -0.136 1
1 517 . 18 1 1 A 50 50 GLY C C 50 168.223 173.312 -5.089 1
1 518 . 18 1 1 A 50 50 GLY CA C 50 42.121 46.034 -3.913 1
1 519 . 18 1 1 A 50 50 GLY N N 50 108.670 105.979 2.691 1
1 520 . 18 1 1 A 51 51 PRO HA H 51 4.298 4.399 -0.101 1
1 527 . 18 1 1 A 51 51 PRO C C 51 175.067 175.873 -0.806 1
1 528 . 18 1 1 A 51 51 PRO CA C 51 60.175 62.603 -2.428 1
1 529 . 18 1 1 A 51 51 PRO CB C 51 30.052 32.599 -2.547 1
1 532 . 18 1 1 A 52 52 PHE H H 52 8.442 7.990 0.452 1
1 533 . 18 1 1 A 52 52 PHE HA H 52 3.981 4.766 -0.785 1
1 541 . 18 1 1 A 52 52 PHE C C 52 175.141 175.923 -0.782 1
1 542 . 18 1 1 A 52 52 PHE CA C 52 56.808 57.172 -0.364 1
1 543 . 18 1 1 A 52 52 PHE CB C 52 36.830 42.079 -5.249 1
1 549 . 18 1 1 A 52 52 PHE N N 52 118.707 119.422 -0.715 1
1 550 . 18 1 1 A 53 53 GLN H H 53 8.778 8.311 0.467 1
1 551 . 18 1 1 A 53 53 GLN HA H 53 4.149 4.232 -0.083 1
1 558 . 18 1 1 A 53 53 GLN C C 53 172.773 175.240 -2.467 1
1 559 . 18 1 1 A 53 53 GLN CA C 53 52.999 56.307 -3.308 1
1 560 . 18 1 1 A 53 53 GLN CB C 53 26.962 29.487 -2.525 1
1 562 . 18 1 1 A 53 53 GLN N N 53 122.164 120.547 1.617 1
1 564 . 18 1 1 A 54 54 GLU H H 54 8.432 8.669 -0.237 1
1 565 . 18 1 1 A 54 54 GLU HA H 54 5.533 5.014 0.519 1
1 570 . 18 1 1 A 54 54 GLU C C 54 173.930 174.878 -0.948 1
1 571 . 18 1 1 A 54 54 GLU CA C 54 52.981 55.628 -2.647 1
1 572 . 18 1 1 A 54 54 GLU CB C 54 31.712 32.526 -0.814 1
1 574 . 18 1 1 A 54 54 GLU N N 54 119.688 121.358 -1.670 1
1 575 . 18 1 1 A 55 55 VAL H H 55 9.077 9.030 0.047 1
1 576 . 18 1 1 A 55 55 VAL HA H 55 4.180 4.821 -0.641 1
1 584 . 18 1 1 A 55 55 VAL C C 55 171.811 174.292 -2.481 1
1 585 . 18 1 1 A 55 55 VAL CA C 55 59.664 61.286 -1.622 1
1 586 . 18 1 1 A 55 55 VAL CB C 55 31.827 34.718 -2.891 1
1 589 . 18 1 1 A 55 55 VAL N N 55 125.328 126.370 -1.042 1
1 590 . 18 1 1 A 56 56 ASP H H 56 8.639 8.820 -0.181 1
1 591 . 18 1 1 A 56 56 ASP HA H 56 5.250 5.694 -0.444 1
1 594 . 18 1 1 A 56 56 ASP C C 56 174.252 175.963 -1.711 1
1 595 . 18 1 1 A 56 56 ASP CA C 56 50.108 52.231 -2.123 1
1 596 . 18 1 1 A 56 56 ASP CB C 56 41.407 44.091 -2.684 1
1 597 . 18 1 1 A 56 56 ASP N N 56 125.773 124.940 0.833 1
1 598 . 18 1 1 A 57 57 GLY H H 57 7.222 8.725 -1.503 1
1 599 . 18 1 1 A 57 57 GLY HA2 H 57 3.479 3.887 -0.408 1
1 600 . 18 1 1 A 57 57 GLY HA3 H 57 2.719 3.950 -1.231 1
1 601 . 18 1 1 A 57 57 GLY C C 57 172.281 174.436 -2.155 1
1 602 . 18 1 1 A 57 57 GLY CA C 57 43.919 45.271 -1.352 1
1 603 . 18 1 1 A 57 57 GLY N N 57 105.564 110.788 -5.224 1
1 604 . 18 1 1 A 58 58 VAL H H 58 8.338 8.016 0.322 1
1 605 . 18 1 1 A 58 58 VAL HA H 58 3.860 4.274 -0.414 1
1 613 . 18 1 1 A 58 58 VAL C C 58 173.981 175.789 -1.808 1
1 614 . 18 1 1 A 58 58 VAL CA C 58 61.233 61.496 -0.263 1
1 615 . 18 1 1 A 58 58 VAL CB C 58 29.708 31.575 -1.867 1
1 618 . 18 1 1 A 58 58 VAL N N 58 121.466 121.087 0.379 1
1 619 . 18 1 1 A 59 59 ALA H H 59 9.038 8.716 0.322 1
1 620 . 18 1 1 A 59 59 ALA HA H 59 4.676 4.579 0.097 1
1 624 . 18 1 1 A 59 59 ALA C C 59 175.105 176.825 -1.720 1
1 625 . 18 1 1 A 59 59 ALA CA C 59 50.866 52.380 -1.514 1
1 626 . 18 1 1 A 59 59 ALA CB C 59 17.647 19.255 -1.608 1
1 627 . 18 1 1 A 59 59 ALA N N 59 130.928 129.826 1.102 1
1 628 . 18 1 1 A 60 60 THR H H 60 7.445 7.691 -0.246 1
1 629 . 18 1 1 A 60 60 THR HA H 60 4.642 4.769 -0.127 1
1 634 . 18 1 1 A 60 60 THR C C 60 169.528 174.492 -4.964 1
1 635 . 18 1 1 A 60 60 THR CA C 60 57.101 59.551 -2.450 1
1 636 . 18 1 1 A 60 60 THR CB C 60 67.982 72.063 -4.081 1
1 638 . 18 1 1 A 60 60 THR N N 60 109.256 109.428 -0.172 1
1 639 . 18 1 1 A 61 61 THR H H 61 7.325 8.262 -0.937 1
1 640 . 18 1 1 A 61 61 THR HA H 61 2.896 3.634 -0.738 1
1 645 . 18 1 1 A 61 61 THR C C 61 169.678 173.109 -3.431 1
1 646 . 18 1 1 A 61 61 THR CA C 61 57.246 61.887 -4.641 1
1 647 . 18 1 1 A 61 61 THR CB C 61 63.794 68.791 -4.997 1
1 649 . 18 1 1 A 61 61 THR N N 61 105.670 110.661 -4.991 1
1 650 . 18 1 1 A 62 62 ARG H H 62 6.490 7.211 -0.721 1
1 651 . 18 1 1 A 62 62 ARG HA H 62 4.698 4.548 0.150 1
1 658 . 18 1 1 A 62 62 ARG C C 62 172.881 173.802 -0.921 1
1 659 . 18 1 1 A 62 62 ARG CA C 62 52.276 54.114 -1.838 1
1 660 . 18 1 1 A 62 62 ARG CB C 62 30.774 33.151 -2.377 1
1 663 . 18 1 1 A 62 62 ARG N N 62 117.485 121.466 -3.981 1
1 664 . 18 1 1 A 63 63 TYR H H 63 8.891 8.697 0.194 1
1 665 . 18 1 1 A 63 63 TYR HA H 63 4.356 5.310 -0.954 1
1 672 . 18 1 1 A 63 63 TYR C C 63 170.393 173.959 -3.566 1
1 673 . 18 1 1 A 63 63 TYR CA C 63 57.284 57.220 0.064 1
1 674 . 18 1 1 A 63 63 TYR CB C 63 41.467 42.678 -1.211 1
1 679 . 18 1 1 A 63 63 TYR N N 63 124.712 127.236 -2.524 1
1 680 . 18 1 1 A 64 64 SER H H 64 7.244 8.104 -0.860 1
1 681 . 18 1 1 A 64 64 SER HA H 64 5.077 5.394 -0.317 1
1 684 . 18 1 1 A 64 64 SER C C 64 169.712 172.953 -3.241 1
1 685 . 18 1 1 A 64 64 SER CA C 64 54.181 55.907 -1.726 1
1 686 . 18 1 1 A 64 64 SER CB C 64 61.122 65.355 -4.233 1
1 687 . 18 1 1 A 64 64 SER N N 64 120.593 117.700 2.893 1
1 688 . 18 1 1 A 65 65 ILE H H 65 8.686 9.058 -0.372 1
1 689 . 18 1 1 A 65 65 ILE HA H 65 3.937 4.737 -0.800 1
1 699 . 18 1 1 A 65 65 ILE C C 65 172.217 175.387 -3.170 1
1 700 . 18 1 1 A 65 65 ILE CA C 65 58.288 59.604 -1.316 1
1 701 . 18 1 1 A 65 65 ILE CB C 65 36.110 39.502 -3.392 1
1 705 . 18 1 1 A 65 65 ILE N N 65 127.792 125.760 2.032 1
1 706 . 18 1 1 A 66 66 GLY H H 66 7.883 8.570 -0.687 1
1 707 . 18 1 1 A 66 66 GLY HA2 H 66 4.799 4.338 0.461 1
1 708 . 18 1 1 A 66 66 GLY HA3 H 66 3.468 4.351 -0.883 1
1 709 . 18 1 1 A 66 66 GLY C C 66 171.983 173.895 -1.912 1
1 710 . 18 1 1 A 66 66 GLY CA C 66 40.534 45.217 -4.683 1
1 711 . 18 1 1 A 66 66 GLY N N 66 112.632 112.349 0.283 1
1 712 . 18 1 1 A 67 67 GLY H H 67 8.483 8.388 0.095 1
1 713 . 18 1 1 A 67 67 GLY HA2 H 67 3.836 4.028 -0.192 1
1 714 . 18 1 1 A 67 67 GLY HA3 H 67 3.682 4.065 -0.383 1
1 715 . 18 1 1 A 67 67 GLY C C 67 172.954 174.535 -1.581 1
1 716 . 18 1 1 A 67 67 GLY CA C 67 43.568 45.633 -2.065 1
1 717 . 18 1 1 A 67 67 GLY N N 67 104.625 109.457 -4.832 1
1 718 . 18 1 1 A 68 68 LEU H H 68 8.236 8.002 0.234 1
1 719 . 18 1 1 A 68 68 LEU HA H 68 4.154 4.570 -0.416 1
1 729 . 18 1 1 A 68 68 LEU C C 68 173.838 176.030 -2.192 1
1 730 . 18 1 1 A 68 68 LEU CA C 68 51.025 53.651 -2.626 1
1 731 . 18 1 1 A 68 68 LEU CB C 68 38.837 42.421 -3.584 1
1 735 . 18 1 1 A 68 68 LEU N N 68 118.919 122.064 -3.145 1
1 736 . 18 1 1 A 69 69 SER H H 69 8.284 8.776 -0.492 1
1 737 . 18 1 1 A 69 69 SER HA H 69 4.765 5.046 -0.281 1
1 740 . 18 1 1 A 69 69 SER C C 69 170.044 172.146 -2.102 1
1 741 . 18 1 1 A 69 69 SER CA C 69 54.639 56.320 -1.681 1
1 742 . 18 1 1 A 69 69 SER CB C 69 61.216 63.795 -2.579 1
1 743 . 18 1 1 A 69 69 SER N N 69 116.361 117.048 -0.687 1
1 744 . 18 1 1 A 70 70 PRO HA H 70 5.141 4.582 0.559 1
1 751 . 18 1 1 A 70 70 PRO C C 70 174.858 177.487 -2.629 1
1 752 . 18 1 1 A 70 70 PRO CA C 70 60.810 63.861 -3.051 1
1 753 . 18 1 1 A 70 70 PRO CB C 70 30.657 32.053 -1.396 1
1 756 . 18 1 1 A 71 71 PHE H H 71 8.139 9.123 -0.984 1
1 757 . 18 1 1 A 71 71 PHE HA H 71 4.202 4.425 -0.223 1
1 765 . 18 1 1 A 71 71 PHE C C 71 172.870 174.383 -1.513 1
1 766 . 18 1 1 A 71 71 PHE CA C 71 55.410 58.943 -3.533 1
1 767 . 18 1 1 A 71 71 PHE CB C 71 36.027 37.624 -1.597 1
1 773 . 18 1 1 A 71 71 PHE N N 71 125.409 123.394 2.015 1
1 774 . 18 1 1 A 72 72 SER H H 72 8.182 7.572 0.610 1
1 775 . 18 1 1 A 72 72 SER HA H 72 4.755 5.099 -0.344 1
1 778 . 18 1 1 A 72 72 SER C C 72 168.850 172.396 -3.546 1
1 779 . 18 1 1 A 72 72 SER CA C 72 55.926 56.537 -0.611 1
1 780 . 18 1 1 A 72 72 SER CB C 72 64.208 67.011 -2.803 1
1 781 . 18 1 1 A 72 72 SER N N 72 113.509 110.112 3.397 1
1 782 . 18 1 1 A 73 73 GLU H H 73 8.422 8.785 -0.363 1
1 783 . 18 1 1 A 73 73 GLU HA H 73 4.966 5.139 -0.173 1
1 788 . 18 1 1 A 73 73 GLU C C 73 173.192 174.727 -1.535 1
1 789 . 18 1 1 A 73 73 GLU CA C 73 52.815 54.987 -2.172 1
1 790 . 18 1 1 A 73 73 GLU CB C 73 29.416 32.269 -2.853 1
1 792 . 18 1 1 A 73 73 GLU N N 73 123.046 123.667 -0.621 1
1 793 . 18 1 1 A 74 74 TYR H H 74 9.205 8.946 0.259 1
1 794 . 18 1 1 A 74 74 TYR HA H 74 4.799 4.995 -0.196 1
1 801 . 18 1 1 A 74 74 TYR C C 74 170.775 174.299 -3.524 1
1 802 . 18 1 1 A 74 74 TYR CA C 74 55.291 56.687 -1.396 1
1 803 . 18 1 1 A 74 74 TYR CB C 74 42.943 42.541 0.402 1
1 808 . 18 1 1 A 74 74 TYR N N 74 125.351 124.665 0.686 1
1 809 . 18 1 1 A 75 75 ALA H H 75 8.639 8.175 0.464 1
1 810 . 18 1 1 A 75 75 ALA HA H 75 5.271 5.213 0.058 1
1 814 . 18 1 1 A 75 75 ALA C C 75 173.698 175.596 -1.898 1
1 815 . 18 1 1 A 75 75 ALA CA C 75 47.904 50.302 -2.398 1
1 816 . 18 1 1 A 75 75 ALA CB C 75 19.634 20.138 -0.504 1
1 817 . 18 1 1 A 75 75 ALA N N 75 121.555 123.611 -2.056 1
1 818 . 18 1 1 A 76 76 PHE H H 76 9.066 9.366 -0.300 1
1 819 . 18 1 1 A 76 76 PHE HA H 76 5.496 5.572 -0.076 1
1 827 . 18 1 1 A 76 76 PHE C C 76 172.268 175.277 -3.009 1
1 828 . 18 1 1 A 76 76 PHE CA C 76 54.216 57.298 -3.082 1
1 829 . 18 1 1 A 76 76 PHE CB C 76 41.901 41.542 0.359 1
1 835 . 18 1 1 A 76 76 PHE N N 76 116.545 123.367 -6.822 1
1 836 . 18 1 1 A 77 77 ARG H H 77 9.216 9.006 0.210 1
1 837 . 18 1 1 A 77 77 ARG HA H 77 4.357 5.205 -0.848 1
1 845 . 18 1 1 A 77 77 ARG C C 77 169.998 174.158 -4.160 1
1 846 . 18 1 1 A 77 77 ARG CA C 77 52.414 54.985 -2.571 1
1 847 . 18 1 1 A 77 77 ARG CB C 77 30.794 34.014 -3.220 1
1 850 . 18 1 1 A 77 77 ARG N N 77 115.738 119.085 -3.347 1
1 852 . 18 1 1 A 78 78 VAL H H 78 8.135 8.802 -0.667 1
1 853 . 18 1 1 A 78 78 VAL HA H 78 4.884 4.761 0.123 1
1 861 . 18 1 1 A 78 78 VAL C C 78 171.098 174.552 -3.454 1
1 862 . 18 1 1 A 78 78 VAL CA C 78 57.566 60.653 -3.087 1
1 863 . 18 1 1 A 78 78 VAL CB C 78 33.146 33.469 -0.323 1
1 866 . 18 1 1 A 78 78 VAL N N 78 117.942 123.696 -5.754 1
1 867 . 18 1 1 A 79 79 LEU H H 79 9.167 8.211 0.956 1
1 868 . 18 1 1 A 79 79 LEU HA H 79 4.575 4.850 -0.275 1
1 878 . 18 1 1 A 79 79 LEU C C 79 171.447 175.062 -3.615 1
1 879 . 18 1 1 A 79 79 LEU CA C 79 51.642 53.566 -1.924 1
1 880 . 18 1 1 A 79 79 LEU CB C 79 42.776 45.674 -2.898 1
1 884 . 18 1 1 A 79 79 LEU N N 79 123.913 119.202 4.711 1
1 885 . 18 1 1 A 80 80 ALA H H 80 9.325 8.560 0.765 1
1 886 . 18 1 1 A 80 80 ALA HA H 80 4.654 3.891 0.763 1
1 890 . 18 1 1 A 80 80 ALA C C 80 172.070 176.923 -4.853 1
1 891 . 18 1 1 A 80 80 ALA CA C 80 48.169 51.303 -3.134 1
1 892 . 18 1 1 A 80 80 ALA CB C 80 20.366 19.702 0.664 1
1 893 . 18 1 1 A 80 80 ALA N N 80 124.135 122.503 1.632 1
1 894 . 18 1 1 A 81 81 VAL H H 81 7.953 7.745 0.208 1
1 895 . 18 1 1 A 81 81 VAL HA H 81 4.293 4.883 -0.590 1
1 903 . 18 1 1 A 81 81 VAL C C 81 172.873 174.150 -1.277 1
1 904 . 18 1 1 A 81 81 VAL CA C 81 58.959 60.423 -1.464 1
1 905 . 18 1 1 A 81 81 VAL CB C 81 31.412 35.135 -3.723 1
1 908 . 18 1 1 A 81 81 VAL N N 81 118.503 119.877 -1.374 1
1 909 . 18 1 1 A 82 82 ASN H H 82 8.262 8.617 -0.355 1
1 910 . 18 1 1 A 82 82 ASN HA H 82 4.945 5.031 -0.086 1
1 915 . 18 1 1 A 82 82 ASN C C 82 173.273 175.209 -1.936 1
1 916 . 18 1 1 A 82 82 ASN CA C 82 48.714 51.806 -3.092 1
1 917 . 18 1 1 A 82 82 ASN CB C 82 36.796 40.349 -3.553 1
1 918 . 18 1 1 A 82 82 ASN N N 82 125.425 123.519 1.906 1
1 920 . 18 1 1 A 83 83 SER HA H 83 3.966 4.072 -0.106 1
1 923 . 18 1 1 A 83 83 SER C C 83 172.812 176.926 -4.114 1
1 924 . 18 1 1 A 83 83 SER CA C 83 59.047 62.459 -3.412 1
1 925 . 18 1 1 A 83 83 SER CB C 83 60.406 62.817 -2.411 1
1 926 . 18 1 1 A 84 84 ILE H H 84 7.803 7.909 -0.106 1
1 927 . 18 1 1 A 84 84 ILE HA H 84 3.862 3.719 0.143 1
1 937 . 18 1 1 A 84 84 ILE C C 84 174.481 176.162 -1.681 1
1 938 . 18 1 1 A 84 84 ILE CA C 84 59.188 64.734 -5.546 1
1 939 . 18 1 1 A 84 84 ILE CB C 84 34.677 38.234 -3.557 1
1 943 . 18 1 1 A 84 84 ILE N N 84 121.222 119.899 1.323 1
1 944 . 18 1 1 A 85 85 GLY H H 85 7.435 7.309 0.126 1
1 945 . 18 1 1 A 85 85 GLY HA2 H 85 4.149 4.056 0.093 1
1 946 . 18 1 1 A 85 85 GLY HA3 H 85 3.747 4.061 -0.314 1
1 947 . 18 1 1 A 85 85 GLY C C 85 168.589 171.939 -3.350 1
1 948 . 18 1 1 A 85 85 GLY CA C 85 42.931 45.522 -2.591 1
1 949 . 18 1 1 A 85 85 GLY N N 85 106.320 105.395 0.925 1
1 950 . 18 1 1 A 86 86 ARG H H 86 8.190 8.462 -0.272 1
1 951 . 18 1 1 A 86 86 ARG HA H 86 4.452 5.030 -0.578 1
1 958 . 18 1 1 A 86 86 ARG C C 86 175.286 175.955 -0.669 1
1 959 . 18 1 1 A 86 86 ARG CA C 86 53.223 54.958 -1.735 1
1 960 . 18 1 1 A 86 86 ARG CB C 86 29.517 31.670 -2.153 1
1 963 . 18 1 1 A 86 86 ARG N N 86 118.339 118.027 0.312 1
1 964 . 18 1 1 A 87 87 GLY H H 87 8.900 8.394 0.506 1
1 965 . 18 1 1 A 87 87 GLY HA2 H 87 4.211 4.011 0.200 1
1 966 . 18 1 1 A 87 87 GLY HA3 H 87 3.967 4.023 -0.056 1
1 967 . 18 1 1 A 87 87 GLY C C 87 168.101 172.785 -4.684 1
1 968 . 18 1 1 A 87 87 GLY CA C 87 42.281 44.222 -1.941 1
1 969 . 18 1 1 A 87 87 GLY N N 87 113.482 109.382 4.100 1
1 970 . 18 1 1 A 88 88 PRO HA H 88 4.563 4.540 0.023 1
1 977 . 18 1 1 A 88 88 PRO CA C 88 60.994 62.109 -1.115 1
1 978 . 18 1 1 A 88 88 PRO CB C 88 29.873 31.522 -1.649 1
1 981 . 18 1 1 A 89 89 PRO HA H 89 4.490 4.455 0.035 1
1 987 . 18 1 1 A 89 89 PRO C C 89 174.543 176.401 -1.858 1
1 988 . 18 1 1 A 89 89 PRO CA C 89 59.435 62.587 -3.152 1
1 989 . 18 1 1 A 89 89 PRO CB C 89 29.805 32.156 -2.351 1
1 992 . 18 1 1 A 90 90 SER H H 90 8.808 8.553 0.255 1
1 993 . 18 1 1 A 90 90 SER HA H 90 4.202 4.524 -0.322 1
1 996 . 18 1 1 A 90 90 SER C C 90 171.870 173.969 -2.099 1
1 997 . 18 1 1 A 90 90 SER CA C 90 55.868 57.820 -1.952 1
1 998 . 18 1 1 A 90 90 SER CB C 90 64.504 63.940 0.564 1
1 999 . 18 1 1 A 90 90 SER N N 90 113.781 116.778 -2.997 1
1 1000 . 18 1 1 A 91 91 GLU H H 91 8.291 8.480 -0.189 1
1 1001 . 18 1 1 A 91 91 GLU HA H 91 4.131 4.118 0.013 1
1 1006 . 18 1 1 A 91 91 GLU C C 91 174.882 176.908 -2.026 1
1 1007 . 18 1 1 A 91 91 GLU CA C 91 54.984 57.269 -2.285 1
1 1008 . 18 1 1 A 91 91 GLU CB C 91 27.643 29.443 -1.800 1
1 1010 . 18 1 1 A 91 91 GLU N N 91 117.930 123.732 -5.802 1
1 1011 . 18 1 1 A 92 92 ALA H H 92 8.605 8.356 0.249 1
1 1012 . 18 1 1 A 92 92 ALA HA H 92 5.068 4.536 0.532 1
1 1016 . 18 1 1 A 92 92 ALA C C 92 176.227 178.017 -1.790 1
1 1017 . 18 1 1 A 92 92 ALA CA C 92 48.997 53.048 -4.051 1
1 1018 . 18 1 1 A 92 92 ALA CB C 92 17.756 19.190 -1.434 1
1 1019 . 18 1 1 A 92 92 ALA N N 92 126.421 127.660 -1.239 1
1 1020 . 18 1 1 A 93 93 VAL H H 93 9.051 9.229 -0.178 1
1 1021 . 18 1 1 A 93 93 VAL HA H 93 4.642 4.956 -0.314 1
1 1029 . 18 1 1 A 93 93 VAL C C 93 172.010 174.458 -2.448 1
1 1030 . 18 1 1 A 93 93 VAL CA C 93 57.495 59.354 -1.859 1
1 1031 . 18 1 1 A 93 93 VAL CB C 93 32.774 34.246 -1.472 1
1 1034 . 18 1 1 A 93 93 VAL N N 93 117.322 117.869 -0.547 1
1 1035 . 18 1 1 A 94 94 ARG H H 94 8.470 8.882 -0.412 1
1 1036 . 18 1 1 A 94 94 ARG HA H 94 5.692 5.374 0.318 1
1 1043 . 18 1 1 A 94 94 ARG C C 94 173.635 175.436 -1.801 1
1 1044 . 18 1 1 A 94 94 ARG CA C 94 52.038 54.709 -2.671 1
1 1045 . 18 1 1 A 94 94 ARG CB C 94 30.966 31.814 -0.848 1
1 1048 . 18 1 1 A 94 94 ARG N N 94 122.258 123.550 -1.292 1
1 1049 . 18 1 1 A 95 95 ALA H H 95 9.051 9.094 -0.043 1
1 1050 . 18 1 1 A 95 95 ALA HA H 95 4.642 5.264 -0.622 1
1 1054 . 18 1 1 A 95 95 ALA C C 95 172.285 175.092 -2.807 1
1 1055 . 18 1 1 A 95 95 ALA CA C 95 49.191 50.644 -1.453 1
1 1056 . 18 1 1 A 95 95 ALA CB C 95 22.562 22.218 0.344 1
1 1057 . 18 1 1 A 95 95 ALA N N 95 121.931 127.041 -5.110 1
1 1058 . 18 1 1 A 96 96 ARG H H 96 8.550 8.772 -0.222 1
1 1059 . 18 1 1 A 96 96 ARG HA H 96 5.407 5.201 0.206 1
1 1066 . 18 1 1 A 96 96 ARG C C 96 174.547 176.016 -1.469 1
1 1067 . 18 1 1 A 96 96 ARG CA C 96 51.439 55.015 -3.576 1
1 1068 . 18 1 1 A 96 96 ARG CB C 96 30.708 31.534 -0.826 1
1 1071 . 18 1 1 A 96 96 ARG N N 96 121.155 124.431 -3.276 1
1 1072 . 18 1 1 A 97 97 THR H H 97 8.797 8.991 -0.194 1
1 1073 . 18 1 1 A 97 97 THR HA H 97 4.116 4.436 -0.320 1
1 1078 . 18 1 1 A 97 97 THR C C 97 173.577 175.024 -1.447 1
1 1079 . 18 1 1 A 97 97 THR CA C 97 58.800 61.697 -2.897 1
1 1080 . 18 1 1 A 97 97 THR CB C 97 67.461 69.590 -2.129 1
1 1082 . 18 1 1 A 97 97 THR N N 97 114.657 117.905 -3.248 1
1 1083 . 18 1 1 A 98 98 GLY H H 98 7.505 8.520 -1.015 1
1 1084 . 18 1 1 A 98 98 GLY HA2 H 98 3.866 4.062 -0.196 1
1 1085 . 18 1 1 A 98 98 GLY HA3 H 98 3.743 4.123 -0.380 1
1 1086 . 18 1 1 A 98 98 GLY C C 98 170.637 173.288 -2.651 1
1 1087 . 18 1 1 A 98 98 GLY CA C 98 42.332 45.109 -2.777 1
1 1088 . 18 1 1 A 98 98 GLY N N 98 106.172 107.986 -1.814 1
1 1089 . 18 1 1 A 99 99 GLU H H 99 8.145 8.464 -0.319 1
1 1090 . 18 1 1 A 99 99 GLU HA H 99 4.210 4.831 -0.621 1
1 1095 . 18 1 1 A 99 99 GLU C C 99 174.134 175.307 -1.173 1
1 1096 . 18 1 1 A 99 99 GLU CA C 99 53.828 56.003 -2.175 1
1 1097 . 18 1 1 A 99 99 GLU CB C 99 28.774 30.485 -1.711 1
1 1099 . 18 1 1 A 99 99 GLU N N 99 117.634 118.787 -1.153 1
1 1100 . 18 1 1 A 100 100 GLN H H 100 8.647 8.689 -0.042 1
1 1101 . 18 1 1 A 100 100 GLN HA H 100 4.247 4.669 -0.422 1
1 1108 . 18 1 1 A 100 100 GLN C C 100 173.348 174.418 -1.070 1
1 1109 . 18 1 1 A 100 100 GLN CA C 100 53.634 55.072 -1.438 1
1 1110 . 18 1 1 A 100 100 GLN CB C 100 27.392 32.109 -4.717 1
1 1112 . 18 1 1 A 100 100 GLN N N 100 121.960 122.198 -0.238 1
1 1114 . 18 1 1 A 101 101 SER H H 101 8.416 8.902 -0.486 1
1 1115 . 18 1 1 A 101 101 SER HA H 101 4.418 4.370 0.048 1
1 1117 . 18 1 1 A 101 101 SER C C 101 172.148 174.172 -2.024 1
1 1118 . 18 1 1 A 101 101 SER CA C 101 55.926 59.684 -3.758 1
1 1119 . 18 1 1 A 101 101 SER CB C 101 61.617 62.888 -1.271 1
1 1120 . 18 1 1 A 101 101 SER N N 101 118.609 119.887 -1.278 1
1 1121 . 18 1 1 A 102 102 GLY H H 102 8.233 8.377 -0.144 1
1 1122 . 18 1 1 A 102 102 GLY HA2 H 102 4.080 4.084 -0.004 1
1 1123 . 18 1 1 A 102 102 GLY HA3 H 102 3.981 4.089 -0.108 1
1 1124 . 18 1 1 A 102 102 GLY C C 102 169.461 173.225 -3.764 1
1 1125 . 18 1 1 A 102 102 GLY CA C 102 42.332 46.108 -3.776 1
1 1126 . 18 1 1 A 102 102 GLY N N 102 110.483 110.756 -0.273 1
1 1127 . 18 1 1 A 103 103 PRO HA H 103 4.618 4.598 0.020 1
1 1134 . 18 1 1 A 103 103 PRO CA C 103 57.843 62.581 -4.738 1
1 1135 . 18 1 1 A 103 103 PRO CB C 103 28.671 32.526 -3.855 1
1 1 . 19 1 1 A 6 6 SER HA H 6 4.492 4.803 -0.311 1
1 4 . 19 1 1 A 6 6 SER CA C 6 55.621 56.901 -1.280 1
1 5 . 19 1 1 A 6 6 SER CB C 6 62.104 64.541 -2.437 1
1 6 . 19 1 1 A 7 7 GLY H H 7 8.244 8.720 -0.476 1
1 7 . 19 1 1 A 7 7 GLY HA2 H 7 3.873 3.994 -0.121 1
1 8 . 19 1 1 A 7 7 GLY HA3 H 7 3.737 4.001 -0.264 1
1 9 . 19 1 1 A 7 7 GLY CA C 7 41.743 44.684 -2.941 1
1 10 . 19 1 1 A 7 7 GLY N N 7 109.193 117.285 -8.092 1
1 11 . 19 1 1 A 8 8 PRO HA H 8 4.286 4.553 -0.267 1
1 18 . 19 1 1 A 8 8 PRO C C 8 173.841 175.501 -1.660 1
1 19 . 19 1 1 A 8 8 PRO CA C 8 60.528 62.464 -1.936 1
1 20 . 19 1 1 A 8 8 PRO CB C 8 30.299 32.743 -2.444 1
1 23 . 19 1 1 A 9 9 LYS H H 9 8.877 8.582 0.295 1
1 24 . 19 1 1 A 9 9 LYS HA H 9 4.360 4.813 -0.453 1
1 33 . 19 1 1 A 9 9 LYS C C 9 173.492 174.263 -0.771 1
1 34 . 19 1 1 A 9 9 LYS CA C 9 52.135 53.075 -0.940 1
1 35 . 19 1 1 A 9 9 LYS CB C 9 28.798 33.340 -4.542 1
1 39 . 19 1 1 A 9 9 LYS N N 9 120.404 120.235 0.169 1
1 40 . 19 1 1 A 10 10 PRO HA H 10 4.284 4.604 -0.320 1
1 47 . 19 1 1 A 10 10 PRO CA C 10 59.326 61.610 -2.284 1
1 48 . 19 1 1 A 10 10 PRO CB C 10 28.825 31.638 -2.813 1
1 51 . 19 1 1 A 11 11 PRO HA H 11 4.468 4.757 -0.289 1
1 58 . 19 1 1 A 11 11 PRO C C 11 171.993 176.438 -4.445 1
1 59 . 19 1 1 A 11 11 PRO CA C 11 60.422 62.775 -2.353 1
1 60 . 19 1 1 A 11 11 PRO CB C 11 30.418 32.701 -2.283 1
1 63 . 19 1 1 A 12 12 ILE H H 12 7.554 7.989 -0.435 1
1 64 . 19 1 1 A 12 12 ILE HA H 12 4.676 4.613 0.063 1
1 74 . 19 1 1 A 12 12 ILE C C 12 171.721 175.140 -3.419 1
1 75 . 19 1 1 A 12 12 ILE CA C 12 56.843 58.846 -2.003 1
1 76 . 19 1 1 A 12 12 ILE CB C 12 40.560 40.591 -0.031 1
1 80 . 19 1 1 A 12 12 ILE N N 12 109.695 117.272 -7.577 1
1 81 . 19 1 1 A 13 13 ASP H H 13 8.435 9.034 -0.599 1
1 82 . 19 1 1 A 13 13 ASP HA H 13 4.094 4.253 -0.159 1
1 85 . 19 1 1 A 13 13 ASP C C 13 171.803 176.142 -4.339 1
1 86 . 19 1 1 A 13 13 ASP CA C 13 52.610 55.114 -2.504 1
1 87 . 19 1 1 A 13 13 ASP CB C 13 36.357 40.290 -3.933 1
1 88 . 19 1 1 A 13 13 ASP N N 13 116.219 122.016 -5.797 1
1 89 . 19 1 1 A 14 14 LEU H H 14 7.483 7.984 -0.501 1
1 90 . 19 1 1 A 14 14 LEU HA H 14 4.990 4.622 0.368 1
1 100 . 19 1 1 A 14 14 LEU C C 14 174.702 175.362 -0.660 1
1 101 . 19 1 1 A 14 14 LEU CA C 14 53.811 55.269 -1.458 1
1 102 . 19 1 1 A 14 14 LEU CB C 14 40.148 42.338 -2.190 1
1 106 . 19 1 1 A 14 14 LEU N N 14 118.463 121.153 -2.690 1
1 107 . 19 1 1 A 15 15 VAL H H 15 9.209 8.506 0.703 1
1 108 . 19 1 1 A 15 15 VAL HA H 15 4.250 4.722 -0.472 1
1 116 . 19 1 1 A 15 15 VAL C C 15 172.080 174.132 -2.052 1
1 117 . 19 1 1 A 15 15 VAL CA C 15 58.570 60.454 -1.884 1
1 118 . 19 1 1 A 15 15 VAL CB C 15 34.146 36.156 -2.010 1
1 121 . 19 1 1 A 15 15 VAL N N 15 124.833 127.967 -3.134 1
1 122 . 19 1 1 A 16 16 VAL H H 16 8.390 8.781 -0.391 1
1 123 . 19 1 1 A 16 16 VAL HA H 16 4.343 4.565 -0.222 1
1 131 . 19 1 1 A 16 16 VAL C C 16 174.672 175.518 -0.846 1
1 132 . 19 1 1 A 16 16 VAL CA C 16 59.188 60.816 -1.628 1
1 133 . 19 1 1 A 16 16 VAL CB C 16 29.187 33.874 -4.687 1
1 136 . 19 1 1 A 16 16 VAL N N 16 124.654 123.691 0.963 1
1 137 . 19 1 1 A 17 17 THR H H 17 8.638 8.705 -0.067 1
1 138 . 19 1 1 A 17 17 THR HA H 17 4.195 4.447 -0.252 1
1 143 . 19 1 1 A 17 17 THR C C 17 172.661 173.249 -0.588 1
1 144 . 19 1 1 A 17 17 THR CA C 17 60.318 63.524 -3.206 1
1 145 . 19 1 1 A 17 17 THR CB C 17 66.420 70.974 -4.554 1
1 147 . 19 1 1 A 17 17 THR N N 17 120.942 121.767 -0.825 1
1 148 . 19 1 1 A 18 18 GLU H H 18 7.361 7.680 -0.319 1
1 149 . 19 1 1 A 18 18 GLU HA H 18 4.497 4.831 -0.334 1
1 154 . 19 1 1 A 18 18 GLU C C 18 171.691 175.240 -3.549 1
1 155 . 19 1 1 A 18 18 GLU CA C 18 53.687 54.891 -1.204 1
1 156 . 19 1 1 A 18 18 GLU CB C 18 30.802 33.233 -2.431 1
1 158 . 19 1 1 A 18 18 GLU N N 18 119.088 118.755 0.333 1
1 159 . 19 1 1 A 19 19 THR H H 19 8.164 8.675 -0.511 1
1 160 . 19 1 1 A 19 19 THR HA H 19 4.912 5.100 -0.188 1
1 165 . 19 1 1 A 19 19 THR C C 19 171.606 172.790 -1.184 1
1 166 . 19 1 1 A 19 19 THR CA C 19 58.473 60.674 -2.201 1
1 167 . 19 1 1 A 19 19 THR CB C 19 70.103 71.205 -1.102 1
1 169 . 19 1 1 A 19 19 THR N N 19 112.424 113.811 -1.387 1
1 170 . 19 1 1 A 20 20 THR H H 20 8.750 8.855 -0.105 1
1 171 . 19 1 1 A 20 20 THR HA H 20 4.710 4.790 -0.080 1
1 176 . 19 1 1 A 20 20 THR C C 20 172.785 176.098 -3.313 1
1 177 . 19 1 1 A 20 20 THR CA C 20 58.059 60.965 -2.906 1
1 178 . 19 1 1 A 20 20 THR CB C 20 68.782 71.018 -2.236 1
1 180 . 19 1 1 A 20 20 THR N N 20 113.438 121.188 -7.750 1
1 181 . 19 1 1 A 21 21 ALA H H 21 8.453 9.045 -0.592 1
1 182 . 19 1 1 A 21 21 ALA HA H 21 4.079 4.468 -0.389 1
1 186 . 19 1 1 A 21 21 ALA C C 21 174.130 177.967 -3.837 1
1 187 . 19 1 1 A 21 21 ALA CA C 21 52.680 55.364 -2.684 1
1 188 . 19 1 1 A 21 21 ALA CB C 21 16.893 18.468 -1.575 1
1 189 . 19 1 1 A 21 21 ALA N N 21 120.078 126.209 -6.131 1
1 190 . 19 1 1 A 22 22 THR H H 22 7.132 7.493 -0.361 1
1 191 . 19 1 1 A 22 22 THR HA H 22 4.433 4.922 -0.489 1
1 196 . 19 1 1 A 22 22 THR C C 22 171.434 173.421 -1.987 1
1 197 . 19 1 1 A 22 22 THR CA C 22 56.836 60.427 -3.591 1
1 198 . 19 1 1 A 22 22 THR CB C 22 68.772 69.349 -0.577 1
1 200 . 19 1 1 A 22 22 THR N N 22 95.772 104.225 -8.453 1
1 201 . 19 1 1 A 23 23 SER H H 23 7.326 7.763 -0.437 1
1 202 . 19 1 1 A 23 23 SER HA H 23 5.562 5.419 0.143 1
1 205 . 19 1 1 A 23 23 SER C C 23 169.267 172.192 -2.925 1
1 206 . 19 1 1 A 23 23 SER CA C 23 54.445 57.679 -3.234 1
1 207 . 19 1 1 A 23 23 SER CB C 23 65.905 67.912 -2.007 1
1 208 . 19 1 1 A 23 23 SER N N 23 115.757 115.934 -0.177 1
1 209 . 19 1 1 A 24 24 VAL H H 24 7.983 8.652 -0.669 1
1 210 . 19 1 1 A 24 24 VAL HA H 24 4.334 4.500 -0.166 1
1 218 . 19 1 1 A 24 24 VAL C C 24 171.917 173.456 -1.539 1
1 219 . 19 1 1 A 24 24 VAL CA C 24 58.642 60.415 -1.773 1
1 220 . 19 1 1 A 24 24 VAL CB C 24 34.254 34.632 -0.378 1
1 223 . 19 1 1 A 24 24 VAL N N 24 116.595 120.749 -4.154 1
1 224 . 19 1 1 A 25 25 THR H H 25 8.636 8.851 -0.215 1
1 225 . 19 1 1 A 25 25 THR HA H 25 4.833 5.014 -0.181 1
1 230 . 19 1 1 A 25 25 THR C C 25 169.721 172.770 -3.049 1
1 231 . 19 1 1 A 25 25 THR CA C 25 59.699 61.468 -1.769 1
1 232 . 19 1 1 A 25 25 THR CB C 25 67.303 70.600 -3.297 1
1 234 . 19 1 1 A 25 25 THR N N 25 121.690 122.227 -0.537 1
1 235 . 19 1 1 A 26 26 LEU H H 26 8.629 9.413 -0.784 1
1 236 . 19 1 1 A 26 26 LEU HA H 26 5.315 5.345 -0.030 1
1 246 . 19 1 1 A 26 26 LEU C C 26 173.182 175.284 -2.102 1
1 247 . 19 1 1 A 26 26 LEU CA C 26 50.643 53.258 -2.615 1
1 248 . 19 1 1 A 26 26 LEU CB C 26 43.976 46.691 -2.715 1
1 252 . 19 1 1 A 26 26 LEU N N 26 126.843 129.600 -2.757 1
1 253 . 19 1 1 A 27 27 THR H H 27 8.704 8.818 -0.114 1
1 254 . 19 1 1 A 27 27 THR HA H 27 4.822 5.178 -0.356 1
1 259 . 19 1 1 A 27 27 THR C C 27 169.840 173.680 -3.840 1
1 260 . 19 1 1 A 27 27 THR CA C 27 58.077 60.030 -1.953 1
1 261 . 19 1 1 A 27 27 THR CB C 27 69.666 71.325 -1.659 1
1 263 . 19 1 1 A 27 27 THR N N 27 111.513 114.705 -3.192 1
1 264 . 19 1 1 A 28 28 TRP H H 28 7.339 8.151 -0.812 1
1 265 . 19 1 1 A 28 28 TRP HA H 28 4.963 5.535 -0.572 1
1 274 . 19 1 1 A 28 28 TRP C C 28 170.637 172.421 -1.784 1
1 275 . 19 1 1 A 28 28 TRP CA C 28 54.438 55.411 -0.973 1
1 276 . 19 1 1 A 28 28 TRP CB C 28 27.497 31.299 -3.802 1
1 282 . 19 1 1 A 28 28 TRP N N 28 117.895 119.758 -1.863 1
1 284 . 19 1 1 A 29 29 ASP H H 29 8.696 9.245 -0.549 1
1 285 . 19 1 1 A 29 29 ASP HA H 29 4.971 5.122 -0.151 1
1 288 . 19 1 1 A 29 29 ASP C C 29 174.901 176.916 -2.015 1
1 289 . 19 1 1 A 29 29 ASP CA C 29 50.178 52.544 -2.366 1
1 290 . 19 1 1 A 29 29 ASP CB C 29 42.291 43.290 -0.999 1
1 291 . 19 1 1 A 29 29 ASP N N 29 117.477 121.684 -4.207 1
1 292 . 19 1 1 A 30 30 SER H H 30 8.800 8.955 -0.155 1
1 293 . 19 1 1 A 30 30 SER HA H 30 4.389 4.205 0.184 1
1 296 . 19 1 1 A 30 30 SER C C 30 174.032 175.073 -1.041 1
1 297 . 19 1 1 A 30 30 SER CA C 30 58.694 61.965 -3.271 1
1 298 . 19 1 1 A 30 30 SER CB C 30 62.428 63.401 -0.973 1
1 299 . 19 1 1 A 30 30 SER N N 30 118.275 120.159 -1.884 1
1 300 . 19 1 1 A 31 31 GLY H H 31 8.759 8.167 0.592 1
1 301 . 19 1 1 A 31 31 GLY HA2 H 31 4.239 4.017 0.222 1
1 302 . 19 1 1 A 31 31 GLY HA3 H 31 3.555 4.046 -0.491 1
1 303 . 19 1 1 A 31 31 GLY C C 31 171.325 174.251 -2.926 1
1 304 . 19 1 1 A 31 31 GLY CA C 31 43.637 45.446 -1.809 1
1 305 . 19 1 1 A 31 31 GLY N N 31 107.961 109.587 -1.626 1
1 306 . 19 1 1 A 32 32 ASN H H 32 8.173 8.140 0.033 1
1 307 . 19 1 1 A 32 32 ASN HA H 32 4.749 4.946 -0.197 1
1 312 . 19 1 1 A 32 32 ASN C C 32 171.355 175.351 -3.996 1
1 313 . 19 1 1 A 32 32 ASN CA C 32 50.795 53.227 -2.432 1
1 314 . 19 1 1 A 32 32 ASN CB C 32 41.508 39.901 1.607 1
1 315 . 19 1 1 A 32 32 ASN N N 32 117.781 119.692 -1.911 1
1 317 . 19 1 1 A 33 33 SER HA H 33 4.291 4.634 -0.343 1
1 320 . 19 1 1 A 33 33 SER C C 33 172.449 174.107 -1.658 1
1 321 . 19 1 1 A 33 33 SER CA C 33 56.733 59.367 -2.634 1
1 322 . 19 1 1 A 33 33 SER CB C 33 60.884 64.641 -3.757 1
1 323 . 19 1 1 A 34 34 GLU H H 34 7.731 7.787 -0.056 1
1 324 . 19 1 1 A 34 34 GLU HA H 34 4.556 4.922 -0.366 1
1 329 . 19 1 1 A 34 34 GLU C C 34 171.792 174.334 -2.542 1
1 330 . 19 1 1 A 34 34 GLU CA C 34 51.818 54.300 -2.482 1
1 331 . 19 1 1 A 34 34 GLU CB C 34 26.891 31.746 -4.855 1
1 333 . 19 1 1 A 34 34 GLU N N 34 122.319 119.137 3.182 1
1 334 . 19 1 1 A 35 35 PRO HA H 35 4.165 4.780 -0.615 1
1 341 . 19 1 1 A 35 35 PRO C C 35 174.288 177.052 -2.764 1
1 342 . 19 1 1 A 35 35 PRO CA C 35 61.374 62.730 -1.356 1
1 343 . 19 1 1 A 35 35 PRO CB C 35 29.887 31.748 -1.861 1
1 346 . 19 1 1 A 36 36 VAL H H 36 8.348 8.272 0.076 1
1 347 . 19 1 1 A 36 36 VAL HA H 36 3.899 4.421 -0.522 1
1 355 . 19 1 1 A 36 36 VAL C C 36 173.344 176.965 -3.621 1
1 356 . 19 1 1 A 36 36 VAL CA C 36 59.014 61.228 -2.214 1
1 357 . 19 1 1 A 36 36 VAL CB C 36 31.865 33.322 -1.457 1
1 360 . 19 1 1 A 36 36 VAL N N 36 122.051 118.237 3.814 1
1 361 . 19 1 1 A 37 37 THR H H 37 8.780 8.628 0.152 1
1 362 . 19 1 1 A 37 37 THR HA H 37 3.923 3.981 -0.058 1
1 367 . 19 1 1 A 37 37 THR C C 37 172.171 174.574 -2.403 1
1 368 . 19 1 1 A 37 37 THR CA C 37 63.155 66.133 -2.978 1
1 369 . 19 1 1 A 37 37 THR CB C 37 65.941 69.044 -3.103 1
1 371 . 19 1 1 A 37 37 THR N N 37 122.351 118.220 4.131 1
1 372 . 19 1 1 A 38 38 TYR H H 38 7.304 7.868 -0.564 1
1 373 . 19 1 1 A 38 38 TYR HA H 38 4.439 5.078 -0.639 1
1 380 . 19 1 1 A 38 38 TYR C C 38 168.385 172.816 -4.431 1
1 381 . 19 1 1 A 38 38 TYR CA C 38 54.101 56.551 -2.450 1
1 382 . 19 1 1 A 38 38 TYR CB C 38 35.874 40.278 -4.404 1
1 387 . 19 1 1 A 38 38 TYR N N 38 113.984 114.749 -0.765 1
1 388 . 19 1 1 A 39 39 TYR H H 39 9.445 8.802 0.643 1
1 389 . 19 1 1 A 39 39 TYR HA H 39 5.293 5.014 0.279 1
1 396 . 19 1 1 A 39 39 TYR C C 39 172.781 175.818 -3.037 1
1 397 . 19 1 1 A 39 39 TYR CA C 39 54.322 55.598 -1.276 1
1 398 . 19 1 1 A 39 39 TYR CB C 39 39.035 41.594 -2.559 1
1 401 . 19 1 1 A 39 39 TYR N N 39 115.092 118.036 -2.944 1
1 402 . 19 1 1 A 40 40 GLY H H 40 8.870 8.668 0.202 1
1 403 . 19 1 1 A 40 40 GLY HA2 H 40 5.137 4.200 0.937 1
1 404 . 19 1 1 A 40 40 GLY HA3 H 40 3.285 4.283 -0.998 1
1 405 . 19 1 1 A 40 40 GLY C C 40 169.688 172.837 -3.149 1
1 406 . 19 1 1 A 40 40 GLY CA C 40 41.415 44.353 -2.938 1
1 407 . 19 1 1 A 40 40 GLY N N 40 106.573 111.485 -4.912 1
1 408 . 19 1 1 A 41 41 ILE H H 41 8.917 8.181 0.736 1
1 409 . 19 1 1 A 41 41 ILE HA H 41 4.527 4.852 -0.325 1
1 419 . 19 1 1 A 41 41 ILE C C 41 172.692 174.454 -1.762 1
1 420 . 19 1 1 A 41 41 ILE CA C 41 57.597 60.109 -2.512 1
1 421 . 19 1 1 A 41 41 ILE CB C 41 37.840 42.041 -4.201 1
1 425 . 19 1 1 A 41 41 ILE N N 41 121.746 120.355 1.391 1
1 426 . 19 1 1 A 42 42 GLN H H 42 9.063 8.891 0.172 1
1 427 . 19 1 1 A 42 42 GLN HA H 42 5.655 5.556 0.099 1
1 434 . 19 1 1 A 42 42 GLN C C 42 172.841 174.467 -1.626 1
1 435 . 19 1 1 A 42 42 GLN CA C 42 50.789 54.281 -3.492 1
1 436 . 19 1 1 A 42 42 GLN CB C 42 28.898 32.181 -3.283 1
1 438 . 19 1 1 A 42 42 GLN N N 42 125.141 125.410 -0.269 1
1 440 . 19 1 1 A 43 43 TYR H H 43 9.066 8.926 0.140 1
1 441 . 19 1 1 A 43 43 TYR HA H 43 5.922 5.803 0.119 1
1 448 . 19 1 1 A 43 43 TYR C C 43 171.219 173.548 -2.329 1
1 449 . 19 1 1 A 43 43 TYR CA C 43 53.349 56.539 -3.190 1
1 450 . 19 1 1 A 43 43 TYR CB C 43 41.074 41.771 -0.697 1
1 455 . 19 1 1 A 43 43 TYR N N 43 118.018 119.648 -1.630 1
1 456 . 19 1 1 A 44 44 ARG H H 44 8.400 8.801 -0.401 1
1 457 . 19 1 1 A 44 44 ARG HA H 44 4.542 4.955 -0.413 1
1 464 . 19 1 1 A 44 44 ARG C C 44 171.974 174.504 -2.530 1
1 465 . 19 1 1 A 44 44 ARG CA C 44 52.453 54.662 -2.209 1
1 466 . 19 1 1 A 44 44 ARG CB C 44 31.125 32.190 -1.065 1
1 469 . 19 1 1 A 44 44 ARG N N 44 115.214 118.583 -3.369 1
1 470 . 19 1 1 A 45 45 ALA H H 45 8.846 8.140 0.706 1
1 471 . 19 1 1 A 45 45 ALA HA H 45 3.894 3.053 0.841 1
1 475 . 19 1 1 A 45 45 ALA C C 45 175.721 176.999 -1.278 1
1 476 . 19 1 1 A 45 45 ALA CA C 45 50.372 52.447 -2.075 1
1 477 . 19 1 1 A 45 45 ALA CB C 45 15.732 19.005 -3.273 1
1 478 . 19 1 1 A 45 45 ALA N N 45 126.463 122.852 3.611 1
1 479 . 19 1 1 A 46 46 ALA H H 46 8.282 8.024 0.258 1
1 480 . 19 1 1 A 46 46 ALA HA H 46 3.922 3.816 0.106 1
1 484 . 19 1 1 A 46 46 ALA C C 46 176.236 178.214 -1.978 1
1 485 . 19 1 1 A 46 46 ALA CA C 46 50.773 53.767 -2.994 1
1 486 . 19 1 1 A 46 46 ALA CB C 46 16.244 18.195 -1.951 1
1 487 . 19 1 1 A 46 46 ALA N N 46 126.301 126.244 0.057 1
1 488 . 19 1 1 A 47 47 GLY HA2 H 47 3.882 3.924 -0.042 1
1 489 . 19 1 1 A 47 47 GLY HA3 H 47 3.695 3.950 -0.255 1
1 490 . 19 1 1 A 47 47 GLY C C 47 171.795 174.553 -2.758 1
1 491 . 19 1 1 A 47 47 GLY CA C 47 43.327 45.014 -1.687 1
1 492 . 19 1 1 A 48 48 THR H H 48 7.145 7.419 -0.274 1
1 493 . 19 1 1 A 48 48 THR HA H 48 4.417 4.129 0.288 1
1 498 . 19 1 1 A 48 48 THR C C 48 171.325 174.062 -2.737 1
1 499 . 19 1 1 A 48 48 THR CA C 48 58.271 63.034 -4.763 1
1 500 . 19 1 1 A 48 48 THR CB C 48 68.846 69.131 -0.285 1
1 502 . 19 1 1 A 48 48 THR N N 48 110.190 115.258 -5.068 1
1 503 . 19 1 1 A 49 49 GLU H H 49 8.346 8.736 -0.390 1
1 504 . 19 1 1 A 49 49 GLU HA H 49 4.277 4.450 -0.173 1
1 509 . 19 1 1 A 49 49 GLU C C 49 174.109 175.087 -0.978 1
1 510 . 19 1 1 A 49 49 GLU CA C 49 52.909 55.419 -2.510 1
1 511 . 19 1 1 A 49 49 GLU CB C 49 27.845 28.134 -0.289 1
1 513 . 19 1 1 A 49 49 GLU N N 49 119.985 127.704 -7.719 1
1 514 . 19 1 1 A 50 50 GLY H H 50 7.617 7.959 -0.342 1
1 515 . 19 1 1 A 50 50 GLY HA2 H 50 3.935 4.161 -0.226 1
1 516 . 19 1 1 A 50 50 GLY HA3 H 50 3.935 4.215 -0.280 1
1 517 . 19 1 1 A 50 50 GLY C C 50 168.223 171.669 -3.446 1
1 518 . 19 1 1 A 50 50 GLY CA C 50 42.121 44.403 -2.282 1
1 519 . 19 1 1 A 50 50 GLY N N 50 108.670 113.282 -4.612 1
1 520 . 19 1 1 A 51 51 PRO HA H 51 4.298 4.663 -0.365 1
1 527 . 19 1 1 A 51 51 PRO C C 51 175.067 176.907 -1.840 1
1 528 . 19 1 1 A 51 51 PRO CA C 51 60.175 62.802 -2.627 1
1 529 . 19 1 1 A 51 51 PRO CB C 51 30.052 32.462 -2.410 1
1 532 . 19 1 1 A 52 52 PHE H H 52 8.442 8.671 -0.229 1
1 533 . 19 1 1 A 52 52 PHE HA H 52 3.981 4.723 -0.742 1
1 541 . 19 1 1 A 52 52 PHE C C 52 175.141 175.963 -0.822 1
1 542 . 19 1 1 A 52 52 PHE CA C 52 56.808 57.658 -0.850 1
1 543 . 19 1 1 A 52 52 PHE CB C 52 36.830 40.072 -3.242 1
1 549 . 19 1 1 A 52 52 PHE N N 52 118.707 121.189 -2.482 1
1 550 . 19 1 1 A 53 53 GLN H H 53 8.778 8.403 0.375 1
1 551 . 19 1 1 A 53 53 GLN HA H 53 4.149 4.761 -0.612 1
1 558 . 19 1 1 A 53 53 GLN C C 53 172.773 174.872 -2.099 1
1 559 . 19 1 1 A 53 53 GLN CA C 53 52.999 55.186 -2.187 1
1 560 . 19 1 1 A 53 53 GLN CB C 53 26.962 30.625 -3.663 1
1 562 . 19 1 1 A 53 53 GLN N N 53 122.164 120.017 2.147 1
1 564 . 19 1 1 A 54 54 GLU H H 54 8.432 8.794 -0.362 1
1 565 . 19 1 1 A 54 54 GLU HA H 54 5.533 5.255 0.278 1
1 570 . 19 1 1 A 54 54 GLU C C 54 173.930 174.783 -0.853 1
1 571 . 19 1 1 A 54 54 GLU CA C 54 52.981 55.061 -2.080 1
1 572 . 19 1 1 A 54 54 GLU CB C 54 31.712 33.312 -1.600 1
1 574 . 19 1 1 A 54 54 GLU N N 54 119.688 123.107 -3.419 1
1 575 . 19 1 1 A 55 55 VAL H H 55 9.077 8.622 0.455 1
1 576 . 19 1 1 A 55 55 VAL HA H 55 4.180 4.855 -0.675 1
1 584 . 19 1 1 A 55 55 VAL C C 55 171.811 174.634 -2.823 1
1 585 . 19 1 1 A 55 55 VAL CA C 55 59.664 61.057 -1.393 1
1 586 . 19 1 1 A 55 55 VAL CB C 55 31.827 34.751 -2.924 1
1 589 . 19 1 1 A 55 55 VAL N N 55 125.328 126.017 -0.689 1
1 590 . 19 1 1 A 56 56 ASP H H 56 8.639 8.853 -0.214 1
1 591 . 19 1 1 A 56 56 ASP HA H 56 5.250 5.592 -0.342 1
1 594 . 19 1 1 A 56 56 ASP C C 56 174.252 176.182 -1.930 1
1 595 . 19 1 1 A 56 56 ASP CA C 56 50.108 52.463 -2.355 1
1 596 . 19 1 1 A 56 56 ASP CB C 56 41.407 44.187 -2.780 1
1 597 . 19 1 1 A 56 56 ASP N N 56 125.773 125.405 0.368 1
1 598 . 19 1 1 A 57 57 GLY H H 57 7.222 8.775 -1.553 1
1 599 . 19 1 1 A 57 57 GLY HA2 H 57 3.479 3.923 -0.444 1
1 600 . 19 1 1 A 57 57 GLY HA3 H 57 2.719 3.967 -1.248 1
1 601 . 19 1 1 A 57 57 GLY C C 57 172.281 174.487 -2.206 1
1 602 . 19 1 1 A 57 57 GLY CA C 57 43.919 45.724 -1.805 1
1 603 . 19 1 1 A 57 57 GLY N N 57 105.564 110.967 -5.403 1
1 604 . 19 1 1 A 58 58 VAL H H 58 8.338 8.110 0.228 1
1 605 . 19 1 1 A 58 58 VAL HA H 58 3.860 4.373 -0.513 1
1 613 . 19 1 1 A 58 58 VAL C C 58 173.981 175.385 -1.404 1
1 614 . 19 1 1 A 58 58 VAL CA C 58 61.233 61.601 -0.368 1
1 615 . 19 1 1 A 58 58 VAL CB C 58 29.708 32.352 -2.644 1
1 618 . 19 1 1 A 58 58 VAL N N 58 121.466 121.024 0.442 1
1 619 . 19 1 1 A 59 59 ALA H H 59 9.038 8.769 0.269 1
1 620 . 19 1 1 A 59 59 ALA HA H 59 4.676 4.597 0.079 1
1 624 . 19 1 1 A 59 59 ALA C C 59 175.105 176.742 -1.637 1
1 625 . 19 1 1 A 59 59 ALA CA C 59 50.866 52.224 -1.358 1
1 626 . 19 1 1 A 59 59 ALA CB C 59 17.647 19.166 -1.519 1
1 627 . 19 1 1 A 59 59 ALA N N 59 130.928 130.333 0.595 1
1 628 . 19 1 1 A 60 60 THR H H 60 7.445 7.732 -0.287 1
1 629 . 19 1 1 A 60 60 THR HA H 60 4.642 4.628 0.014 1
1 634 . 19 1 1 A 60 60 THR C C 60 169.528 174.087 -4.559 1
1 635 . 19 1 1 A 60 60 THR CA C 60 57.101 59.290 -2.189 1
1 636 . 19 1 1 A 60 60 THR CB C 60 67.982 72.296 -4.314 1
1 638 . 19 1 1 A 60 60 THR N N 60 109.256 109.379 -0.123 1
1 639 . 19 1 1 A 61 61 THR H H 61 7.325 8.261 -0.936 1
1 640 . 19 1 1 A 61 61 THR HA H 61 2.896 3.302 -0.406 1
1 645 . 19 1 1 A 61 61 THR C C 61 169.678 172.775 -3.097 1
1 646 . 19 1 1 A 61 61 THR CA C 61 57.246 61.632 -4.386 1
1 647 . 19 1 1 A 61 61 THR CB C 61 63.794 68.660 -4.866 1
1 649 . 19 1 1 A 61 61 THR N N 61 105.670 110.879 -5.209 1
1 650 . 19 1 1 A 62 62 ARG H H 62 6.490 7.232 -0.742 1
1 651 . 19 1 1 A 62 62 ARG HA H 62 4.698 4.840 -0.142 1
1 658 . 19 1 1 A 62 62 ARG C C 62 172.881 174.254 -1.373 1
1 659 . 19 1 1 A 62 62 ARG CA C 62 52.276 54.328 -2.052 1
1 660 . 19 1 1 A 62 62 ARG CB C 62 30.774 32.690 -1.916 1
1 663 . 19 1 1 A 62 62 ARG N N 62 117.485 122.195 -4.710 1
1 664 . 19 1 1 A 63 63 TYR H H 63 8.891 8.835 0.056 1
1 665 . 19 1 1 A 63 63 TYR HA H 63 4.356 5.370 -1.014 1
1 672 . 19 1 1 A 63 63 TYR C C 63 170.393 173.846 -3.453 1
1 673 . 19 1 1 A 63 63 TYR CA C 63 57.284 56.889 0.395 1
1 674 . 19 1 1 A 63 63 TYR CB C 63 41.467 42.555 -1.088 1
1 679 . 19 1 1 A 63 63 TYR N N 63 124.712 127.478 -2.766 1
1 680 . 19 1 1 A 64 64 SER H H 64 7.244 8.563 -1.319 1
1 681 . 19 1 1 A 64 64 SER HA H 64 5.077 5.793 -0.716 1
1 684 . 19 1 1 A 64 64 SER C C 64 169.712 173.571 -3.859 1
1 685 . 19 1 1 A 64 64 SER CA C 64 54.181 55.490 -1.309 1
1 686 . 19 1 1 A 64 64 SER CB C 64 61.122 65.722 -4.600 1
1 687 . 19 1 1 A 64 64 SER N N 64 120.593 121.546 -0.953 1
1 688 . 19 1 1 A 65 65 ILE H H 65 8.686 9.068 -0.382 1
1 689 . 19 1 1 A 65 65 ILE HA H 65 3.937 4.885 -0.948 1
1 699 . 19 1 1 A 65 65 ILE C C 65 172.217 175.244 -3.027 1
1 700 . 19 1 1 A 65 65 ILE CA C 65 58.288 59.675 -1.387 1
1 701 . 19 1 1 A 65 65 ILE CB C 65 36.110 40.151 -4.041 1
1 705 . 19 1 1 A 65 65 ILE N N 65 127.792 124.417 3.375 1
1 706 . 19 1 1 A 66 66 GLY H H 66 7.883 8.616 -0.733 1
1 707 . 19 1 1 A 66 66 GLY HA2 H 66 4.799 4.201 0.598 1
1 708 . 19 1 1 A 66 66 GLY HA3 H 66 3.468 4.208 -0.740 1
1 709 . 19 1 1 A 66 66 GLY C C 66 171.983 174.164 -2.181 1
1 710 . 19 1 1 A 66 66 GLY CA C 66 40.534 44.587 -4.053 1
1 711 . 19 1 1 A 66 66 GLY N N 66 112.632 114.748 -2.116 1
1 712 . 19 1 1 A 67 67 GLY H H 67 8.483 8.467 0.016 1
1 713 . 19 1 1 A 67 67 GLY HA2 H 67 3.836 3.929 -0.093 1
1 714 . 19 1 1 A 67 67 GLY HA3 H 67 3.682 3.953 -0.271 1
1 715 . 19 1 1 A 67 67 GLY C C 67 172.954 174.463 -1.509 1
1 716 . 19 1 1 A 67 67 GLY CA C 67 43.568 46.353 -2.785 1
1 717 . 19 1 1 A 67 67 GLY N N 67 104.625 108.956 -4.331 1
1 718 . 19 1 1 A 68 68 LEU H H 68 8.236 7.611 0.625 1
1 719 . 19 1 1 A 68 68 LEU HA H 68 4.154 4.711 -0.557 1
1 729 . 19 1 1 A 68 68 LEU C C 68 173.838 175.606 -1.768 1
1 730 . 19 1 1 A 68 68 LEU CA C 68 51.025 53.269 -2.244 1
1 731 . 19 1 1 A 68 68 LEU CB C 68 38.837 43.297 -4.460 1
1 735 . 19 1 1 A 68 68 LEU N N 68 118.919 121.513 -2.594 1
1 736 . 19 1 1 A 69 69 SER H H 69 8.284 8.789 -0.505 1
1 737 . 19 1 1 A 69 69 SER HA H 69 4.765 5.029 -0.264 1
1 740 . 19 1 1 A 69 69 SER C C 69 170.044 173.030 -2.986 1
1 741 . 19 1 1 A 69 69 SER CA C 69 54.639 55.087 -0.448 1
1 742 . 19 1 1 A 69 69 SER CB C 69 61.216 63.899 -2.683 1
1 743 . 19 1 1 A 69 69 SER N N 69 116.361 117.030 -0.669 1
1 744 . 19 1 1 A 70 70 PRO HA H 70 5.141 4.684 0.457 1
1 751 . 19 1 1 A 70 70 PRO C C 70 174.858 177.500 -2.642 1
1 752 . 19 1 1 A 70 70 PRO CA C 70 60.810 63.981 -3.171 1
1 753 . 19 1 1 A 70 70 PRO CB C 70 30.657 32.054 -1.397 1
1 756 . 19 1 1 A 71 71 PHE H H 71 8.139 9.091 -0.952 1
1 757 . 19 1 1 A 71 71 PHE HA H 71 4.202 4.286 -0.084 1
1 765 . 19 1 1 A 71 71 PHE C C 71 172.870 174.474 -1.604 1
1 766 . 19 1 1 A 71 71 PHE CA C 71 55.410 59.217 -3.807 1
1 767 . 19 1 1 A 71 71 PHE CB C 71 36.027 37.655 -1.628 1
1 773 . 19 1 1 A 71 71 PHE N N 71 125.409 122.830 2.579 1
1 774 . 19 1 1 A 72 72 SER H H 72 8.182 7.534 0.648 1
1 775 . 19 1 1 A 72 72 SER HA H 72 4.755 5.053 -0.298 1
1 778 . 19 1 1 A 72 72 SER C C 72 168.850 173.084 -4.234 1
1 779 . 19 1 1 A 72 72 SER CA C 72 55.926 56.381 -0.455 1
1 780 . 19 1 1 A 72 72 SER CB C 72 64.208 66.355 -2.147 1
1 781 . 19 1 1 A 72 72 SER N N 72 113.509 110.735 2.774 1
1 782 . 19 1 1 A 73 73 GLU H H 73 8.422 8.763 -0.341 1
1 783 . 19 1 1 A 73 73 GLU HA H 73 4.966 5.362 -0.396 1
1 788 . 19 1 1 A 73 73 GLU C C 73 173.192 174.677 -1.485 1
1 789 . 19 1 1 A 73 73 GLU CA C 73 52.815 54.889 -2.074 1
1 790 . 19 1 1 A 73 73 GLU CB C 73 29.416 33.349 -3.933 1
1 792 . 19 1 1 A 73 73 GLU N N 73 123.046 121.999 1.047 1
1 793 . 19 1 1 A 74 74 TYR H H 74 9.205 8.683 0.522 1
1 794 . 19 1 1 A 74 74 TYR HA H 74 4.799 4.955 -0.156 1
1 801 . 19 1 1 A 74 74 TYR C C 74 170.775 174.285 -3.510 1
1 802 . 19 1 1 A 74 74 TYR CA C 74 55.291 56.441 -1.150 1
1 803 . 19 1 1 A 74 74 TYR CB C 74 42.943 42.391 0.552 1
1 808 . 19 1 1 A 74 74 TYR N N 74 125.351 123.970 1.381 1
1 809 . 19 1 1 A 75 75 ALA H H 75 8.639 8.189 0.450 1
1 810 . 19 1 1 A 75 75 ALA HA H 75 5.271 5.377 -0.106 1
1 814 . 19 1 1 A 75 75 ALA C C 75 173.698 176.096 -2.398 1
1 815 . 19 1 1 A 75 75 ALA CA C 75 47.904 50.282 -2.378 1
1 816 . 19 1 1 A 75 75 ALA CB C 75 19.634 20.741 -1.107 1
1 817 . 19 1 1 A 75 75 ALA N N 75 121.555 124.251 -2.696 1
1 818 . 19 1 1 A 76 76 PHE H H 76 9.066 9.253 -0.187 1
1 819 . 19 1 1 A 76 76 PHE HA H 76 5.496 5.365 0.131 1
1 827 . 19 1 1 A 76 76 PHE C C 76 172.268 175.286 -3.018 1
1 828 . 19 1 1 A 76 76 PHE CA C 76 54.216 56.853 -2.637 1
1 829 . 19 1 1 A 76 76 PHE CB C 76 41.901 41.561 0.340 1
1 835 . 19 1 1 A 76 76 PHE N N 76 116.545 123.025 -6.480 1
1 836 . 19 1 1 A 77 77 ARG H H 77 9.216 8.695 0.521 1
1 837 . 19 1 1 A 77 77 ARG HA H 77 4.357 5.146 -0.789 1
1 845 . 19 1 1 A 77 77 ARG C C 77 169.998 173.886 -3.888 1
1 846 . 19 1 1 A 77 77 ARG CA C 77 52.414 54.976 -2.562 1
1 847 . 19 1 1 A 77 77 ARG CB C 77 30.794 33.938 -3.144 1
1 850 . 19 1 1 A 77 77 ARG N N 77 115.738 119.079 -3.341 1
1 852 . 19 1 1 A 78 78 VAL H H 78 8.135 8.631 -0.496 1
1 853 . 19 1 1 A 78 78 VAL HA H 78 4.884 4.844 0.040 1
1 861 . 19 1 1 A 78 78 VAL C C 78 171.098 174.324 -3.226 1
1 862 . 19 1 1 A 78 78 VAL CA C 78 57.566 60.481 -2.915 1
1 863 . 19 1 1 A 78 78 VAL CB C 78 33.146 33.453 -0.307 1
1 866 . 19 1 1 A 78 78 VAL N N 78 117.942 123.027 -5.085 1
1 867 . 19 1 1 A 79 79 LEU H H 79 9.167 8.169 0.998 1
1 868 . 19 1 1 A 79 79 LEU HA H 79 4.575 4.971 -0.396 1
1 878 . 19 1 1 A 79 79 LEU C C 79 171.447 174.990 -3.543 1
1 879 . 19 1 1 A 79 79 LEU CA C 79 51.642 53.542 -1.900 1
1 880 . 19 1 1 A 79 79 LEU CB C 79 42.776 45.751 -2.975 1
1 884 . 19 1 1 A 79 79 LEU N N 79 123.913 119.760 4.153 1
1 885 . 19 1 1 A 80 80 ALA H H 80 9.325 8.592 0.733 1
1 886 . 19 1 1 A 80 80 ALA HA H 80 4.654 3.873 0.781 1
1 890 . 19 1 1 A 80 80 ALA C C 80 172.070 177.063 -4.993 1
1 891 . 19 1 1 A 80 80 ALA CA C 80 48.169 51.578 -3.409 1
1 892 . 19 1 1 A 80 80 ALA CB C 80 20.366 19.446 0.920 1
1 893 . 19 1 1 A 80 80 ALA N N 80 124.135 122.974 1.161 1
1 894 . 19 1 1 A 81 81 VAL H H 81 7.953 7.766 0.187 1
1 895 . 19 1 1 A 81 81 VAL HA H 81 4.293 4.789 -0.496 1
1 903 . 19 1 1 A 81 81 VAL C C 81 172.873 174.788 -1.915 1
1 904 . 19 1 1 A 81 81 VAL CA C 81 58.959 60.693 -1.734 1
1 905 . 19 1 1 A 81 81 VAL CB C 81 31.412 34.434 -3.022 1
1 908 . 19 1 1 A 81 81 VAL N N 81 118.503 121.128 -2.625 1
1 909 . 19 1 1 A 82 82 ASN H H 82 8.262 8.323 -0.061 1
1 910 . 19 1 1 A 82 82 ASN HA H 82 4.945 5.065 -0.120 1
1 915 . 19 1 1 A 82 82 ASN C C 82 173.273 175.628 -2.355 1
1 916 . 19 1 1 A 82 82 ASN CA C 82 48.714 51.318 -2.604 1
1 917 . 19 1 1 A 82 82 ASN CB C 82 36.796 40.412 -3.616 1
1 918 . 19 1 1 A 82 82 ASN N N 82 125.425 124.741 0.684 1
1 920 . 19 1 1 A 83 83 SER HA H 83 3.966 4.155 -0.189 1
1 923 . 19 1 1 A 83 83 SER C C 83 172.812 176.883 -4.071 1
1 924 . 19 1 1 A 83 83 SER CA C 83 59.047 61.565 -2.518 1
1 925 . 19 1 1 A 83 83 SER CB C 83 60.406 62.771 -2.365 1
1 926 . 19 1 1 A 84 84 ILE H H 84 7.803 7.954 -0.151 1
1 927 . 19 1 1 A 84 84 ILE HA H 84 3.862 3.778 0.084 1
1 937 . 19 1 1 A 84 84 ILE C C 84 174.481 176.218 -1.737 1
1 938 . 19 1 1 A 84 84 ILE CA C 84 59.188 64.365 -5.177 1
1 939 . 19 1 1 A 84 84 ILE CB C 84 34.677 38.259 -3.582 1
1 943 . 19 1 1 A 84 84 ILE N N 84 121.222 119.798 1.424 1
1 944 . 19 1 1 A 85 85 GLY H H 85 7.435 7.286 0.149 1
1 945 . 19 1 1 A 85 85 GLY HA2 H 85 4.149 4.051 0.098 1
1 946 . 19 1 1 A 85 85 GLY HA3 H 85 3.747 4.057 -0.310 1
1 947 . 19 1 1 A 85 85 GLY C C 85 168.589 172.045 -3.456 1
1 948 . 19 1 1 A 85 85 GLY CA C 85 42.931 45.374 -2.443 1
1 949 . 19 1 1 A 85 85 GLY N N 85 106.320 105.581 0.739 1
1 950 . 19 1 1 A 86 86 ARG H H 86 8.190 8.405 -0.215 1
1 951 . 19 1 1 A 86 86 ARG HA H 86 4.452 4.835 -0.383 1
1 958 . 19 1 1 A 86 86 ARG C C 86 175.286 176.201 -0.915 1
1 959 . 19 1 1 A 86 86 ARG CA C 86 53.223 55.232 -2.009 1
1 960 . 19 1 1 A 86 86 ARG CB C 86 29.517 30.954 -1.437 1
1 963 . 19 1 1 A 86 86 ARG N N 86 118.339 117.290 1.049 1
1 964 . 19 1 1 A 87 87 GLY H H 87 8.900 8.732 0.168 1
1 965 . 19 1 1 A 87 87 GLY HA2 H 87 4.211 4.001 0.210 1
1 966 . 19 1 1 A 87 87 GLY HA3 H 87 3.967 4.012 -0.045 1
1 967 . 19 1 1 A 87 87 GLY C C 87 168.101 172.714 -4.613 1
1 968 . 19 1 1 A 87 87 GLY CA C 87 42.281 44.106 -1.825 1
1 969 . 19 1 1 A 87 87 GLY N N 87 113.482 109.255 4.227 1
1 970 . 19 1 1 A 88 88 PRO HA H 88 4.563 4.569 -0.006 1
1 977 . 19 1 1 A 88 88 PRO CA C 88 60.994 62.087 -1.093 1
1 978 . 19 1 1 A 88 88 PRO CB C 88 29.873 31.705 -1.832 1
1 981 . 19 1 1 A 89 89 PRO HA H 89 4.490 4.451 0.039 1
1 987 . 19 1 1 A 89 89 PRO C C 89 174.543 176.106 -1.563 1
1 988 . 19 1 1 A 89 89 PRO CA C 89 59.435 62.401 -2.966 1
1 989 . 19 1 1 A 89 89 PRO CB C 89 29.805 31.852 -2.047 1
1 992 . 19 1 1 A 90 90 SER H H 90 8.808 8.308 0.500 1
1 993 . 19 1 1 A 90 90 SER HA H 90 4.202 4.635 -0.433 1
1 996 . 19 1 1 A 90 90 SER C C 90 171.870 173.989 -2.119 1
1 997 . 19 1 1 A 90 90 SER CA C 90 55.868 57.310 -1.442 1
1 998 . 19 1 1 A 90 90 SER CB C 90 64.504 64.427 0.077 1
1 999 . 19 1 1 A 90 90 SER N N 90 113.781 116.834 -3.053 1
1 1000 . 19 1 1 A 91 91 GLU H H 91 8.291 8.567 -0.276 1
1 1001 . 19 1 1 A 91 91 GLU HA H 91 4.131 4.173 -0.042 1
1 1006 . 19 1 1 A 91 91 GLU C C 91 174.882 176.421 -1.539 1
1 1007 . 19 1 1 A 91 91 GLU CA C 91 54.984 56.572 -1.588 1
1 1008 . 19 1 1 A 91 91 GLU CB C 91 27.643 29.107 -1.464 1
1 1010 . 19 1 1 A 91 91 GLU N N 91 117.930 123.625 -5.695 1
1 1011 . 19 1 1 A 92 92 ALA H H 92 8.605 8.272 0.333 1
1 1012 . 19 1 1 A 92 92 ALA HA H 92 5.068 4.384 0.684 1
1 1016 . 19 1 1 A 92 92 ALA C C 92 176.227 177.890 -1.663 1
1 1017 . 19 1 1 A 92 92 ALA CA C 92 48.997 53.028 -4.031 1
1 1018 . 19 1 1 A 92 92 ALA CB C 92 17.756 19.177 -1.421 1
1 1019 . 19 1 1 A 92 92 ALA N N 92 126.421 127.593 -1.172 1
1 1020 . 19 1 1 A 93 93 VAL H H 93 9.051 9.241 -0.190 1
1 1021 . 19 1 1 A 93 93 VAL HA H 93 4.642 4.988 -0.346 1
1 1029 . 19 1 1 A 93 93 VAL C C 93 172.010 174.428 -2.418 1
1 1030 . 19 1 1 A 93 93 VAL CA C 93 57.495 59.393 -1.898 1
1 1031 . 19 1 1 A 93 93 VAL CB C 93 32.774 34.070 -1.296 1
1 1034 . 19 1 1 A 93 93 VAL N N 93 117.322 117.888 -0.566 1
1 1035 . 19 1 1 A 94 94 ARG H H 94 8.470 8.854 -0.384 1
1 1036 . 19 1 1 A 94 94 ARG HA H 94 5.692 5.141 0.551 1
1 1043 . 19 1 1 A 94 94 ARG C C 94 173.635 175.210 -1.575 1
1 1044 . 19 1 1 A 94 94 ARG CA C 94 52.038 54.631 -2.593 1
1 1045 . 19 1 1 A 94 94 ARG CB C 94 30.966 31.987 -1.021 1
1 1048 . 19 1 1 A 94 94 ARG N N 94 122.258 122.936 -0.678 1
1 1049 . 19 1 1 A 95 95 ALA H H 95 9.051 8.779 0.272 1
1 1050 . 19 1 1 A 95 95 ALA HA H 95 4.642 5.224 -0.582 1
1 1054 . 19 1 1 A 95 95 ALA C C 95 172.285 175.225 -2.940 1
1 1055 . 19 1 1 A 95 95 ALA CA C 95 49.191 50.910 -1.719 1
1 1056 . 19 1 1 A 95 95 ALA CB C 95 22.562 22.275 0.287 1
1 1057 . 19 1 1 A 95 95 ALA N N 95 121.931 126.339 -4.408 1
1 1058 . 19 1 1 A 96 96 ARG H H 96 8.550 8.622 -0.072 1
1 1059 . 19 1 1 A 96 96 ARG HA H 96 5.407 5.109 0.298 1
1 1066 . 19 1 1 A 96 96 ARG C C 96 174.547 176.113 -1.566 1
1 1067 . 19 1 1 A 96 96 ARG CA C 96 51.439 55.314 -3.875 1
1 1068 . 19 1 1 A 96 96 ARG CB C 96 30.708 31.659 -0.951 1
1 1071 . 19 1 1 A 96 96 ARG N N 96 121.155 124.643 -3.488 1
1 1072 . 19 1 1 A 97 97 THR H H 97 8.797 8.780 0.017 1
1 1073 . 19 1 1 A 97 97 THR HA H 97 4.116 4.544 -0.428 1
1 1078 . 19 1 1 A 97 97 THR C C 97 173.577 174.985 -1.408 1
1 1079 . 19 1 1 A 97 97 THR CA C 97 58.800 61.368 -2.568 1
1 1080 . 19 1 1 A 97 97 THR CB C 97 67.461 69.787 -2.326 1
1 1082 . 19 1 1 A 97 97 THR N N 97 114.657 117.296 -2.639 1
1 1083 . 19 1 1 A 98 98 GLY H H 98 7.505 8.458 -0.953 1
1 1084 . 19 1 1 A 98 98 GLY HA2 H 98 3.866 4.142 -0.276 1
1 1085 . 19 1 1 A 98 98 GLY HA3 H 98 3.743 4.185 -0.442 1
1 1086 . 19 1 1 A 98 98 GLY C C 98 170.637 172.853 -2.216 1
1 1087 . 19 1 1 A 98 98 GLY CA C 98 42.332 44.428 -2.096 1
1 1088 . 19 1 1 A 98 98 GLY N N 98 106.172 107.945 -1.773 1
1 1089 . 19 1 1 A 99 99 GLU H H 99 8.145 8.693 -0.548 1
1 1090 . 19 1 1 A 99 99 GLU HA H 99 4.210 5.224 -1.014 1
1 1095 . 19 1 1 A 99 99 GLU C C 99 174.134 175.127 -0.993 1
1 1096 . 19 1 1 A 99 99 GLU CA C 99 53.828 55.340 -1.512 1
1 1097 . 19 1 1 A 99 99 GLU CB C 99 28.774 32.600 -3.826 1
1 1099 . 19 1 1 A 99 99 GLU N N 99 117.634 116.734 0.900 1
1 1100 . 19 1 1 A 100 100 GLN H H 100 8.647 8.872 -0.225 1
1 1101 . 19 1 1 A 100 100 GLN HA H 100 4.247 4.530 -0.283 1
1 1108 . 19 1 1 A 100 100 GLN C C 100 173.348 175.000 -1.652 1
1 1109 . 19 1 1 A 100 100 GLN CA C 100 53.634 55.723 -2.089 1
1 1110 . 19 1 1 A 100 100 GLN CB C 100 27.392 31.137 -3.745 1
1 1112 . 19 1 1 A 100 100 GLN N N 100 121.960 122.079 -0.119 1
1 1114 . 19 1 1 A 101 101 SER H H 101 8.416 9.196 -0.780 1
1 1115 . 19 1 1 A 101 101 SER HA H 101 4.418 4.078 0.340 1
1 1117 . 19 1 1 A 101 101 SER C C 101 172.148 174.177 -2.029 1
1 1118 . 19 1 1 A 101 101 SER CA C 101 55.926 58.962 -3.036 1
1 1119 . 19 1 1 A 101 101 SER CB C 101 61.617 61.651 -0.034 1
1 1120 . 19 1 1 A 101 101 SER N N 101 118.609 122.062 -3.453 1
1 1121 . 19 1 1 A 102 102 GLY H H 102 8.233 8.070 0.163 1
1 1122 . 19 1 1 A 102 102 GLY HA2 H 102 4.080 4.025 0.055 1
1 1123 . 19 1 1 A 102 102 GLY HA3 H 102 3.981 4.042 -0.061 1
1 1124 . 19 1 1 A 102 102 GLY C C 102 169.461 173.005 -3.544 1
1 1125 . 19 1 1 A 102 102 GLY CA C 102 42.332 44.665 -2.333 1
1 1126 . 19 1 1 A 102 102 GLY N N 102 110.483 108.941 1.542 1
1 1127 . 19 1 1 A 103 103 PRO HA H 103 4.618 4.700 -0.082 1
1 1134 . 19 1 1 A 103 103 PRO CA C 103 57.843 62.679 -4.836 1
1 1135 . 19 1 1 A 103 103 PRO CB C 103 28.671 30.371 -1.700 1
1 1 . 20 1 1 A 6 6 SER HA H 6 4.492 5.023 -0.531 1
1 4 . 20 1 1 A 6 6 SER CA C 6 55.621 57.093 -1.472 1
1 5 . 20 1 1 A 6 6 SER CB C 6 62.104 64.738 -2.634 1
1 6 . 20 1 1 A 7 7 GLY H H 7 8.244 8.229 0.015 1
1 7 . 20 1 1 A 7 7 GLY HA2 H 7 3.873 4.037 -0.164 1
1 8 . 20 1 1 A 7 7 GLY HA3 H 7 3.737 4.044 -0.307 1
1 9 . 20 1 1 A 7 7 GLY CA C 7 41.743 44.240 -2.497 1
1 10 . 20 1 1 A 7 7 GLY N N 7 109.193 111.890 -2.697 1
1 11 . 20 1 1 A 8 8 PRO HA H 8 4.286 4.576 -0.290 1
1 18 . 20 1 1 A 8 8 PRO C C 8 173.841 175.659 -1.818 1
1 19 . 20 1 1 A 8 8 PRO CA C 8 60.528 62.526 -1.998 1
1 20 . 20 1 1 A 8 8 PRO CB C 8 30.299 33.013 -2.714 1
1 23 . 20 1 1 A 9 9 LYS H H 9 8.877 8.393 0.484 1
1 24 . 20 1 1 A 9 9 LYS HA H 9 4.360 4.804 -0.444 1
1 33 . 20 1 1 A 9 9 LYS C C 9 173.492 174.457 -0.965 1
1 34 . 20 1 1 A 9 9 LYS CA C 9 52.135 53.317 -1.182 1
1 35 . 20 1 1 A 9 9 LYS CB C 9 28.798 32.196 -3.398 1
1 39 . 20 1 1 A 9 9 LYS N N 9 120.404 120.705 -0.301 1
1 40 . 20 1 1 A 10 10 PRO HA H 10 4.284 4.644 -0.360 1
1 47 . 20 1 1 A 10 10 PRO CA C 10 59.326 61.630 -2.304 1
1 48 . 20 1 1 A 10 10 PRO CB C 10 28.825 31.587 -2.762 1
1 51 . 20 1 1 A 11 11 PRO HA H 11 4.468 4.892 -0.424 1
1 58 . 20 1 1 A 11 11 PRO C C 11 171.993 176.306 -4.313 1
1 59 . 20 1 1 A 11 11 PRO CA C 11 60.422 62.736 -2.314 1
1 60 . 20 1 1 A 11 11 PRO CB C 11 30.418 32.480 -2.062 1
1 63 . 20 1 1 A 12 12 ILE H H 12 7.554 8.219 -0.665 1
1 64 . 20 1 1 A 12 12 ILE HA H 12 4.676 4.661 0.015 1
1 74 . 20 1 1 A 12 12 ILE C C 12 171.721 175.135 -3.414 1
1 75 . 20 1 1 A 12 12 ILE CA C 12 56.843 58.853 -2.010 1
1 76 . 20 1 1 A 12 12 ILE CB C 12 40.560 40.803 -0.243 1
1 80 . 20 1 1 A 12 12 ILE N N 12 109.695 117.194 -7.499 1
1 81 . 20 1 1 A 13 13 ASP H H 13 8.435 9.068 -0.633 1
1 82 . 20 1 1 A 13 13 ASP HA H 13 4.094 4.271 -0.177 1
1 85 . 20 1 1 A 13 13 ASP C C 13 171.803 176.209 -4.406 1
1 86 . 20 1 1 A 13 13 ASP CA C 13 52.610 55.080 -2.470 1
1 87 . 20 1 1 A 13 13 ASP CB C 13 36.357 40.133 -3.776 1
1 88 . 20 1 1 A 13 13 ASP N N 13 116.219 122.092 -5.873 1
1 89 . 20 1 1 A 14 14 LEU H H 14 7.483 7.983 -0.500 1
1 90 . 20 1 1 A 14 14 LEU HA H 14 4.990 4.953 0.037 1
1 100 . 20 1 1 A 14 14 LEU C C 14 174.702 175.302 -0.600 1
1 101 . 20 1 1 A 14 14 LEU CA C 14 53.811 55.172 -1.361 1
1 102 . 20 1 1 A 14 14 LEU CB C 14 40.148 42.072 -1.924 1
1 106 . 20 1 1 A 14 14 LEU N N 14 118.463 121.092 -2.629 1
1 107 . 20 1 1 A 15 15 VAL H H 15 9.209 8.553 0.656 1
1 108 . 20 1 1 A 15 15 VAL HA H 15 4.250 4.773 -0.523 1
1 116 . 20 1 1 A 15 15 VAL C C 15 172.080 173.417 -1.337 1
1 117 . 20 1 1 A 15 15 VAL CA C 15 58.570 60.447 -1.877 1
1 118 . 20 1 1 A 15 15 VAL CB C 15 34.146 36.044 -1.898 1
1 121 . 20 1 1 A 15 15 VAL N N 15 124.833 126.946 -2.113 1
1 122 . 20 1 1 A 16 16 VAL H H 16 8.390 8.654 -0.264 1
1 123 . 20 1 1 A 16 16 VAL HA H 16 4.343 5.099 -0.756 1
1 131 . 20 1 1 A 16 16 VAL C C 16 174.672 176.203 -1.531 1
1 132 . 20 1 1 A 16 16 VAL CA C 16 59.188 59.761 -0.573 1
1 133 . 20 1 1 A 16 16 VAL CB C 16 29.187 34.344 -5.157 1
1 136 . 20 1 1 A 16 16 VAL N N 16 124.654 125.063 -0.409 1
1 137 . 20 1 1 A 17 17 THR H H 17 8.638 8.257 0.381 1
1 138 . 20 1 1 A 17 17 THR HA H 17 4.195 4.325 -0.130 1
1 143 . 20 1 1 A 17 17 THR C C 17 172.661 173.846 -1.185 1
1 144 . 20 1 1 A 17 17 THR CA C 17 60.318 64.433 -4.115 1
1 145 . 20 1 1 A 17 17 THR CB C 17 66.420 70.254 -3.834 1
1 147 . 20 1 1 A 17 17 THR N N 17 120.942 123.201 -2.259 1
1 148 . 20 1 1 A 18 18 GLU H H 18 7.361 7.654 -0.293 1
1 149 . 20 1 1 A 18 18 GLU HA H 18 4.497 4.757 -0.260 1
1 154 . 20 1 1 A 18 18 GLU C C 18 171.691 175.087 -3.396 1
1 155 . 20 1 1 A 18 18 GLU CA C 18 53.687 54.923 -1.236 1
1 156 . 20 1 1 A 18 18 GLU CB C 18 30.802 33.342 -2.540 1
1 158 . 20 1 1 A 18 18 GLU N N 18 119.088 118.492 0.596 1
1 159 . 20 1 1 A 19 19 THR H H 19 8.164 8.681 -0.517 1
1 160 . 20 1 1 A 19 19 THR HA H 19 4.912 5.032 -0.120 1
1 165 . 20 1 1 A 19 19 THR C C 19 171.606 172.831 -1.225 1
1 166 . 20 1 1 A 19 19 THR CA C 19 58.473 60.672 -2.199 1
1 167 . 20 1 1 A 19 19 THR CB C 19 70.103 71.040 -0.937 1
1 169 . 20 1 1 A 19 19 THR N N 19 112.424 113.722 -1.298 1
1 170 . 20 1 1 A 20 20 THR H H 20 8.750 9.056 -0.306 1
1 171 . 20 1 1 A 20 20 THR HA H 20 4.710 4.795 -0.085 1
1 176 . 20 1 1 A 20 20 THR C C 20 172.785 175.979 -3.194 1
1 177 . 20 1 1 A 20 20 THR CA C 20 58.059 61.163 -3.104 1
1 178 . 20 1 1 A 20 20 THR CB C 20 68.782 71.081 -2.299 1
1 180 . 20 1 1 A 20 20 THR N N 20 113.438 121.441 -8.003 1
1 181 . 20 1 1 A 21 21 ALA H H 21 8.453 9.007 -0.554 1
1 182 . 20 1 1 A 21 21 ALA HA H 21 4.079 4.457 -0.378 1
1 186 . 20 1 1 A 21 21 ALA C C 21 174.130 177.809 -3.679 1
1 187 . 20 1 1 A 21 21 ALA CA C 21 52.680 54.938 -2.258 1
1 188 . 20 1 1 A 21 21 ALA CB C 21 16.893 18.509 -1.616 1
1 189 . 20 1 1 A 21 21 ALA N N 21 120.078 125.893 -5.815 1
1 190 . 20 1 1 A 22 22 THR H H 22 7.132 7.535 -0.403 1
1 191 . 20 1 1 A 22 22 THR HA H 22 4.433 4.742 -0.309 1
1 196 . 20 1 1 A 22 22 THR C C 22 171.434 173.420 -1.986 1
1 197 . 20 1 1 A 22 22 THR CA C 22 56.836 60.595 -3.759 1
1 198 . 20 1 1 A 22 22 THR CB C 22 68.772 69.525 -0.753 1
1 200 . 20 1 1 A 22 22 THR N N 22 95.772 104.057 -8.285 1
1 201 . 20 1 1 A 23 23 SER H H 23 7.326 7.726 -0.400 1
1 202 . 20 1 1 A 23 23 SER HA H 23 5.562 5.419 0.143 1
1 205 . 20 1 1 A 23 23 SER C C 23 169.267 172.135 -2.868 1
1 206 . 20 1 1 A 23 23 SER CA C 23 54.445 57.628 -3.183 1
1 207 . 20 1 1 A 23 23 SER CB C 23 65.905 67.487 -1.582 1
1 208 . 20 1 1 A 23 23 SER N N 23 115.757 116.077 -0.320 1
1 209 . 20 1 1 A 24 24 VAL H H 24 7.983 8.319 -0.336 1
1 210 . 20 1 1 A 24 24 VAL HA H 24 4.334 4.507 -0.173 1
1 218 . 20 1 1 A 24 24 VAL C C 24 171.917 173.553 -1.636 1
1 219 . 20 1 1 A 24 24 VAL CA C 24 58.642 60.324 -1.682 1
1 220 . 20 1 1 A 24 24 VAL CB C 24 34.254 34.980 -0.726 1
1 223 . 20 1 1 A 24 24 VAL N N 24 116.595 120.706 -4.111 1
1 224 . 20 1 1 A 25 25 THR H H 25 8.636 8.847 -0.211 1
1 225 . 20 1 1 A 25 25 THR HA H 25 4.833 4.857 -0.024 1
1 230 . 20 1 1 A 25 25 THR C C 25 169.721 172.825 -3.104 1
1 231 . 20 1 1 A 25 25 THR CA C 25 59.699 62.040 -2.341 1
1 232 . 20 1 1 A 25 25 THR CB C 25 67.303 69.760 -2.457 1
1 234 . 20 1 1 A 25 25 THR N N 25 121.690 122.920 -1.230 1
1 235 . 20 1 1 A 26 26 LEU H H 26 8.629 9.179 -0.550 1
1 236 . 20 1 1 A 26 26 LEU HA H 26 5.315 5.253 0.062 1
1 246 . 20 1 1 A 26 26 LEU C C 26 173.182 175.508 -2.326 1
1 247 . 20 1 1 A 26 26 LEU CA C 26 50.643 53.278 -2.635 1
1 248 . 20 1 1 A 26 26 LEU CB C 26 43.976 45.970 -1.994 1
1 252 . 20 1 1 A 26 26 LEU N N 26 126.843 130.054 -3.211 1
1 253 . 20 1 1 A 27 27 THR H H 27 8.704 9.239 -0.535 1
1 254 . 20 1 1 A 27 27 THR HA H 27 4.822 5.222 -0.400 1
1 259 . 20 1 1 A 27 27 THR C C 27 169.840 173.231 -3.391 1
1 260 . 20 1 1 A 27 27 THR CA C 27 58.077 59.568 -1.491 1
1 261 . 20 1 1 A 27 27 THR CB C 27 69.666 71.997 -2.331 1
1 263 . 20 1 1 A 27 27 THR N N 27 111.513 113.687 -2.174 1
1 264 . 20 1 1 A 28 28 TRP H H 28 7.339 8.095 -0.756 1
1 265 . 20 1 1 A 28 28 TRP HA H 28 4.963 5.375 -0.412 1
1 274 . 20 1 1 A 28 28 TRP C C 28 170.637 172.450 -1.813 1
1 275 . 20 1 1 A 28 28 TRP CA C 28 54.438 55.671 -1.233 1
1 276 . 20 1 1 A 28 28 TRP CB C 28 27.497 31.276 -3.779 1
1 282 . 20 1 1 A 28 28 TRP N N 28 117.895 118.885 -0.990 1
1 284 . 20 1 1 A 29 29 ASP H H 29 8.696 9.333 -0.637 1
1 285 . 20 1 1 A 29 29 ASP HA H 29 4.971 5.119 -0.148 1
1 288 . 20 1 1 A 29 29 ASP C C 29 174.901 176.931 -2.030 1
1 289 . 20 1 1 A 29 29 ASP CA C 29 50.178 52.466 -2.288 1
1 290 . 20 1 1 A 29 29 ASP CB C 29 42.291 43.280 -0.989 1
1 291 . 20 1 1 A 29 29 ASP N N 29 117.477 121.473 -3.996 1
1 292 . 20 1 1 A 30 30 SER H H 30 8.800 8.877 -0.077 1
1 293 . 20 1 1 A 30 30 SER HA H 30 4.389 4.113 0.276 1
1 296 . 20 1 1 A 30 30 SER C C 30 174.032 175.097 -1.065 1
1 297 . 20 1 1 A 30 30 SER CA C 30 58.694 62.039 -3.345 1
1 298 . 20 1 1 A 30 30 SER CB C 30 62.428 63.317 -0.889 1
1 299 . 20 1 1 A 30 30 SER N N 30 118.275 120.495 -2.220 1
1 300 . 20 1 1 A 31 31 GLY H H 31 8.759 7.875 0.884 1
1 301 . 20 1 1 A 31 31 GLY HA2 H 31 4.239 4.022 0.217 1
1 302 . 20 1 1 A 31 31 GLY HA3 H 31 3.555 4.054 -0.499 1
1 303 . 20 1 1 A 31 31 GLY C C 31 171.325 174.111 -2.786 1
1 304 . 20 1 1 A 31 31 GLY CA C 31 43.637 45.644 -2.007 1
1 305 . 20 1 1 A 31 31 GLY N N 31 107.961 109.788 -1.827 1
1 306 . 20 1 1 A 32 32 ASN H H 32 8.173 8.325 -0.152 1
1 307 . 20 1 1 A 32 32 ASN HA H 32 4.749 4.946 -0.197 1
1 312 . 20 1 1 A 32 32 ASN C C 32 171.355 175.684 -4.329 1
1 313 . 20 1 1 A 32 32 ASN CA C 32 50.795 52.709 -1.914 1
1 314 . 20 1 1 A 32 32 ASN CB C 32 41.508 39.634 1.874 1
1 315 . 20 1 1 A 32 32 ASN N N 32 117.781 118.682 -0.901 1
1 317 . 20 1 1 A 33 33 SER HA H 33 4.291 4.404 -0.113 1
1 320 . 20 1 1 A 33 33 SER C C 33 172.449 175.123 -2.674 1
1 321 . 20 1 1 A 33 33 SER CA C 33 56.733 59.526 -2.793 1
1 322 . 20 1 1 A 33 33 SER CB C 33 60.884 64.123 -3.239 1
1 323 . 20 1 1 A 34 34 GLU H H 34 7.731 7.649 0.082 1
1 324 . 20 1 1 A 34 34 GLU HA H 34 4.556 4.523 0.033 1
1 329 . 20 1 1 A 34 34 GLU C C 34 171.792 174.747 -2.955 1
1 330 . 20 1 1 A 34 34 GLU CA C 34 51.818 55.116 -3.298 1
1 331 . 20 1 1 A 34 34 GLU CB C 34 26.891 28.742 -1.851 1
1 333 . 20 1 1 A 34 34 GLU N N 34 122.319 123.098 -0.779 1
1 334 . 20 1 1 A 35 35 PRO HA H 35 4.165 4.739 -0.574 1
1 341 . 20 1 1 A 35 35 PRO C C 35 174.288 176.169 -1.881 1
1 342 . 20 1 1 A 35 35 PRO CA C 35 61.374 62.719 -1.345 1
1 343 . 20 1 1 A 35 35 PRO CB C 35 29.887 31.783 -1.896 1
1 346 . 20 1 1 A 36 36 VAL H H 36 8.348 8.691 -0.343 1
1 347 . 20 1 1 A 36 36 VAL HA H 36 3.899 4.239 -0.340 1
1 355 . 20 1 1 A 36 36 VAL C C 36 173.344 176.402 -3.058 1
1 356 . 20 1 1 A 36 36 VAL CA C 36 59.014 61.462 -2.448 1
1 357 . 20 1 1 A 36 36 VAL CB C 36 31.865 33.210 -1.345 1
1 360 . 20 1 1 A 36 36 VAL N N 36 122.051 124.021 -1.970 1
1 361 . 20 1 1 A 37 37 THR H H 37 8.780 8.450 0.330 1
1 362 . 20 1 1 A 37 37 THR HA H 37 3.923 4.297 -0.374 1
1 367 . 20 1 1 A 37 37 THR C C 37 172.171 174.633 -2.462 1
1 368 . 20 1 1 A 37 37 THR CA C 37 63.155 64.287 -1.132 1
1 369 . 20 1 1 A 37 37 THR CB C 37 65.941 69.242 -3.301 1
1 371 . 20 1 1 A 37 37 THR N N 37 122.351 119.874 2.477 1
1 372 . 20 1 1 A 38 38 TYR H H 38 7.304 7.810 -0.506 1
1 373 . 20 1 1 A 38 38 TYR HA H 38 4.439 5.065 -0.626 1
1 380 . 20 1 1 A 38 38 TYR C C 38 168.385 172.540 -4.155 1
1 381 . 20 1 1 A 38 38 TYR CA C 38 54.101 56.446 -2.345 1
1 382 . 20 1 1 A 38 38 TYR CB C 38 35.874 40.023 -4.149 1
1 387 . 20 1 1 A 38 38 TYR N N 38 113.984 115.297 -1.313 1
1 388 . 20 1 1 A 39 39 TYR H H 39 9.445 8.989 0.456 1
1 389 . 20 1 1 A 39 39 TYR HA H 39 5.293 5.301 -0.008 1
1 396 . 20 1 1 A 39 39 TYR C C 39 172.781 175.774 -2.993 1
1 397 . 20 1 1 A 39 39 TYR CA C 39 54.322 55.786 -1.464 1
1 398 . 20 1 1 A 39 39 TYR CB C 39 39.035 40.439 -1.404 1
1 401 . 20 1 1 A 39 39 TYR N N 39 115.092 118.934 -3.842 1
1 402 . 20 1 1 A 40 40 GLY H H 40 8.870 8.760 0.110 1
1 403 . 20 1 1 A 40 40 GLY HA2 H 40 5.137 4.107 1.030 1
1 404 . 20 1 1 A 40 40 GLY HA3 H 40 3.285 4.173 -0.888 1
1 405 . 20 1 1 A 40 40 GLY C C 40 169.688 172.869 -3.181 1
1 406 . 20 1 1 A 40 40 GLY CA C 40 41.415 44.886 -3.471 1
1 407 . 20 1 1 A 40 40 GLY N N 40 106.573 111.774 -5.201 1
1 408 . 20 1 1 A 41 41 ILE H H 41 8.917 8.429 0.488 1
1 409 . 20 1 1 A 41 41 ILE HA H 41 4.527 4.710 -0.183 1
1 419 . 20 1 1 A 41 41 ILE C C 41 172.692 174.561 -1.869 1
1 420 . 20 1 1 A 41 41 ILE CA C 41 57.597 60.003 -2.406 1
1 421 . 20 1 1 A 41 41 ILE CB C 41 37.840 41.881 -4.041 1
1 425 . 20 1 1 A 41 41 ILE N N 41 121.746 121.493 0.253 1
1 426 . 20 1 1 A 42 42 GLN H H 42 9.063 8.698 0.365 1
1 427 . 20 1 1 A 42 42 GLN HA H 42 5.655 5.270 0.385 1
1 434 . 20 1 1 A 42 42 GLN C C 42 172.841 174.511 -1.670 1
1 435 . 20 1 1 A 42 42 GLN CA C 42 50.789 54.045 -3.256 1
1 436 . 20 1 1 A 42 42 GLN CB C 42 28.898 32.495 -3.597 1
1 438 . 20 1 1 A 42 42 GLN N N 42 125.141 125.611 -0.470 1
1 440 . 20 1 1 A 43 43 TYR H H 43 9.066 8.812 0.254 1
1 441 . 20 1 1 A 43 43 TYR HA H 43 5.922 5.705 0.217 1
1 448 . 20 1 1 A 43 43 TYR C C 43 171.219 173.515 -2.296 1
1 449 . 20 1 1 A 43 43 TYR CA C 43 53.349 56.773 -3.424 1
1 450 . 20 1 1 A 43 43 TYR CB C 43 41.074 41.185 -0.111 1
1 455 . 20 1 1 A 43 43 TYR N N 43 118.018 119.184 -1.166 1
1 456 . 20 1 1 A 44 44 ARG H H 44 8.400 8.809 -0.409 1
1 457 . 20 1 1 A 44 44 ARG HA H 44 4.542 4.978 -0.436 1
1 464 . 20 1 1 A 44 44 ARG C C 44 171.974 174.133 -2.159 1
1 465 . 20 1 1 A 44 44 ARG CA C 44 52.453 54.418 -1.965 1
1 466 . 20 1 1 A 44 44 ARG CB C 44 31.125 32.947 -1.822 1
1 469 . 20 1 1 A 44 44 ARG N N 44 115.214 118.964 -3.750 1
1 470 . 20 1 1 A 45 45 ALA H H 45 8.846 8.398 0.448 1
1 471 . 20 1 1 A 45 45 ALA HA H 45 3.894 2.734 1.160 1
1 475 . 20 1 1 A 45 45 ALA C C 45 175.721 176.473 -0.752 1
1 476 . 20 1 1 A 45 45 ALA CA C 45 50.372 51.286 -0.914 1
1 477 . 20 1 1 A 45 45 ALA CB C 45 15.732 18.407 -2.675 1
1 478 . 20 1 1 A 45 45 ALA N N 45 126.463 122.992 3.471 1
1 479 . 20 1 1 A 46 46 ALA H H 46 8.282 8.086 0.196 1
1 480 . 20 1 1 A 46 46 ALA HA H 46 3.922 3.804 0.118 1
1 484 . 20 1 1 A 46 46 ALA C C 46 176.236 178.033 -1.797 1
1 485 . 20 1 1 A 46 46 ALA CA C 46 50.773 53.685 -2.912 1
1 486 . 20 1 1 A 46 46 ALA CB C 46 16.244 18.266 -2.022 1
1 487 . 20 1 1 A 46 46 ALA N N 46 126.301 126.413 -0.112 1
1 488 . 20 1 1 A 47 47 GLY HA2 H 47 3.882 3.927 -0.045 1
1 489 . 20 1 1 A 47 47 GLY HA3 H 47 3.695 3.947 -0.252 1
1 490 . 20 1 1 A 47 47 GLY C C 47 171.795 174.697 -2.902 1
1 491 . 20 1 1 A 47 47 GLY CA C 47 43.327 45.337 -2.010 1
1 492 . 20 1 1 A 48 48 THR H H 48 7.145 7.574 -0.429 1
1 493 . 20 1 1 A 48 48 THR HA H 48 4.417 4.149 0.268 1
1 498 . 20 1 1 A 48 48 THR C C 48 171.325 174.750 -3.425 1
1 499 . 20 1 1 A 48 48 THR CA C 48 58.271 62.786 -4.515 1
1 500 . 20 1 1 A 48 48 THR CB C 48 68.846 69.066 -0.220 1
1 502 . 20 1 1 A 48 48 THR N N 48 110.190 114.978 -4.788 1
1 503 . 20 1 1 A 49 49 GLU H H 49 8.346 8.518 -0.172 1
1 504 . 20 1 1 A 49 49 GLU HA H 49 4.277 4.398 -0.121 1
1 509 . 20 1 1 A 49 49 GLU C C 49 174.109 175.221 -1.112 1
1 510 . 20 1 1 A 49 49 GLU CA C 49 52.909 56.211 -3.302 1
1 511 . 20 1 1 A 49 49 GLU CB C 49 27.845 28.097 -0.252 1
1 513 . 20 1 1 A 49 49 GLU N N 49 119.985 125.098 -5.113 1
1 514 . 20 1 1 A 50 50 GLY H H 50 7.617 7.735 -0.118 1
1 515 . 20 1 1 A 50 50 GLY HA2 H 50 3.935 4.117 -0.182 1
1 516 . 20 1 1 A 50 50 GLY HA3 H 50 3.935 4.152 -0.217 1
1 517 . 20 1 1 A 50 50 GLY C C 50 168.223 172.385 -4.162 1
1 518 . 20 1 1 A 50 50 GLY CA C 50 42.121 43.839 -1.718 1
1 519 . 20 1 1 A 50 50 GLY N N 50 108.670 108.889 -0.219 1
1 520 . 20 1 1 A 51 51 PRO HA H 51 4.298 4.544 -0.246 1
1 527 . 20 1 1 A 51 51 PRO C C 51 175.067 175.598 -0.531 1
1 528 . 20 1 1 A 51 51 PRO CA C 51 60.175 62.632 -2.457 1
1 529 . 20 1 1 A 51 51 PRO CB C 51 30.052 32.393 -2.341 1
1 532 . 20 1 1 A 52 52 PHE H H 52 8.442 8.534 -0.092 1
1 533 . 20 1 1 A 52 52 PHE HA H 52 3.981 4.646 -0.665 1
1 541 . 20 1 1 A 52 52 PHE C C 52 175.141 175.631 -0.490 1
1 542 . 20 1 1 A 52 52 PHE CA C 52 56.808 57.536 -0.728 1
1 543 . 20 1 1 A 52 52 PHE CB C 52 36.830 41.358 -4.528 1
1 549 . 20 1 1 A 52 52 PHE N N 52 118.707 119.329 -0.622 1
1 550 . 20 1 1 A 53 53 GLN H H 53 8.778 8.687 0.091 1
1 551 . 20 1 1 A 53 53 GLN HA H 53 4.149 4.492 -0.343 1
1 558 . 20 1 1 A 53 53 GLN C C 53 172.773 175.093 -2.320 1
1 559 . 20 1 1 A 53 53 GLN CA C 53 52.999 55.481 -2.482 1
1 560 . 20 1 1 A 53 53 GLN CB C 53 26.962 29.910 -2.948 1
1 562 . 20 1 1 A 53 53 GLN N N 53 122.164 120.516 1.648 1
1 564 . 20 1 1 A 54 54 GLU H H 54 8.432 8.654 -0.222 1
1 565 . 20 1 1 A 54 54 GLU HA H 54 5.533 4.966 0.567 1
1 570 . 20 1 1 A 54 54 GLU C C 54 173.930 174.749 -0.819 1
1 571 . 20 1 1 A 54 54 GLU CA C 54 52.981 55.627 -2.646 1
1 572 . 20 1 1 A 54 54 GLU CB C 54 31.712 33.143 -1.431 1
1 574 . 20 1 1 A 54 54 GLU N N 54 119.688 121.221 -1.533 1
1 575 . 20 1 1 A 55 55 VAL H H 55 9.077 8.627 0.450 1
1 576 . 20 1 1 A 55 55 VAL HA H 55 4.180 4.824 -0.644 1
1 584 . 20 1 1 A 55 55 VAL C C 55 171.811 174.292 -2.481 1
1 585 . 20 1 1 A 55 55 VAL CA C 55 59.664 61.200 -1.536 1
1 586 . 20 1 1 A 55 55 VAL CB C 55 31.827 34.649 -2.822 1
1 589 . 20 1 1 A 55 55 VAL N N 55 125.328 126.073 -0.745 1
1 590 . 20 1 1 A 56 56 ASP H H 56 8.639 8.869 -0.230 1
1 591 . 20 1 1 A 56 56 ASP HA H 56 5.250 5.610 -0.360 1
1 594 . 20 1 1 A 56 56 ASP C C 56 174.252 175.951 -1.699 1
1 595 . 20 1 1 A 56 56 ASP CA C 56 50.108 52.177 -2.069 1
1 596 . 20 1 1 A 56 56 ASP CB C 56 41.407 43.871 -2.464 1
1 597 . 20 1 1 A 56 56 ASP N N 56 125.773 124.788 0.985 1
1 598 . 20 1 1 A 57 57 GLY H H 57 7.222 8.567 -1.345 1
1 599 . 20 1 1 A 57 57 GLY HA2 H 57 3.479 3.855 -0.376 1
1 600 . 20 1 1 A 57 57 GLY HA3 H 57 2.719 3.941 -1.222 1
1 601 . 20 1 1 A 57 57 GLY C C 57 172.281 174.355 -2.074 1
1 602 . 20 1 1 A 57 57 GLY CA C 57 43.919 45.037 -1.118 1
1 603 . 20 1 1 A 57 57 GLY N N 57 105.564 110.834 -5.270 1
1 604 . 20 1 1 A 58 58 VAL H H 58 8.338 7.996 0.342 1
1 605 . 20 1 1 A 58 58 VAL HA H 58 3.860 4.293 -0.433 1
1 613 . 20 1 1 A 58 58 VAL C C 58 173.981 175.535 -1.554 1
1 614 . 20 1 1 A 58 58 VAL CA C 58 61.233 61.632 -0.399 1
1 615 . 20 1 1 A 58 58 VAL CB C 58 29.708 30.812 -1.104 1
1 618 . 20 1 1 A 58 58 VAL N N 58 121.466 121.130 0.336 1
1 619 . 20 1 1 A 59 59 ALA H H 59 9.038 8.743 0.295 1
1 620 . 20 1 1 A 59 59 ALA HA H 59 4.676 4.578 0.098 1
1 624 . 20 1 1 A 59 59 ALA C C 59 175.105 176.855 -1.750 1
1 625 . 20 1 1 A 59 59 ALA CA C 59 50.866 52.465 -1.599 1
1 626 . 20 1 1 A 59 59 ALA CB C 59 17.647 18.956 -1.309 1
1 627 . 20 1 1 A 59 59 ALA N N 59 130.928 130.123 0.805 1
1 628 . 20 1 1 A 60 60 THR H H 60 7.445 7.743 -0.298 1
1 629 . 20 1 1 A 60 60 THR HA H 60 4.642 4.674 -0.032 1
1 634 . 20 1 1 A 60 60 THR C C 60 169.528 174.440 -4.912 1
1 635 . 20 1 1 A 60 60 THR CA C 60 57.101 59.411 -2.310 1
1 636 . 20 1 1 A 60 60 THR CB C 60 67.982 72.252 -4.270 1
1 638 . 20 1 1 A 60 60 THR N N 60 109.256 109.527 -0.271 1
1 639 . 20 1 1 A 61 61 THR H H 61 7.325 8.333 -1.008 1
1 640 . 20 1 1 A 61 61 THR HA H 61 2.896 3.501 -0.605 1
1 645 . 20 1 1 A 61 61 THR C C 61 169.678 173.229 -3.551 1
1 646 . 20 1 1 A 61 61 THR CA C 61 57.246 61.838 -4.592 1
1 647 . 20 1 1 A 61 61 THR CB C 61 63.794 68.651 -4.857 1
1 649 . 20 1 1 A 61 61 THR N N 61 105.670 111.078 -5.408 1
1 650 . 20 1 1 A 62 62 ARG H H 62 6.490 7.326 -0.836 1
1 651 . 20 1 1 A 62 62 ARG HA H 62 4.698 4.392 0.306 1
1 658 . 20 1 1 A 62 62 ARG C C 62 172.881 173.857 -0.976 1
1 659 . 20 1 1 A 62 62 ARG CA C 62 52.276 53.741 -1.465 1
1 660 . 20 1 1 A 62 62 ARG CB C 62 30.774 34.083 -3.309 1
1 663 . 20 1 1 A 62 62 ARG N N 62 117.485 120.384 -2.899 1
1 664 . 20 1 1 A 63 63 TYR H H 63 8.891 8.755 0.136 1
1 665 . 20 1 1 A 63 63 TYR HA H 63 4.356 5.065 -0.709 1
1 672 . 20 1 1 A 63 63 TYR C C 63 170.393 173.161 -2.768 1
1 673 . 20 1 1 A 63 63 TYR CA C 63 57.284 58.201 -0.917 1
1 674 . 20 1 1 A 63 63 TYR CB C 63 41.467 42.116 -0.649 1
1 679 . 20 1 1 A 63 63 TYR N N 63 124.712 124.331 0.381 1
1 680 . 20 1 1 A 64 64 SER H H 64 7.244 8.166 -0.922 1
1 681 . 20 1 1 A 64 64 SER HA H 64 5.077 5.694 -0.617 1
1 684 . 20 1 1 A 64 64 SER C C 64 169.712 172.470 -2.758 1
1 685 . 20 1 1 A 64 64 SER CA C 64 54.181 56.032 -1.851 1
1 686 . 20 1 1 A 64 64 SER CB C 64 61.122 65.341 -4.219 1
1 687 . 20 1 1 A 64 64 SER N N 64 120.593 121.465 -0.872 1
1 688 . 20 1 1 A 65 65 ILE H H 65 8.686 8.749 -0.063 1
1 689 . 20 1 1 A 65 65 ILE HA H 65 3.937 4.942 -1.005 1
1 699 . 20 1 1 A 65 65 ILE C C 65 172.217 175.280 -3.063 1
1 700 . 20 1 1 A 65 65 ILE CA C 65 58.288 59.645 -1.357 1
1 701 . 20 1 1 A 65 65 ILE CB C 65 36.110 40.230 -4.120 1
1 705 . 20 1 1 A 65 65 ILE N N 65 127.792 125.975 1.817 1
1 706 . 20 1 1 A 66 66 GLY H H 66 7.883 8.613 -0.730 1
1 707 . 20 1 1 A 66 66 GLY HA2 H 66 4.799 4.197 0.602 1
1 708 . 20 1 1 A 66 66 GLY HA3 H 66 3.468 4.221 -0.753 1
1 709 . 20 1 1 A 66 66 GLY C C 66 171.983 174.118 -2.135 1
1 710 . 20 1 1 A 66 66 GLY CA C 66 40.534 44.602 -4.068 1
1 711 . 20 1 1 A 66 66 GLY N N 66 112.632 114.453 -1.821 1
1 712 . 20 1 1 A 67 67 GLY H H 67 8.483 8.234 0.249 1
1 713 . 20 1 1 A 67 67 GLY HA2 H 67 3.836 3.973 -0.137 1
1 714 . 20 1 1 A 67 67 GLY HA3 H 67 3.682 4.005 -0.323 1
1 715 . 20 1 1 A 67 67 GLY C C 67 172.954 174.233 -1.279 1
1 716 . 20 1 1 A 67 67 GLY CA C 67 43.568 46.120 -2.552 1
1 717 . 20 1 1 A 67 67 GLY N N 67 104.625 109.386 -4.761 1
1 718 . 20 1 1 A 68 68 LEU H H 68 8.236 7.413 0.823 1
1 719 . 20 1 1 A 68 68 LEU HA H 68 4.154 4.683 -0.529 1
1 729 . 20 1 1 A 68 68 LEU C C 68 173.838 175.729 -1.891 1
1 730 . 20 1 1 A 68 68 LEU CA C 68 51.025 53.333 -2.308 1
1 731 . 20 1 1 A 68 68 LEU CB C 68 38.837 42.776 -3.939 1
1 735 . 20 1 1 A 68 68 LEU N N 68 118.919 121.349 -2.430 1
1 736 . 20 1 1 A 69 69 SER H H 69 8.284 8.830 -0.546 1
1 737 . 20 1 1 A 69 69 SER HA H 69 4.765 4.916 -0.151 1
1 740 . 20 1 1 A 69 69 SER C C 69 170.044 172.101 -2.057 1
1 741 . 20 1 1 A 69 69 SER CA C 69 54.639 55.814 -1.175 1
1 742 . 20 1 1 A 69 69 SER CB C 69 61.216 64.448 -3.232 1
1 743 . 20 1 1 A 69 69 SER N N 69 116.361 117.197 -0.836 1
1 744 . 20 1 1 A 70 70 PRO HA H 70 5.141 4.627 0.514 1
1 751 . 20 1 1 A 70 70 PRO C C 70 174.858 177.491 -2.633 1
1 752 . 20 1 1 A 70 70 PRO CA C 70 60.810 63.993 -3.183 1
1 753 . 20 1 1 A 70 70 PRO CB C 70 30.657 31.963 -1.306 1
1 756 . 20 1 1 A 71 71 PHE H H 71 8.139 9.274 -1.135 1
1 757 . 20 1 1 A 71 71 PHE HA H 71 4.202 4.271 -0.069 1
1 765 . 20 1 1 A 71 71 PHE C C 71 172.870 174.445 -1.575 1
1 766 . 20 1 1 A 71 71 PHE CA C 71 55.410 58.987 -3.577 1
1 767 . 20 1 1 A 71 71 PHE CB C 71 36.027 37.673 -1.646 1
1 773 . 20 1 1 A 71 71 PHE N N 71 125.409 123.513 1.896 1
1 774 . 20 1 1 A 72 72 SER H H 72 8.182 7.518 0.664 1
1 775 . 20 1 1 A 72 72 SER HA H 72 4.755 5.058 -0.303 1
1 778 . 20 1 1 A 72 72 SER C C 72 168.850 172.660 -3.810 1
1 779 . 20 1 1 A 72 72 SER CA C 72 55.926 56.467 -0.541 1
1 780 . 20 1 1 A 72 72 SER CB C 72 64.208 66.999 -2.791 1
1 781 . 20 1 1 A 72 72 SER N N 72 113.509 110.348 3.161 1
1 782 . 20 1 1 A 73 73 GLU H H 73 8.422 8.842 -0.420 1
1 783 . 20 1 1 A 73 73 GLU HA H 73 4.966 5.225 -0.259 1
1 788 . 20 1 1 A 73 73 GLU C C 73 173.192 174.792 -1.600 1
1 789 . 20 1 1 A 73 73 GLU CA C 73 52.815 54.944 -2.129 1
1 790 . 20 1 1 A 73 73 GLU CB C 73 29.416 32.644 -3.228 1
1 792 . 20 1 1 A 73 73 GLU N N 73 123.046 122.681 0.365 1
1 793 . 20 1 1 A 74 74 TYR H H 74 9.205 8.818 0.387 1
1 794 . 20 1 1 A 74 74 TYR HA H 74 4.799 5.063 -0.264 1
1 801 . 20 1 1 A 74 74 TYR C C 74 170.775 174.336 -3.561 1
1 802 . 20 1 1 A 74 74 TYR CA C 74 55.291 56.645 -1.354 1
1 803 . 20 1 1 A 74 74 TYR CB C 74 42.943 42.539 0.404 1
1 808 . 20 1 1 A 74 74 TYR N N 74 125.351 124.138 1.213 1
1 809 . 20 1 1 A 75 75 ALA H H 75 8.639 8.176 0.463 1
1 810 . 20 1 1 A 75 75 ALA HA H 75 5.271 5.468 -0.197 1
1 814 . 20 1 1 A 75 75 ALA C C 75 173.698 176.221 -2.523 1
1 815 . 20 1 1 A 75 75 ALA CA C 75 47.904 50.187 -2.283 1
1 816 . 20 1 1 A 75 75 ALA CB C 75 19.634 20.607 -0.973 1
1 817 . 20 1 1 A 75 75 ALA N N 75 121.555 124.327 -2.772 1
1 818 . 20 1 1 A 76 76 PHE H H 76 9.066 9.455 -0.389 1
1 819 . 20 1 1 A 76 76 PHE HA H 76 5.496 5.351 0.145 1
1 827 . 20 1 1 A 76 76 PHE C C 76 172.268 175.182 -2.914 1
1 828 . 20 1 1 A 76 76 PHE CA C 76 54.216 56.826 -2.610 1
1 829 . 20 1 1 A 76 76 PHE CB C 76 41.901 41.882 0.019 1
1 835 . 20 1 1 A 76 76 PHE N N 76 116.545 122.849 -6.304 1
1 836 . 20 1 1 A 77 77 ARG H H 77 9.216 8.706 0.510 1
1 837 . 20 1 1 A 77 77 ARG HA H 77 4.357 5.148 -0.791 1
1 845 . 20 1 1 A 77 77 ARG C C 77 169.998 173.980 -3.982 1
1 846 . 20 1 1 A 77 77 ARG CA C 77 52.414 54.828 -2.414 1
1 847 . 20 1 1 A 77 77 ARG CB C 77 30.794 33.979 -3.185 1
1 850 . 20 1 1 A 77 77 ARG N N 77 115.738 119.023 -3.285 1
1 852 . 20 1 1 A 78 78 VAL H H 78 8.135 8.792 -0.657 1
1 853 . 20 1 1 A 78 78 VAL HA H 78 4.884 4.681 0.203 1
1 861 . 20 1 1 A 78 78 VAL C C 78 171.098 175.215 -4.117 1
1 862 . 20 1 1 A 78 78 VAL CA C 78 57.566 60.913 -3.347 1
1 863 . 20 1 1 A 78 78 VAL CB C 78 33.146 32.902 0.244 1
1 866 . 20 1 1 A 78 78 VAL N N 78 117.942 124.064 -6.122 1
1 867 . 20 1 1 A 79 79 LEU H H 79 9.167 8.694 0.473 1
1 868 . 20 1 1 A 79 79 LEU HA H 79 4.575 5.001 -0.426 1
1 878 . 20 1 1 A 79 79 LEU C C 79 171.447 175.087 -3.640 1
1 879 . 20 1 1 A 79 79 LEU CA C 79 51.642 53.114 -1.472 1
1 880 . 20 1 1 A 79 79 LEU CB C 79 42.776 45.439 -2.663 1
1 884 . 20 1 1 A 79 79 LEU N N 79 123.913 122.264 1.649 1
1 885 . 20 1 1 A 80 80 ALA H H 80 9.325 8.589 0.736 1
1 886 . 20 1 1 A 80 80 ALA HA H 80 4.654 3.642 1.012 1
1 890 . 20 1 1 A 80 80 ALA C C 80 172.070 177.197 -5.127 1
1 891 . 20 1 1 A 80 80 ALA CA C 80 48.169 51.733 -3.564 1
1 892 . 20 1 1 A 80 80 ALA CB C 80 20.366 19.289 1.077 1
1 893 . 20 1 1 A 80 80 ALA N N 80 124.135 124.727 -0.592 1
1 894 . 20 1 1 A 81 81 VAL H H 81 7.953 8.147 -0.194 1
1 895 . 20 1 1 A 81 81 VAL HA H 81 4.293 4.823 -0.530 1
1 903 . 20 1 1 A 81 81 VAL C C 81 172.873 174.702 -1.829 1
1 904 . 20 1 1 A 81 81 VAL CA C 81 58.959 60.792 -1.833 1
1 905 . 20 1 1 A 81 81 VAL CB C 81 31.412 34.666 -3.254 1
1 908 . 20 1 1 A 81 81 VAL N N 81 118.503 120.541 -2.038 1
1 909 . 20 1 1 A 82 82 ASN H H 82 8.262 8.420 -0.158 1
1 910 . 20 1 1 A 82 82 ASN HA H 82 4.945 5.012 -0.067 1
1 915 . 20 1 1 A 82 82 ASN C C 82 173.273 175.877 -2.604 1
1 916 . 20 1 1 A 82 82 ASN CA C 82 48.714 51.166 -2.452 1
1 917 . 20 1 1 A 82 82 ASN CB C 82 36.796 40.445 -3.649 1
1 918 . 20 1 1 A 82 82 ASN N N 82 125.425 125.564 -0.139 1
1 920 . 20 1 1 A 83 83 SER HA H 83 3.966 4.087 -0.121 1
1 923 . 20 1 1 A 83 83 SER C C 83 172.812 176.753 -3.941 1
1 924 . 20 1 1 A 83 83 SER CA C 83 59.047 62.459 -3.412 1
1 925 . 20 1 1 A 83 83 SER CB C 83 60.406 62.719 -2.313 1
1 926 . 20 1 1 A 84 84 ILE H H 84 7.803 7.864 -0.061 1
1 927 . 20 1 1 A 84 84 ILE HA H 84 3.862 3.736 0.126 1
1 937 . 20 1 1 A 84 84 ILE C C 84 174.481 176.144 -1.663 1
1 938 . 20 1 1 A 84 84 ILE CA C 84 59.188 64.510 -5.322 1
1 939 . 20 1 1 A 84 84 ILE CB C 84 34.677 38.172 -3.495 1
1 943 . 20 1 1 A 84 84 ILE N N 84 121.222 119.873 1.349 1
1 944 . 20 1 1 A 85 85 GLY H H 85 7.435 7.282 0.153 1
1 945 . 20 1 1 A 85 85 GLY HA2 H 85 4.149 4.037 0.112 1
1 946 . 20 1 1 A 85 85 GLY HA3 H 85 3.747 4.039 -0.292 1
1 947 . 20 1 1 A 85 85 GLY C C 85 168.589 171.976 -3.387 1
1 948 . 20 1 1 A 85 85 GLY CA C 85 42.931 45.447 -2.516 1
1 949 . 20 1 1 A 85 85 GLY N N 85 106.320 105.519 0.801 1
1 950 . 20 1 1 A 86 86 ARG H H 86 8.190 8.454 -0.264 1
1 951 . 20 1 1 A 86 86 ARG HA H 86 4.452 4.926 -0.474 1
1 958 . 20 1 1 A 86 86 ARG C C 86 175.286 176.141 -0.855 1
1 959 . 20 1 1 A 86 86 ARG CA C 86 53.223 55.222 -1.999 1
1 960 . 20 1 1 A 86 86 ARG CB C 86 29.517 31.525 -2.008 1
1 963 . 20 1 1 A 86 86 ARG N N 86 118.339 117.911 0.428 1
1 964 . 20 1 1 A 87 87 GLY H H 87 8.900 8.535 0.365 1
1 965 . 20 1 1 A 87 87 GLY HA2 H 87 4.211 3.986 0.225 1
1 966 . 20 1 1 A 87 87 GLY HA3 H 87 3.967 3.997 -0.030 1
1 967 . 20 1 1 A 87 87 GLY C C 87 168.101 172.840 -4.739 1
1 968 . 20 1 1 A 87 87 GLY CA C 87 42.281 44.145 -1.864 1
1 969 . 20 1 1 A 87 87 GLY N N 87 113.482 109.211 4.271 1
1 970 . 20 1 1 A 88 88 PRO HA H 88 4.563 4.544 0.019 1
1 977 . 20 1 1 A 88 88 PRO CA C 88 60.994 62.102 -1.108 1
1 978 . 20 1 1 A 88 88 PRO CB C 88 29.873 31.552 -1.679 1
1 981 . 20 1 1 A 89 89 PRO HA H 89 4.490 4.459 0.031 1
1 987 . 20 1 1 A 89 89 PRO C C 89 174.543 176.112 -1.569 1
1 988 . 20 1 1 A 89 89 PRO CA C 89 59.435 62.408 -2.973 1
1 989 . 20 1 1 A 89 89 PRO CB C 89 29.805 31.815 -2.010 1
1 992 . 20 1 1 A 90 90 SER H H 90 8.808 8.076 0.732 1
1 993 . 20 1 1 A 90 90 SER HA H 90 4.202 4.616 -0.414 1
1 996 . 20 1 1 A 90 90 SER C C 90 171.870 173.951 -2.081 1
1 997 . 20 1 1 A 90 90 SER CA C 90 55.868 57.277 -1.409 1
1 998 . 20 1 1 A 90 90 SER CB C 90 64.504 64.453 0.051 1
1 999 . 20 1 1 A 90 90 SER N N 90 113.781 116.925 -3.144 1
1 1000 . 20 1 1 A 91 91 GLU H H 91 8.291 8.492 -0.201 1
1 1001 . 20 1 1 A 91 91 GLU HA H 91 4.131 4.100 0.031 1
1 1006 . 20 1 1 A 91 91 GLU C C 91 174.882 176.732 -1.850 1
1 1007 . 20 1 1 A 91 91 GLU CA C 91 54.984 57.262 -2.278 1
1 1008 . 20 1 1 A 91 91 GLU CB C 91 27.643 29.618 -1.975 1
1 1010 . 20 1 1 A 91 91 GLU N N 91 117.930 122.793 -4.863 1
1 1011 . 20 1 1 A 92 92 ALA H H 92 8.605 8.314 0.291 1
1 1012 . 20 1 1 A 92 92 ALA HA H 92 5.068 4.348 0.720 1
1 1016 . 20 1 1 A 92 92 ALA C C 92 176.227 177.865 -1.638 1
1 1017 . 20 1 1 A 92 92 ALA CA C 92 48.997 52.989 -3.992 1
1 1018 . 20 1 1 A 92 92 ALA CB C 92 17.756 19.183 -1.427 1
1 1019 . 20 1 1 A 92 92 ALA N N 92 126.421 127.741 -1.320 1
1 1020 . 20 1 1 A 93 93 VAL H H 93 9.051 9.071 -0.020 1
1 1021 . 20 1 1 A 93 93 VAL HA H 93 4.642 5.017 -0.375 1
1 1029 . 20 1 1 A 93 93 VAL C C 93 172.010 174.438 -2.428 1
1 1030 . 20 1 1 A 93 93 VAL CA C 93 57.495 59.390 -1.895 1
1 1031 . 20 1 1 A 93 93 VAL CB C 93 32.774 34.332 -1.558 1
1 1034 . 20 1 1 A 93 93 VAL N N 93 117.322 118.508 -1.186 1
1 1035 . 20 1 1 A 94 94 ARG H H 94 8.470 8.948 -0.478 1
1 1036 . 20 1 1 A 94 94 ARG HA H 94 5.692 5.463 0.229 1
1 1043 . 20 1 1 A 94 94 ARG C C 94 173.635 175.018 -1.383 1
1 1044 . 20 1 1 A 94 94 ARG CA C 94 52.038 54.405 -2.367 1
1 1045 . 20 1 1 A 94 94 ARG CB C 94 30.966 32.258 -1.292 1
1 1048 . 20 1 1 A 94 94 ARG N N 94 122.258 122.370 -0.112 1
1 1049 . 20 1 1 A 95 95 ALA H H 95 9.051 9.205 -0.154 1
1 1050 . 20 1 1 A 95 95 ALA HA H 95 4.642 5.343 -0.701 1
1 1054 . 20 1 1 A 95 95 ALA C C 95 172.285 175.166 -2.881 1
1 1055 . 20 1 1 A 95 95 ALA CA C 95 49.191 50.575 -1.384 1
1 1056 . 20 1 1 A 95 95 ALA CB C 95 22.562 22.066 0.496 1
1 1057 . 20 1 1 A 95 95 ALA N N 95 121.931 127.145 -5.214 1
1 1058 . 20 1 1 A 96 96 ARG H H 96 8.550 8.776 -0.226 1
1 1059 . 20 1 1 A 96 96 ARG HA H 96 5.407 5.215 0.192 1
1 1066 . 20 1 1 A 96 96 ARG C C 96 174.547 176.011 -1.464 1
1 1067 . 20 1 1 A 96 96 ARG CA C 96 51.439 55.181 -3.742 1
1 1068 . 20 1 1 A 96 96 ARG CB C 96 30.708 31.642 -0.934 1
1 1071 . 20 1 1 A 96 96 ARG N N 96 121.155 124.526 -3.371 1
1 1072 . 20 1 1 A 97 97 THR H H 97 8.797 8.912 -0.115 1
1 1073 . 20 1 1 A 97 97 THR HA H 97 4.116 4.429 -0.313 1
1 1078 . 20 1 1 A 97 97 THR C C 97 173.577 175.056 -1.479 1
1 1079 . 20 1 1 A 97 97 THR CA C 97 58.800 61.840 -3.040 1
1 1080 . 20 1 1 A 97 97 THR CB C 97 67.461 69.659 -2.198 1
1 1082 . 20 1 1 A 97 97 THR N N 97 114.657 118.317 -3.660 1
1 1083 . 20 1 1 A 98 98 GLY H H 98 7.505 8.403 -0.898 1
1 1084 . 20 1 1 A 98 98 GLY HA2 H 98 3.866 4.141 -0.275 1
1 1085 . 20 1 1 A 98 98 GLY HA3 H 98 3.743 4.194 -0.451 1
1 1086 . 20 1 1 A 98 98 GLY C C 98 170.637 174.995 -4.358 1
1 1087 . 20 1 1 A 98 98 GLY CA C 98 42.332 45.143 -2.811 1
1 1088 . 20 1 1 A 98 98 GLY N N 98 106.172 108.547 -2.375 1
1 1089 . 20 1 1 A 99 99 GLU H H 99 8.145 8.556 -0.411 1
1 1090 . 20 1 1 A 99 99 GLU HA H 99 4.210 4.607 -0.397 1
1 1095 . 20 1 1 A 99 99 GLU C C 99 174.134 176.613 -2.479 1
1 1096 . 20 1 1 A 99 99 GLU CA C 99 53.828 55.440 -1.612 1
1 1097 . 20 1 1 A 99 99 GLU CB C 99 28.774 28.807 -0.033 1
1 1099 . 20 1 1 A 99 99 GLU N N 99 117.634 117.601 0.033 1
1 1100 . 20 1 1 A 100 100 GLN H H 100 8.647 7.632 1.015 1
1 1101 . 20 1 1 A 100 100 GLN HA H 100 4.247 3.907 0.340 1
1 1108 . 20 1 1 A 100 100 GLN C C 100 173.348 176.718 -3.370 1
1 1109 . 20 1 1 A 100 100 GLN CA C 100 53.634 57.541 -3.907 1
1 1110 . 20 1 1 A 100 100 GLN CB C 100 27.392 28.465 -1.073 1
1 1112 . 20 1 1 A 100 100 GLN N N 100 121.960 121.712 0.248 1
1 1114 . 20 1 1 A 101 101 SER H H 101 8.416 8.903 -0.487 1
1 1115 . 20 1 1 A 101 101 SER HA H 101 4.418 4.011 0.407 1
1 1117 . 20 1 1 A 101 101 SER C C 101 172.148 174.270 -2.122 1
1 1118 . 20 1 1 A 101 101 SER CA C 101 55.926 59.128 -3.202 1
1 1119 . 20 1 1 A 101 101 SER CB C 101 61.617 61.743 -0.126 1
1 1120 . 20 1 1 A 101 101 SER N N 101 118.609 117.585 1.024 1
1 1121 . 20 1 1 A 102 102 GLY H H 102 8.233 7.669 0.564 1
1 1122 . 20 1 1 A 102 102 GLY HA2 H 102 4.080 3.933 0.147 1
1 1123 . 20 1 1 A 102 102 GLY HA3 H 102 3.981 3.974 0.007 1
1 1124 . 20 1 1 A 102 102 GLY C C 102 169.461 173.262 -3.801 1
1 1125 . 20 1 1 A 102 102 GLY CA C 102 42.332 45.258 -2.926 1
1 1126 . 20 1 1 A 102 102 GLY N N 102 110.483 108.465 2.018 1
1 1127 . 20 1 1 A 103 103 PRO HA H 103 4.618 4.478 0.140 1
1 1134 . 20 1 1 A 103 103 PRO CA C 103 57.843 63.022 -5.179 1
1 1135 . 20 1 1 A 103 103 PRO CB C 103 28.671 30.738 -2.067 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 93 2.830 1
2 1 1 1 "RMS(OBS, PRED)" CA 98 2.703 1
3 1 1 1 "RMS(OBS, PRED)" CB 86 2.579 1
4 1 1 1 "RMS(OBS, PRED)" H 85 0.522 1
5 1 1 1 "RMS(OBS, PRED)" HA 110 0.418 1
6 1 1 1 "RMS(OBS, PRED)" N 85 3.241 1
7 1 2 1 "RMS(OBS, PRED)" C 93 2.718 1
8 1 2 1 "RMS(OBS, PRED)" CA 98 2.505 1
9 1 2 1 "RMS(OBS, PRED)" CB 86 2.520 1
10 1 2 1 "RMS(OBS, PRED)" H 85 0.493 1
11 1 2 1 "RMS(OBS, PRED)" HA 110 0.426 1
12 1 2 1 "RMS(OBS, PRED)" N 85 3.428 1
13 1 3 1 "RMS(OBS, PRED)" C 93 2.650 1
14 1 3 1 "RMS(OBS, PRED)" CA 98 2.529 1
15 1 3 1 "RMS(OBS, PRED)" CB 86 2.632 1
16 1 3 1 "RMS(OBS, PRED)" H 85 0.494 1
17 1 3 1 "RMS(OBS, PRED)" HA 110 0.433 1
18 1 3 1 "RMS(OBS, PRED)" N 85 3.299 1
19 1 4 1 "RMS(OBS, PRED)" C 93 2.692 1
20 1 4 1 "RMS(OBS, PRED)" CA 98 2.618 1
21 1 4 1 "RMS(OBS, PRED)" CB 86 2.571 1
22 1 4 1 "RMS(OBS, PRED)" H 85 0.498 1
23 1 4 1 "RMS(OBS, PRED)" HA 110 0.422 1
24 1 4 1 "RMS(OBS, PRED)" N 85 3.175 1
25 1 5 1 "RMS(OBS, PRED)" C 93 2.791 1
26 1 5 1 "RMS(OBS, PRED)" CA 98 2.588 1
27 1 5 1 "RMS(OBS, PRED)" CB 86 2.522 1
28 1 5 1 "RMS(OBS, PRED)" H 85 0.470 1
29 1 5 1 "RMS(OBS, PRED)" HA 110 0.417 1
30 1 5 1 "RMS(OBS, PRED)" N 85 3.193 1
31 1 6 1 "RMS(OBS, PRED)" C 93 2.734 1
32 1 6 1 "RMS(OBS, PRED)" CA 98 2.645 1
33 1 6 1 "RMS(OBS, PRED)" CB 86 2.506 1
34 1 6 1 "RMS(OBS, PRED)" H 85 0.503 1
35 1 6 1 "RMS(OBS, PRED)" HA 110 0.417 1
36 1 6 1 "RMS(OBS, PRED)" N 85 3.263 1
37 1 7 1 "RMS(OBS, PRED)" C 93 2.797 1
38 1 7 1 "RMS(OBS, PRED)" CA 98 2.564 1
39 1 7 1 "RMS(OBS, PRED)" CB 86 2.550 1
40 1 7 1 "RMS(OBS, PRED)" H 85 0.501 1
41 1 7 1 "RMS(OBS, PRED)" HA 110 0.407 1
42 1 7 1 "RMS(OBS, PRED)" N 85 3.419 1
43 1 8 1 "RMS(OBS, PRED)" C 93 2.697 1
44 1 8 1 "RMS(OBS, PRED)" CA 98 2.574 1
45 1 8 1 "RMS(OBS, PRED)" CB 86 2.651 1
46 1 8 1 "RMS(OBS, PRED)" H 85 0.495 1
47 1 8 1 "RMS(OBS, PRED)" HA 110 0.436 1
48 1 8 1 "RMS(OBS, PRED)" N 85 3.263 1
49 1 9 1 "RMS(OBS, PRED)" C 93 2.729 1
50 1 9 1 "RMS(OBS, PRED)" CA 98 2.563 1
51 1 9 1 "RMS(OBS, PRED)" CB 86 2.661 1
52 1 9 1 "RMS(OBS, PRED)" H 85 0.487 1
53 1 9 1 "RMS(OBS, PRED)" HA 110 0.420 1
54 1 9 1 "RMS(OBS, PRED)" N 85 3.249 1
55 1 10 1 "RMS(OBS, PRED)" C 93 2.682 1
56 1 10 1 "RMS(OBS, PRED)" CA 98 2.560 1
57 1 10 1 "RMS(OBS, PRED)" CB 86 2.676 1
58 1 10 1 "RMS(OBS, PRED)" H 85 0.494 1
59 1 10 1 "RMS(OBS, PRED)" HA 110 0.448 1
60 1 10 1 "RMS(OBS, PRED)" N 85 3.356 1
61 1 11 1 "RMS(OBS, PRED)" C 93 2.728 1
62 1 11 1 "RMS(OBS, PRED)" CA 98 2.558 1
63 1 11 1 "RMS(OBS, PRED)" CB 86 2.492 1
64 1 11 1 "RMS(OBS, PRED)" H 85 0.496 1
65 1 11 1 "RMS(OBS, PRED)" HA 110 0.420 1
66 1 11 1 "RMS(OBS, PRED)" N 85 3.570 1
67 1 12 1 "RMS(OBS, PRED)" C 93 2.733 1
68 1 12 1 "RMS(OBS, PRED)" CA 98 2.524 1
69 1 12 1 "RMS(OBS, PRED)" CB 86 2.557 1
70 1 12 1 "RMS(OBS, PRED)" H 85 0.477 1
71 1 12 1 "RMS(OBS, PRED)" HA 110 0.436 1
72 1 12 1 "RMS(OBS, PRED)" N 85 3.259 1
73 1 13 1 "RMS(OBS, PRED)" C 93 2.667 1
74 1 13 1 "RMS(OBS, PRED)" CA 98 2.553 1
75 1 13 1 "RMS(OBS, PRED)" CB 86 2.538 1
76 1 13 1 "RMS(OBS, PRED)" H 85 0.490 1
77 1 13 1 "RMS(OBS, PRED)" HA 110 0.437 1
78 1 13 1 "RMS(OBS, PRED)" N 85 3.375 1
79 1 14 1 "RMS(OBS, PRED)" C 93 2.766 1
80 1 14 1 "RMS(OBS, PRED)" CA 98 2.593 1
81 1 14 1 "RMS(OBS, PRED)" CB 86 2.560 1
82 1 14 1 "RMS(OBS, PRED)" H 85 0.498 1
83 1 14 1 "RMS(OBS, PRED)" HA 110 0.406 1
84 1 14 1 "RMS(OBS, PRED)" N 85 3.619 1
85 1 15 1 "RMS(OBS, PRED)" C 93 2.650 1
86 1 15 1 "RMS(OBS, PRED)" CA 98 2.561 1
87 1 15 1 "RMS(OBS, PRED)" CB 86 2.639 1
88 1 15 1 "RMS(OBS, PRED)" H 85 0.482 1
89 1 15 1 "RMS(OBS, PRED)" HA 110 0.449 1
90 1 15 1 "RMS(OBS, PRED)" N 85 3.306 1
91 1 16 1 "RMS(OBS, PRED)" C 93 2.628 1
92 1 16 1 "RMS(OBS, PRED)" CA 98 2.545 1
93 1 16 1 "RMS(OBS, PRED)" CB 86 2.676 1
94 1 16 1 "RMS(OBS, PRED)" H 85 0.486 1
95 1 16 1 "RMS(OBS, PRED)" HA 110 0.435 1
96 1 16 1 "RMS(OBS, PRED)" N 85 3.386 1
97 1 17 1 "RMS(OBS, PRED)" C 93 2.677 1
98 1 17 1 "RMS(OBS, PRED)" CA 98 2.662 1
99 1 17 1 "RMS(OBS, PRED)" CB 86 2.682 1
100 1 17 1 "RMS(OBS, PRED)" H 85 0.515 1
101 1 17 1 "RMS(OBS, PRED)" HA 110 0.437 1
102 1 17 1 "RMS(OBS, PRED)" N 85 3.215 1
103 1 18 1 "RMS(OBS, PRED)" C 93 2.720 1
104 1 18 1 "RMS(OBS, PRED)" CA 98 2.636 1
105 1 18 1 "RMS(OBS, PRED)" CB 86 2.609 1
106 1 18 1 "RMS(OBS, PRED)" H 85 0.510 1
107 1 18 1 "RMS(OBS, PRED)" HA 110 0.408 1
108 1 18 1 "RMS(OBS, PRED)" N 85 3.256 1
109 1 19 1 "RMS(OBS, PRED)" C 93 2.678 1
110 1 19 1 "RMS(OBS, PRED)" CA 98 2.502 1
111 1 19 1 "RMS(OBS, PRED)" CB 86 2.670 1
112 1 19 1 "RMS(OBS, PRED)" H 85 0.514 1
113 1 19 1 "RMS(OBS, PRED)" HA 110 0.430 1
114 1 19 1 "RMS(OBS, PRED)" N 85 3.498 1
115 1 20 1 "RMS(OBS, PRED)" C 93 2.724 1
116 1 20 1 "RMS(OBS, PRED)" CA 98 2.575 1
117 1 20 1 "RMS(OBS, PRED)" CB 86 2.500 1
118 1 20 1 "RMS(OBS, PRED)" H 85 0.508 1
119 1 20 1 "RMS(OBS, PRED)" HA 110 0.426 1
120 1 20 1 "RMS(OBS, PRED)" N 85 3.129 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 6 6 SER HA H 6 4.492 4.865 -0.373 2
1 4 . 1 1 A 6 6 SER CA C 6 55.621 57.221 -1.601 2
1 5 . 1 1 A 6 6 SER CB C 6 62.104 64.503 -2.399 2
1 6 . 1 1 A 7 7 GLY H H 7 8.244 8.407 -0.163 2
1 7 . 1 1 A 7 7 GLY HA2 H 7 3.873 4.051 -0.178 2
1 8 . 1 1 A 7 7 GLY HA3 H 7 3.737 4.059 -0.322 2
1 9 . 1 1 A 7 7 GLY CA C 7 41.743 44.363 -2.620 2
1 10 . 1 1 A 7 7 GLY N N 7 109.193 113.184 -3.991 2
1 11 . 1 1 A 8 8 PRO HA H 8 4.286 4.561 -0.275 2
1 18 . 1 1 A 8 8 PRO C C 8 173.841 175.552 -1.711 2
1 19 . 1 1 A 8 8 PRO CA C 8 60.528 62.522 -1.994 2
1 20 . 1 1 A 8 8 PRO CB C 8 30.299 32.934 -2.635 2
1 23 . 1 1 A 9 9 LYS H H 9 8.877 8.417 0.460 2
1 24 . 1 1 A 9 9 LYS HA H 9 4.360 4.809 -0.449 2
1 33 . 1 1 A 9 9 LYS C C 9 173.492 174.282 -0.790 2
1 34 . 1 1 A 9 9 LYS CA C 9 52.135 53.130 -0.995 2
1 35 . 1 1 A 9 9 LYS CB C 9 28.798 33.014 -4.216 2
1 39 . 1 1 A 9 9 LYS N N 9 120.404 120.563 -0.159 2
1 40 . 1 1 A 10 10 PRO HA H 10 4.284 4.622 -0.338 2
1 47 . 1 1 A 10 10 PRO CA C 10 59.326 61.622 -2.296 2
1 48 . 1 1 A 10 10 PRO CB C 10 28.825 31.578 -2.753 2
1 51 . 1 1 A 11 11 PRO HA H 11 4.468 4.795 -0.327 2
1 58 . 1 1 A 11 11 PRO C C 11 171.993 176.385 -4.392 2
1 59 . 1 1 A 11 11 PRO CA C 11 60.422 62.680 -2.258 2
1 60 . 1 1 A 11 11 PRO CB C 11 30.418 32.687 -2.269 2
1 63 . 1 1 A 12 12 ILE H H 12 7.554 8.140 -0.586 2
1 64 . 1 1 A 12 12 ILE HA H 12 4.676 4.650 0.026 2
1 74 . 1 1 A 12 12 ILE C C 12 171.721 175.055 -3.334 2
1 75 . 1 1 A 12 12 ILE CA C 12 56.843 58.912 -2.069 2
1 76 . 1 1 A 12 12 ILE CB C 12 40.560 40.870 -0.310 2
1 80 . 1 1 A 12 12 ILE N N 12 109.695 116.887 -7.192 2
1 81 . 1 1 A 13 13 ASP H H 13 8.435 9.002 -0.567 2
1 82 . 1 1 A 13 13 ASP HA H 13 4.094 4.240 -0.146 2
1 85 . 1 1 A 13 13 ASP C C 13 171.803 175.889 -4.086 2
1 86 . 1 1 A 13 13 ASP CA C 13 52.610 55.065 -2.455 2
1 87 . 1 1 A 13 13 ASP CB C 13 36.357 39.967 -3.610 2
1 88 . 1 1 A 13 13 ASP N N 13 116.219 121.718 -5.499 2
1 89 . 1 1 A 14 14 LEU H H 14 7.483 7.993 -0.510 2
1 90 . 1 1 A 14 14 LEU HA H 14 4.990 4.892 0.098 2
1 100 . 1 1 A 14 14 LEU C C 14 174.702 175.365 -0.663 2
1 101 . 1 1 A 14 14 LEU CA C 14 53.811 55.108 -1.297 2
1 102 . 1 1 A 14 14 LEU CB C 14 40.148 42.262 -2.114 2
1 106 . 1 1 A 14 14 LEU N N 14 118.463 121.206 -2.743 2
1 107 . 1 1 A 15 15 VAL H H 15 9.209 8.605 0.604 2
1 108 . 1 1 A 15 15 VAL HA H 15 4.250 4.758 -0.508 2
1 116 . 1 1 A 15 15 VAL C C 15 172.080 174.066 -1.986 2
1 117 . 1 1 A 15 15 VAL CA C 15 58.570 60.488 -1.918 2
1 118 . 1 1 A 15 15 VAL CB C 15 34.146 36.084 -1.938 2
1 121 . 1 1 A 15 15 VAL N N 15 124.833 127.241 -2.408 2
1 122 . 1 1 A 16 16 VAL H H 16 8.390 8.884 -0.494 2
1 123 . 1 1 A 16 16 VAL HA H 16 4.343 4.622 -0.279 2
1 131 . 1 1 A 16 16 VAL C C 16 174.672 175.865 -1.193 2
1 132 . 1 1 A 16 16 VAL CA C 16 59.188 61.034 -1.846 2
1 133 . 1 1 A 16 16 VAL CB C 16 29.187 33.307 -4.120 2
1 136 . 1 1 A 16 16 VAL N N 16 124.654 125.352 -0.698 2
1 137 . 1 1 A 17 17 THR H H 17 8.638 8.510 0.128 2
1 138 . 1 1 A 17 17 THR HA H 17 4.195 4.411 -0.216 2
1 143 . 1 1 A 17 17 THR C C 17 172.661 173.489 -0.828 2
1 144 . 1 1 A 17 17 THR CA C 17 60.318 63.672 -3.354 2
1 145 . 1 1 A 17 17 THR CB C 17 66.420 70.610 -4.190 2
1 147 . 1 1 A 17 17 THR N N 17 120.942 122.246 -1.304 2
1 148 . 1 1 A 18 18 GLU H H 18 7.361 7.659 -0.298 2
1 149 . 1 1 A 18 18 GLU HA H 18 4.497 4.763 -0.266 2
1 154 . 1 1 A 18 18 GLU C C 18 171.691 175.060 -3.369 2
1 155 . 1 1 A 18 18 GLU CA C 18 53.687 54.984 -1.297 2
1 156 . 1 1 A 18 18 GLU CB C 18 30.802 33.538 -2.736 2
1 158 . 1 1 A 18 18 GLU N N 18 119.088 118.545 0.543 2
1 159 . 1 1 A 19 19 THR H H 19 8.164 8.663 -0.499 2
1 160 . 1 1 A 19 19 THR HA H 19 4.912 5.072 -0.160 2
1 165 . 1 1 A 19 19 THR C C 19 171.606 172.886 -1.280 2
1 166 . 1 1 A 19 19 THR CA C 19 58.473 60.656 -2.183 2
1 167 . 1 1 A 19 19 THR CB C 19 70.103 71.162 -1.059 2
1 169 . 1 1 A 19 19 THR N N 19 112.424 113.805 -1.381 2
1 170 . 1 1 A 20 20 THR H H 20 8.750 9.021 -0.271 2
1 171 . 1 1 A 20 20 THR HA H 20 4.710 4.799 -0.089 2
1 176 . 1 1 A 20 20 THR C C 20 172.785 175.932 -3.147 2
1 177 . 1 1 A 20 20 THR CA C 20 58.059 61.004 -2.945 2
1 178 . 1 1 A 20 20 THR CB C 20 68.782 71.165 -2.383 2
1 180 . 1 1 A 20 20 THR N N 20 113.438 120.889 -7.451 2
1 181 . 1 1 A 21 21 ALA H H 21 8.453 8.961 -0.508 2
1 182 . 1 1 A 21 21 ALA HA H 21 4.079 4.375 -0.296 2
1 186 . 1 1 A 21 21 ALA C C 21 174.130 177.905 -3.775 2
1 187 . 1 1 A 21 21 ALA CA C 21 52.680 55.082 -2.402 2
1 188 . 1 1 A 21 21 ALA CB C 21 16.893 18.535 -1.642 2
1 189 . 1 1 A 21 21 ALA N N 21 120.078 125.516 -5.438 2
1 190 . 1 1 A 22 22 THR H H 22 7.132 7.534 -0.402 2
1 191 . 1 1 A 22 22 THR HA H 22 4.433 4.764 -0.332 2
1 196 . 1 1 A 22 22 THR C C 22 171.434 173.459 -2.025 2
1 197 . 1 1 A 22 22 THR CA C 22 56.836 60.485 -3.649 2
1 198 . 1 1 A 22 22 THR CB C 22 68.772 69.387 -0.615 2
1 200 . 1 1 A 22 22 THR N N 22 95.772 104.149 -8.377 2
1 201 . 1 1 A 23 23 SER H H 23 7.326 7.713 -0.387 2
1 202 . 1 1 A 23 23 SER HA H 23 5.562 5.304 0.258 2
1 205 . 1 1 A 23 23 SER C C 23 169.267 172.333 -3.066 2
1 206 . 1 1 A 23 23 SER CA C 23 54.445 57.696 -3.251 2
1 207 . 1 1 A 23 23 SER CB C 23 65.905 67.308 -1.403 2
1 208 . 1 1 A 23 23 SER N N 23 115.757 115.889 -0.132 2
1 209 . 1 1 A 24 24 VAL H H 24 7.983 8.493 -0.510 2
1 210 . 1 1 A 24 24 VAL HA H 24 4.334 4.587 -0.253 2
1 218 . 1 1 A 24 24 VAL C C 24 171.917 174.088 -2.171 2
1 219 . 1 1 A 24 24 VAL CA C 24 58.642 60.413 -1.771 2
1 220 . 1 1 A 24 24 VAL CB C 24 34.254 35.406 -1.152 2
1 223 . 1 1 A 24 24 VAL N N 24 116.595 121.050 -4.455 2
1 224 . 1 1 A 25 25 THR H H 25 8.636 8.904 -0.268 2
1 225 . 1 1 A 25 25 THR HA H 25 4.833 4.910 -0.077 2
1 230 . 1 1 A 25 25 THR C C 25 169.721 172.798 -3.077 2
1 231 . 1 1 A 25 25 THR CA C 25 59.699 61.701 -2.002 2
1 232 . 1 1 A 25 25 THR CB C 25 67.303 70.194 -2.891 2
1 234 . 1 1 A 25 25 THR N N 25 121.690 121.799 -0.109 2
1 235 . 1 1 A 26 26 LEU H H 26 8.629 9.155 -0.526 2
1 236 . 1 1 A 26 26 LEU HA H 26 5.315 5.256 0.059 2
1 246 . 1 1 A 26 26 LEU C C 26 173.182 175.390 -2.208 2
1 247 . 1 1 A 26 26 LEU CA C 26 50.643 53.335 -2.692 2
1 248 . 1 1 A 26 26 LEU CB C 26 43.976 45.767 -1.791 2
1 252 . 1 1 A 26 26 LEU N N 26 126.843 129.757 -2.914 2
1 253 . 1 1 A 27 27 THR H H 27 8.704 9.088 -0.384 2
1 254 . 1 1 A 27 27 THR HA H 27 4.822 5.262 -0.440 2
1 259 . 1 1 A 27 27 THR C C 27 169.840 173.453 -3.613 2
1 260 . 1 1 A 27 27 THR CA C 27 58.077 59.591 -1.514 2
1 261 . 1 1 A 27 27 THR CB C 27 69.666 71.718 -2.052 2
1 263 . 1 1 A 27 27 THR N N 27 111.513 115.616 -4.103 2
1 264 . 1 1 A 28 28 TRP H H 28 7.339 8.180 -0.841 2
1 265 . 1 1 A 28 28 TRP HA H 28 4.963 5.480 -0.517 2
1 274 . 1 1 A 28 28 TRP C C 28 170.637 172.478 -1.841 2
1 275 . 1 1 A 28 28 TRP CA C 28 54.438 55.571 -1.133 2
1 276 . 1 1 A 28 28 TRP CB C 28 27.497 31.319 -3.822 2
1 282 . 1 1 A 28 28 TRP N N 28 117.895 119.180 -1.285 2
1 284 . 1 1 A 29 29 ASP H H 29 8.696 9.208 -0.512 2
1 285 . 1 1 A 29 29 ASP HA H 29 4.971 5.074 -0.103 2
1 288 . 1 1 A 29 29 ASP C C 29 174.901 177.262 -2.361 2
1 289 . 1 1 A 29 29 ASP CA C 29 50.178 52.588 -2.410 2
1 290 . 1 1 A 29 29 ASP CB C 29 42.291 43.217 -0.926 2
1 291 . 1 1 A 29 29 ASP N N 29 117.477 121.427 -3.950 2
1 292 . 1 1 A 30 30 SER H H 30 8.800 8.900 -0.100 2
1 293 . 1 1 A 30 30 SER HA H 30 4.389 4.177 0.212 2
1 296 . 1 1 A 30 30 SER C C 30 174.032 175.422 -1.390 2
1 297 . 1 1 A 30 30 SER CA C 30 58.694 61.304 -2.610 2
1 298 . 1 1 A 30 30 SER CB C 30 62.428 63.441 -1.013 2
1 299 . 1 1 A 30 30 SER N N 30 118.275 119.710 -1.435 2
1 300 . 1 1 A 31 31 GLY H H 31 8.759 8.258 0.500 2
1 301 . 1 1 A 31 31 GLY HA2 H 31 4.239 4.019 0.221 2
1 302 . 1 1 A 31 31 GLY HA3 H 31 3.555 4.050 -0.495 2
1 303 . 1 1 A 31 31 GLY C C 31 171.325 174.058 -2.733 2
1 304 . 1 1 A 31 31 GLY CA C 31 43.637 45.548 -1.911 2
1 305 . 1 1 A 31 31 GLY N N 31 107.961 110.340 -2.379 2
1 306 . 1 1 A 32 32 ASN H H 32 8.173 8.130 0.043 2
1 307 . 1 1 A 32 32 ASN HA H 32 4.749 5.019 -0.270 2
1 312 . 1 1 A 32 32 ASN C C 32 171.355 175.320 -3.965 2
1 313 . 1 1 A 32 32 ASN CA C 32 50.795 52.681 -1.886 2
1 314 . 1 1 A 32 32 ASN CB C 32 41.508 40.000 1.508 2
1 315 . 1 1 A 32 32 ASN N N 32 117.781 119.245 -1.464 2
1 317 . 1 1 A 33 33 SER HA H 33 4.291 4.518 -0.227 2
1 320 . 1 1 A 33 33 SER C C 33 172.449 174.457 -2.008 2
1 321 . 1 1 A 33 33 SER CA C 33 56.733 59.636 -2.903 2
1 322 . 1 1 A 33 33 SER CB C 33 60.884 64.279 -3.395 2
1 323 . 1 1 A 34 34 GLU H H 34 7.731 7.693 0.038 2
1 324 . 1 1 A 34 34 GLU HA H 34 4.556 4.603 -0.047 2
1 329 . 1 1 A 34 34 GLU C C 34 171.792 174.703 -2.911 2
1 330 . 1 1 A 34 34 GLU CA C 34 51.818 54.456 -2.638 2
1 331 . 1 1 A 34 34 GLU CB C 34 26.891 29.757 -2.866 2
1 333 . 1 1 A 34 34 GLU N N 34 122.319 120.156 2.163 2
1 334 . 1 1 A 35 35 PRO HA H 35 4.165 4.766 -0.601 2
1 341 . 1 1 A 35 35 PRO C C 35 174.288 176.703 -2.415 2
1 342 . 1 1 A 35 35 PRO CA C 35 61.374 62.584 -1.210 2
1 343 . 1 1 A 35 35 PRO CB C 35 29.887 30.944 -1.057 2
1 346 . 1 1 A 36 36 VAL H H 36 8.348 8.270 0.078 2
1 347 . 1 1 A 36 36 VAL HA H 36 3.899 4.273 -0.374 2
1 355 . 1 1 A 36 36 VAL C C 36 173.344 176.721 -3.377 2
1 356 . 1 1 A 36 36 VAL CA C 36 59.014 61.844 -2.830 2
1 357 . 1 1 A 36 36 VAL CB C 36 31.865 32.693 -0.828 2
1 360 . 1 1 A 36 36 VAL N N 36 122.051 121.599 0.452 2
1 361 . 1 1 A 37 37 THR H H 37 8.780 8.473 0.307 2
1 362 . 1 1 A 37 37 THR HA H 37 3.923 4.207 -0.284 2
1 367 . 1 1 A 37 37 THR C C 37 172.171 174.574 -2.403 2
1 368 . 1 1 A 37 37 THR CA C 37 63.155 64.769 -1.614 2
1 369 . 1 1 A 37 37 THR CB C 37 65.941 69.236 -3.295 2
1 371 . 1 1 A 37 37 THR N N 37 122.351 118.978 3.373 2
1 372 . 1 1 A 38 38 TYR H H 38 7.304 7.579 -0.275 2
1 373 . 1 1 A 38 38 TYR HA H 38 4.439 5.113 -0.674 2
1 380 . 1 1 A 38 38 TYR C C 38 168.385 172.657 -4.272 2
1 381 . 1 1 A 38 38 TYR CA C 38 54.101 56.407 -2.306 2
1 382 . 1 1 A 38 38 TYR CB C 38 35.874 40.320 -4.446 2
1 387 . 1 1 A 38 38 TYR N N 38 113.984 115.106 -1.122 2
1 388 . 1 1 A 39 39 TYR H H 39 9.445 8.938 0.507 2
1 389 . 1 1 A 39 39 TYR HA H 39 5.293 5.274 0.019 2
1 396 . 1 1 A 39 39 TYR C C 39 172.781 175.789 -3.008 2
1 397 . 1 1 A 39 39 TYR CA C 39 54.322 55.695 -1.373 2
1 398 . 1 1 A 39 39 TYR CB C 39 39.035 40.958 -1.923 2
1 401 . 1 1 A 39 39 TYR N N 39 115.092 118.506 -3.414 2
1 402 . 1 1 A 40 40 GLY H H 40 8.870 8.630 0.240 2
1 403 . 1 1 A 40 40 GLY HA2 H 40 5.137 4.160 0.977 2
1 404 . 1 1 A 40 40 GLY HA3 H 40 3.285 4.235 -0.950 2
1 405 . 1 1 A 40 40 GLY C C 40 169.688 172.776 -3.088 2
1 406 . 1 1 A 40 40 GLY CA C 40 41.415 44.592 -3.177 2
1 407 . 1 1 A 40 40 GLY N N 40 106.573 111.700 -5.126 2
1 408 . 1 1 A 41 41 ILE H H 41 8.917 8.429 0.488 2
1 409 . 1 1 A 41 41 ILE HA H 41 4.527 4.853 -0.326 2
1 419 . 1 1 A 41 41 ILE C C 41 172.692 174.742 -2.050 2
1 420 . 1 1 A 41 41 ILE CA C 41 57.597 60.026 -2.429 2
1 421 . 1 1 A 41 41 ILE CB C 41 37.840 41.812 -3.972 2
1 425 . 1 1 A 41 41 ILE N N 41 121.746 121.277 0.469 2
1 426 . 1 1 A 42 42 GLN H H 42 9.063 8.821 0.242 2
1 427 . 1 1 A 42 42 GLN HA H 42 5.655 5.430 0.225 2
1 434 . 1 1 A 42 42 GLN C C 42 172.841 174.504 -1.663 2
1 435 . 1 1 A 42 42 GLN CA C 42 50.789 54.366 -3.577 2
1 436 . 1 1 A 42 42 GLN CB C 42 28.898 32.386 -3.488 2
1 438 . 1 1 A 42 42 GLN N N 42 125.141 125.563 -0.422 2
1 440 . 1 1 A 43 43 TYR H H 43 9.066 8.887 0.179 2
1 441 . 1 1 A 43 43 TYR HA H 43 5.922 5.962 -0.040 2
1 448 . 1 1 A 43 43 TYR C C 43 171.219 173.113 -1.894 2
1 449 . 1 1 A 43 43 TYR CA C 43 53.349 56.193 -2.844 2
1 450 . 1 1 A 43 43 TYR CB C 43 41.074 42.211 -1.137 2
1 455 . 1 1 A 43 43 TYR N N 43 118.018 119.585 -1.567 2
1 456 . 1 1 A 44 44 ARG H H 44 8.400 8.602 -0.202 2
1 457 . 1 1 A 44 44 ARG HA H 44 4.542 4.557 -0.015 2
1 464 . 1 1 A 44 44 ARG C C 44 171.974 174.220 -2.246 2
1 465 . 1 1 A 44 44 ARG CA C 44 52.453 54.901 -2.448 2
1 466 . 1 1 A 44 44 ARG CB C 44 31.125 33.149 -2.024 2
1 469 . 1 1 A 44 44 ARG N N 44 115.214 120.174 -4.959 2
1 470 . 1 1 A 45 45 ALA H H 45 8.846 8.247 0.599 2
1 471 . 1 1 A 45 45 ALA HA H 45 3.894 2.643 1.251 2
1 475 . 1 1 A 45 45 ALA C C 45 175.721 177.013 -1.292 2
1 476 . 1 1 A 45 45 ALA CA C 45 50.372 52.147 -1.775 2
1 477 . 1 1 A 45 45 ALA CB C 45 15.732 18.815 -3.083 2
1 478 . 1 1 A 45 45 ALA N N 45 126.463 126.623 -0.160 2
1 479 . 1 1 A 46 46 ALA H H 46 8.282 8.184 0.098 2
1 480 . 1 1 A 46 46 ALA HA H 46 3.922 3.943 -0.021 2
1 484 . 1 1 A 46 46 ALA C C 46 176.236 177.986 -1.750 2
1 485 . 1 1 A 46 46 ALA CA C 46 50.773 53.272 -2.499 2
1 486 . 1 1 A 46 46 ALA CB C 46 16.244 18.200 -1.956 2
1 487 . 1 1 A 46 46 ALA N N 46 126.301 125.534 0.768 2
1 488 . 1 1 A 47 47 GLY HA2 H 47 3.882 3.953 -0.071 2
1 489 . 1 1 A 47 47 GLY HA3 H 47 3.695 3.981 -0.286 2
1 490 . 1 1 A 47 47 GLY C C 47 171.795 174.375 -2.580 2
1 491 . 1 1 A 47 47 GLY CA C 47 43.327 45.483 -2.156 2
1 492 . 1 1 A 48 48 THR H H 48 7.145 7.658 -0.513 2
1 493 . 1 1 A 48 48 THR HA H 48 4.417 4.252 0.165 2
1 498 . 1 1 A 48 48 THR C C 48 171.325 174.235 -2.910 2
1 499 . 1 1 A 48 48 THR CA C 48 58.271 62.711 -4.440 2
1 500 . 1 1 A 48 48 THR CB C 48 68.846 69.577 -0.731 2
1 502 . 1 1 A 48 48 THR N N 48 110.190 115.836 -5.646 2
1 503 . 1 1 A 49 49 GLU H H 49 8.346 8.617 -0.271 2
1 504 . 1 1 A 49 49 GLU HA H 49 4.277 4.529 -0.252 2
1 509 . 1 1 A 49 49 GLU C C 49 174.109 175.785 -1.676 2
1 510 . 1 1 A 49 49 GLU CA C 49 52.909 56.033 -3.124 2
1 511 . 1 1 A 49 49 GLU CB C 49 27.845 29.144 -1.299 2
1 513 . 1 1 A 49 49 GLU N N 49 119.985 124.546 -4.561 2
1 514 . 1 1 A 50 50 GLY H H 50 7.617 8.162 -0.545 2
1 515 . 1 1 A 50 50 GLY HA2 H 50 3.935 4.118 -0.183 2
1 516 . 1 1 A 50 50 GLY HA3 H 50 3.935 4.153 -0.218 2
1 517 . 1 1 A 50 50 GLY C C 50 168.223 172.543 -4.320 2
1 518 . 1 1 A 50 50 GLY CA C 50 42.121 44.254 -2.133 2
1 519 . 1 1 A 50 50 GLY N N 50 108.670 109.790 -1.120 2
1 520 . 1 1 A 51 51 PRO HA H 51 4.298 4.661 -0.363 2
1 527 . 1 1 A 51 51 PRO C C 51 175.067 176.758 -1.691 2
1 528 . 1 1 A 51 51 PRO CA C 51 60.175 62.911 -2.736 2
1 529 . 1 1 A 51 51 PRO CB C 51 30.052 32.127 -2.075 2
1 532 . 1 1 A 52 52 PHE H H 52 8.442 8.629 -0.187 2
1 533 . 1 1 A 52 52 PHE HA H 52 3.981 4.623 -0.642 2
1 541 . 1 1 A 52 52 PHE C C 52 175.141 175.727 -0.586 2
1 542 . 1 1 A 52 52 PHE CA C 52 56.808 57.672 -0.864 2
1 543 . 1 1 A 52 52 PHE CB C 52 36.830 39.997 -3.167 2
1 549 . 1 1 A 52 52 PHE N N 52 118.707 121.834 -3.127 2
1 550 . 1 1 A 53 53 GLN H H 53 8.778 8.157 0.621 2
1 551 . 1 1 A 53 53 GLN HA H 53 4.149 4.254 -0.105 2
1 558 . 1 1 A 53 53 GLN C C 53 172.773 175.238 -2.465 2
1 559 . 1 1 A 53 53 GLN CA C 53 52.999 56.379 -3.380 2
1 560 . 1 1 A 53 53 GLN CB C 53 26.962 29.314 -2.352 2
1 562 . 1 1 A 53 53 GLN N N 53 122.164 121.617 0.547 2
1 564 . 1 1 A 54 54 GLU H H 54 8.432 8.603 -0.171 2
1 565 . 1 1 A 54 54 GLU HA H 54 5.533 5.101 0.432 2
1 570 . 1 1 A 54 54 GLU C C 54 173.930 174.758 -0.828 2
1 571 . 1 1 A 54 54 GLU CA C 54 52.981 55.338 -2.357 2
1 572 . 1 1 A 54 54 GLU CB C 54 31.712 33.146 -1.434 2
1 574 . 1 1 A 54 54 GLU N N 54 119.688 121.568 -1.880 2
1 575 . 1 1 A 55 55 VAL H H 55 9.077 8.774 0.303 2
1 576 . 1 1 A 55 55 VAL HA H 55 4.180 4.873 -0.693 2
1 584 . 1 1 A 55 55 VAL C C 55 171.811 174.461 -2.650 2
1 585 . 1 1 A 55 55 VAL CA C 55 59.664 61.147 -1.483 2
1 586 . 1 1 A 55 55 VAL CB C 55 31.827 34.512 -2.685 2
1 589 . 1 1 A 55 55 VAL N N 55 125.328 126.150 -0.822 2
1 590 . 1 1 A 56 56 ASP H H 56 8.639 8.840 -0.201 2
1 591 . 1 1 A 56 56 ASP HA H 56 5.250 5.584 -0.334 2
1 594 . 1 1 A 56 56 ASP C C 56 174.252 175.969 -1.717 2
1 595 . 1 1 A 56 56 ASP CA C 56 50.108 52.304 -2.196 2
1 596 . 1 1 A 56 56 ASP CB C 56 41.407 44.105 -2.698 2
1 597 . 1 1 A 56 56 ASP N N 56 125.773 125.092 0.681 2
1 598 . 1 1 A 57 57 GLY H H 57 7.222 8.601 -1.379 2
1 599 . 1 1 A 57 57 GLY HA2 H 57 3.479 3.865 -0.386 2
1 600 . 1 1 A 57 57 GLY HA3 H 57 2.719 3.934 -1.215 2
1 601 . 1 1 A 57 57 GLY C C 57 172.281 174.408 -2.127 2
1 602 . 1 1 A 57 57 GLY CA C 57 43.919 45.364 -1.445 2
1 603 . 1 1 A 57 57 GLY N N 57 105.564 110.878 -5.314 2
1 604 . 1 1 A 58 58 VAL H H 58 8.338 8.024 0.314 2
1 605 . 1 1 A 58 58 VAL HA H 58 3.860 4.310 -0.450 2
1 613 . 1 1 A 58 58 VAL C C 58 173.981 175.398 -1.417 2
1 614 . 1 1 A 58 58 VAL CA C 58 61.233 61.652 -0.419 2
1 615 . 1 1 A 58 58 VAL CB C 58 29.708 31.608 -1.900 2
1 618 . 1 1 A 58 58 VAL N N 58 121.466 121.216 0.250 2
1 619 . 1 1 A 59 59 ALA H H 59 9.038 8.729 0.309 2
1 620 . 1 1 A 59 59 ALA HA H 59 4.676 4.595 0.081 2
1 624 . 1 1 A 59 59 ALA C C 59 175.105 176.792 -1.687 2
1 625 . 1 1 A 59 59 ALA CA C 59 50.866 52.168 -1.302 2
1 626 . 1 1 A 59 59 ALA CB C 59 17.647 19.166 -1.519 2
1 627 . 1 1 A 59 59 ALA N N 59 130.928 130.200 0.728 2
1 628 . 1 1 A 60 60 THR H H 60 7.445 7.739 -0.295 2
1 629 . 1 1 A 60 60 THR HA H 60 4.642 4.669 -0.027 2
1 634 . 1 1 A 60 60 THR C C 60 169.528 174.224 -4.696 2
1 635 . 1 1 A 60 60 THR CA C 60 57.101 59.397 -2.296 2
1 636 . 1 1 A 60 60 THR CB C 60 67.982 72.217 -4.235 2
1 638 . 1 1 A 60 60 THR N N 60 109.256 109.291 -0.035 2
1 639 . 1 1 A 61 61 THR H H 61 7.325 8.343 -1.018 2
1 640 . 1 1 A 61 61 THR HA H 61 2.896 3.575 -0.679 2
1 645 . 1 1 A 61 61 THR C C 61 169.678 172.976 -3.298 2
1 646 . 1 1 A 61 61 THR CA C 61 57.246 61.692 -4.446 2
1 647 . 1 1 A 61 61 THR CB C 61 63.794 68.575 -4.781 2
1 649 . 1 1 A 61 61 THR N N 61 105.670 111.070 -5.400 2
1 650 . 1 1 A 62 62 ARG H H 62 6.490 7.165 -0.675 2
1 651 . 1 1 A 62 62 ARG HA H 62 4.698 4.509 0.189 2
1 658 . 1 1 A 62 62 ARG C C 62 172.881 173.766 -0.885 2
1 659 . 1 1 A 62 62 ARG CA C 62 52.276 54.452 -2.176 2
1 660 . 1 1 A 62 62 ARG CB C 62 30.774 33.312 -2.538 2
1 663 . 1 1 A 62 62 ARG N N 62 117.485 121.774 -4.289 2
1 664 . 1 1 A 63 63 TYR H H 63 8.891 8.730 0.161 2
1 665 . 1 1 A 63 63 TYR HA H 63 4.356 5.220 -0.864 2
1 672 . 1 1 A 63 63 TYR C C 63 170.393 173.781 -3.388 2
1 673 . 1 1 A 63 63 TYR CA C 63 57.284 57.414 -0.130 2
1 674 . 1 1 A 63 63 TYR CB C 63 41.467 42.468 -1.001 2
1 679 . 1 1 A 63 63 TYR N N 63 124.712 126.907 -2.195 2
1 680 . 1 1 A 64 64 SER H H 64 7.244 8.325 -1.081 2
1 681 . 1 1 A 64 64 SER HA H 64 5.077 5.573 -0.496 2
1 684 . 1 1 A 64 64 SER C C 64 169.712 173.256 -3.544 2
1 685 . 1 1 A 64 64 SER CA C 64 54.181 55.755 -1.574 2
1 686 . 1 1 A 64 64 SER CB C 64 61.122 65.394 -4.272 2
1 687 . 1 1 A 64 64 SER N N 64 120.593 120.392 0.201 2
1 688 . 1 1 A 65 65 ILE H H 65 8.686 8.870 -0.184 2
1 689 . 1 1 A 65 65 ILE HA H 65 3.937 4.851 -0.914 2
1 699 . 1 1 A 65 65 ILE C C 65 172.217 175.248 -3.031 2
1 700 . 1 1 A 65 65 ILE CA C 65 58.288 59.592 -1.304 2
1 701 . 1 1 A 65 65 ILE CB C 65 36.110 40.019 -3.909 2
1 705 . 1 1 A 65 65 ILE N N 65 127.792 125.172 2.620 2
1 706 . 1 1 A 66 66 GLY H H 66 7.883 8.577 -0.694 2
1 707 . 1 1 A 66 66 GLY HA2 H 66 4.799 4.247 0.553 2
1 708 . 1 1 A 66 66 GLY HA3 H 66 3.468 4.266 -0.799 2
1 709 . 1 1 A 66 66 GLY C C 66 171.983 174.018 -2.035 2
1 710 . 1 1 A 66 66 GLY CA C 66 40.534 44.782 -4.248 2
1 711 . 1 1 A 66 66 GLY N N 66 112.632 113.590 -0.958 2
1 712 . 1 1 A 67 67 GLY H H 67 8.483 8.357 0.126 2
1 713 . 1 1 A 67 67 GLY HA2 H 67 3.836 3.966 -0.130 2
1 714 . 1 1 A 67 67 GLY HA3 H 67 3.682 3.988 -0.306 2
1 715 . 1 1 A 67 67 GLY C C 67 172.954 174.272 -1.318 2
1 716 . 1 1 A 67 67 GLY CA C 67 43.568 46.001 -2.433 2
1 717 . 1 1 A 67 67 GLY N N 67 104.625 109.630 -5.005 2
1 718 . 1 1 A 68 68 LEU H H 68 8.236 7.646 0.590 2
1 719 . 1 1 A 68 68 LEU HA H 68 4.154 4.678 -0.524 2
1 729 . 1 1 A 68 68 LEU C C 68 173.838 175.674 -1.836 2
1 730 . 1 1 A 68 68 LEU CA C 68 51.025 53.267 -2.242 2
1 731 . 1 1 A 68 68 LEU CB C 68 38.837 43.182 -4.345 2
1 735 . 1 1 A 68 68 LEU N N 68 118.919 121.453 -2.534 2
1 736 . 1 1 A 69 69 SER H H 69 8.284 8.820 -0.536 2
1 737 . 1 1 A 69 69 SER HA H 69 4.765 5.079 -0.314 2
1 740 . 1 1 A 69 69 SER C C 69 170.044 172.580 -2.536 2
1 741 . 1 1 A 69 69 SER CA C 69 54.639 55.544 -0.905 2
1 742 . 1 1 A 69 69 SER CB C 69 61.216 63.990 -2.774 2
1 743 . 1 1 A 69 69 SER N N 69 116.361 117.003 -0.642 2
1 744 . 1 1 A 70 70 PRO HA H 70 5.141 4.676 0.465 2
1 751 . 1 1 A 70 70 PRO C C 70 174.858 177.481 -2.623 2
1 752 . 1 1 A 70 70 PRO CA C 70 60.810 63.953 -3.143 2
1 753 . 1 1 A 70 70 PRO CB C 70 30.657 31.923 -1.266 2
1 756 . 1 1 A 71 71 PHE H H 71 8.139 9.116 -0.977 2
1 757 . 1 1 A 71 71 PHE HA H 71 4.202 4.299 -0.097 2
1 765 . 1 1 A 71 71 PHE C C 71 172.870 174.442 -1.572 2
1 766 . 1 1 A 71 71 PHE CA C 71 55.410 59.036 -3.627 2
1 767 . 1 1 A 71 71 PHE CB C 71 36.027 37.697 -1.670 2
1 773 . 1 1 A 71 71 PHE N N 71 125.409 123.138 2.271 2
1 774 . 1 1 A 72 72 SER H H 72 8.182 7.539 0.643 2
1 775 . 1 1 A 72 72 SER HA H 72 4.755 5.023 -0.268 2
1 778 . 1 1 A 72 72 SER C C 72 168.850 172.681 -3.831 2
1 779 . 1 1 A 72 72 SER CA C 72 55.926 56.406 -0.480 2
1 780 . 1 1 A 72 72 SER CB C 72 64.208 66.783 -2.575 2
1 781 . 1 1 A 72 72 SER N N 72 113.509 110.532 2.977 2
1 782 . 1 1 A 73 73 GLU H H 73 8.422 8.742 -0.320 2
1 783 . 1 1 A 73 73 GLU HA H 73 4.966 5.177 -0.211 2
1 788 . 1 1 A 73 73 GLU C C 73 173.192 174.665 -1.473 2
1 789 . 1 1 A 73 73 GLU CA C 73 52.815 54.868 -2.053 2
1 790 . 1 1 A 73 73 GLU CB C 73 29.416 32.752 -3.336 2
1 792 . 1 1 A 73 73 GLU N N 73 123.046 122.441 0.605 2
1 793 . 1 1 A 74 74 TYR H H 74 9.205 8.787 0.418 2
1 794 . 1 1 A 74 74 TYR HA H 74 4.799 5.006 -0.207 2
1 801 . 1 1 A 74 74 TYR C C 74 170.775 174.229 -3.454 2
1 802 . 1 1 A 74 74 TYR CA C 74 55.291 56.736 -1.445 2
1 803 . 1 1 A 74 74 TYR CB C 74 42.943 42.587 0.356 2
1 808 . 1 1 A 74 74 TYR N N 74 125.351 124.499 0.852 2
1 809 . 1 1 A 75 75 ALA H H 75 8.639 8.273 0.366 2
1 810 . 1 1 A 75 75 ALA HA H 75 5.271 5.340 -0.069 2
1 814 . 1 1 A 75 75 ALA C C 75 173.698 176.064 -2.366 2
1 815 . 1 1 A 75 75 ALA CA C 75 47.904 50.289 -2.385 2
1 816 . 1 1 A 75 75 ALA CB C 75 19.634 20.802 -1.168 2
1 817 . 1 1 A 75 75 ALA N N 75 121.555 124.449 -2.894 2
1 818 . 1 1 A 76 76 PHE H H 76 9.066 9.407 -0.341 2
1 819 . 1 1 A 76 76 PHE HA H 76 5.496 5.339 0.157 2
1 827 . 1 1 A 76 76 PHE C C 76 172.268 175.162 -2.894 2
1 828 . 1 1 A 76 76 PHE CA C 76 54.216 56.963 -2.747 2
1 829 . 1 1 A 76 76 PHE CB C 76 41.901 41.777 0.124 2
1 835 . 1 1 A 76 76 PHE N N 76 116.545 122.454 -5.909 2
1 836 . 1 1 A 77 77 ARG H H 77 9.216 8.911 0.305 2
1 837 . 1 1 A 77 77 ARG HA H 77 4.357 5.165 -0.808 2
1 845 . 1 1 A 77 77 ARG C C 77 169.998 174.112 -4.114 2
1 846 . 1 1 A 77 77 ARG CA C 77 52.414 54.792 -2.378 2
1 847 . 1 1 A 77 77 ARG CB C 77 30.794 33.928 -3.134 2
1 850 . 1 1 A 77 77 ARG N N 77 115.738 119.165 -3.427 2
1 852 . 1 1 A 78 78 VAL H H 78 8.135 8.793 -0.658 2
1 853 . 1 1 A 78 78 VAL HA H 78 4.884 4.762 0.122 2
1 861 . 1 1 A 78 78 VAL C C 78 171.098 174.792 -3.694 2
1 862 . 1 1 A 78 78 VAL CA C 78 57.566 60.846 -3.280 2
1 863 . 1 1 A 78 78 VAL CB C 78 33.146 33.121 0.025 2
1 866 . 1 1 A 78 78 VAL N N 78 117.942 124.140 -6.198 2
1 867 . 1 1 A 79 79 LEU H H 79 9.167 8.452 0.715 2
1 868 . 1 1 A 79 79 LEU HA H 79 4.575 4.956 -0.381 2
1 878 . 1 1 A 79 79 LEU C C 79 171.447 174.989 -3.542 2
1 879 . 1 1 A 79 79 LEU CA C 79 51.642 53.492 -1.849 2
1 880 . 1 1 A 79 79 LEU CB C 79 42.776 45.669 -2.893 2
1 884 . 1 1 A 79 79 LEU N N 79 123.913 120.234 3.679 2
1 885 . 1 1 A 80 80 ALA H H 80 9.325 8.577 0.748 2
1 886 . 1 1 A 80 80 ALA HA H 80 4.654 3.787 0.867 2
1 890 . 1 1 A 80 80 ALA C C 80 172.070 176.952 -4.882 2
1 891 . 1 1 A 80 80 ALA CA C 80 48.169 51.398 -3.229 2
1 892 . 1 1 A 80 80 ALA CB C 80 20.366 19.487 0.879 2
1 893 . 1 1 A 80 80 ALA N N 80 124.135 123.401 0.734 2
1 894 . 1 1 A 81 81 VAL H H 81 7.953 8.018 -0.065 2
1 895 . 1 1 A 81 81 VAL HA H 81 4.293 4.745 -0.452 2
1 903 . 1 1 A 81 81 VAL C C 81 172.873 174.304 -1.431 2
1 904 . 1 1 A 81 81 VAL CA C 81 58.959 60.419 -1.460 2
1 905 . 1 1 A 81 81 VAL CB C 81 31.412 34.923 -3.511 2
1 908 . 1 1 A 81 81 VAL N N 81 118.503 120.625 -2.122 2
1 909 . 1 1 A 82 82 ASN H H 82 8.262 8.420 -0.158 2
1 910 . 1 1 A 82 82 ASN HA H 82 4.945 5.151 -0.206 2
1 915 . 1 1 A 82 82 ASN C C 82 173.273 175.395 -2.122 2
1 916 . 1 1 A 82 82 ASN CA C 82 48.714 51.617 -2.903 2
1 917 . 1 1 A 82 82 ASN CB C 82 36.796 40.183 -3.387 2
1 918 . 1 1 A 82 82 ASN N N 82 125.425 123.889 1.536 2
1 920 . 1 1 A 83 83 SER HA H 83 3.966 4.102 -0.136 2
1 923 . 1 1 A 83 83 SER C C 83 172.812 176.827 -4.015 2
1 924 . 1 1 A 83 83 SER CA C 83 59.047 62.242 -3.195 2
1 925 . 1 1 A 83 83 SER CB C 83 60.406 62.845 -2.439 2
1 926 . 1 1 A 84 84 ILE H H 84 7.803 7.927 -0.124 2
1 927 . 1 1 A 84 84 ILE HA H 84 3.862 3.774 0.088 2
1 937 . 1 1 A 84 84 ILE C C 84 174.481 176.158 -1.677 2
1 938 . 1 1 A 84 84 ILE CA C 84 59.188 64.132 -4.944 2
1 939 . 1 1 A 84 84 ILE CB C 84 34.677 38.290 -3.613 2
1 943 . 1 1 A 84 84 ILE N N 84 121.222 119.292 1.930 2
1 944 . 1 1 A 85 85 GLY H H 85 7.435 7.322 0.113 2
1 945 . 1 1 A 85 85 GLY HA2 H 85 4.149 4.036 0.113 2
1 946 . 1 1 A 85 85 GLY HA3 H 85 3.747 4.040 -0.293 2
1 947 . 1 1 A 85 85 GLY C C 85 168.589 172.233 -3.644 2
1 948 . 1 1 A 85 85 GLY CA C 85 42.931 45.311 -2.380 2
1 949 . 1 1 A 85 85 GLY N N 85 106.320 105.745 0.575 2
1 950 . 1 1 A 86 86 ARG H H 86 8.190 8.407 -0.217 2
1 951 . 1 1 A 86 86 ARG HA H 86 4.452 4.630 -0.178 2
1 958 . 1 1 A 86 86 ARG C C 86 175.286 176.270 -0.984 2
1 959 . 1 1 A 86 86 ARG CA C 86 53.223 55.347 -2.124 2
1 960 . 1 1 A 86 86 ARG CB C 86 29.517 30.853 -1.336 2
1 963 . 1 1 A 86 86 ARG N N 86 118.339 117.711 0.628 2
1 964 . 1 1 A 87 87 GLY H H 87 8.900 8.732 0.168 2
1 965 . 1 1 A 87 87 GLY HA2 H 87 4.211 4.000 0.211 2
1 966 . 1 1 A 87 87 GLY HA3 H 87 3.967 4.013 -0.046 2
1 967 . 1 1 A 87 87 GLY C C 87 168.101 172.807 -4.706 2
1 968 . 1 1 A 87 87 GLY CA C 87 42.281 44.099 -1.818 2
1 969 . 1 1 A 87 87 GLY N N 87 113.482 109.418 4.064 2
1 970 . 1 1 A 88 88 PRO HA H 88 4.563 4.564 -0.001 2
1 977 . 1 1 A 88 88 PRO CA C 88 60.994 62.111 -1.117 2
1 978 . 1 1 A 88 88 PRO CB C 88 29.873 31.607 -1.734 2
1 981 . 1 1 A 89 89 PRO HA H 89 4.490 4.469 0.021 2
1 987 . 1 1 A 89 89 PRO C C 89 174.543 176.242 -1.699 2
1 988 . 1 1 A 89 89 PRO CA C 89 59.435 62.459 -3.024 2
1 989 . 1 1 A 89 89 PRO CB C 89 29.805 32.024 -2.219 2
1 992 . 1 1 A 90 90 SER H H 90 8.808 8.409 0.399 2
1 993 . 1 1 A 90 90 SER HA H 90 4.202 4.581 -0.379 2
1 996 . 1 1 A 90 90 SER C C 90 171.870 173.961 -2.091 2
1 997 . 1 1 A 90 90 SER CA C 90 55.868 57.545 -1.677 2
1 998 . 1 1 A 90 90 SER CB C 90 64.504 64.314 0.190 2
1 999 . 1 1 A 90 90 SER N N 90 113.781 116.802 -3.021 2
1 1000 . 1 1 A 91 91 GLU H H 91 8.291 8.537 -0.245 2
1 1001 . 1 1 A 91 91 GLU HA H 91 4.131 4.150 -0.019 2
1 1006 . 1 1 A 91 91 GLU C C 91 174.882 176.612 -1.730 2
1 1007 . 1 1 A 91 91 GLU CA C 91 54.984 56.947 -1.963 2
1 1008 . 1 1 A 91 91 GLU CB C 91 27.643 29.444 -1.801 2
1 1010 . 1 1 A 91 91 GLU N N 91 117.930 123.337 -5.407 2
1 1011 . 1 1 A 92 92 ALA H H 92 8.605 8.303 0.302 2
1 1012 . 1 1 A 92 92 ALA HA H 92 5.068 4.449 0.619 2
1 1016 . 1 1 A 92 92 ALA C C 92 176.227 177.865 -1.638 2
1 1017 . 1 1 A 92 92 ALA CA C 92 48.997 52.975 -3.978 2
1 1018 . 1 1 A 92 92 ALA CB C 92 17.756 19.152 -1.396 2
1 1019 . 1 1 A 92 92 ALA N N 92 126.421 127.376 -0.955 2
1 1020 . 1 1 A 93 93 VAL H H 93 9.051 9.120 -0.068 2
1 1021 . 1 1 A 93 93 VAL HA H 93 4.642 4.986 -0.344 2
1 1029 . 1 1 A 93 93 VAL C C 93 172.010 174.513 -2.503 2
1 1030 . 1 1 A 93 93 VAL CA C 93 57.495 59.562 -2.067 2
1 1031 . 1 1 A 93 93 VAL CB C 93 32.774 34.394 -1.620 2
1 1034 . 1 1 A 93 93 VAL N N 93 117.322 118.119 -0.797 2
1 1035 . 1 1 A 94 94 ARG H H 94 8.470 8.884 -0.414 2
1 1036 . 1 1 A 94 94 ARG HA H 94 5.692 5.263 0.429 2
1 1043 . 1 1 A 94 94 ARG C C 94 173.635 175.246 -1.611 2
1 1044 . 1 1 A 94 94 ARG CA C 94 52.038 54.766 -2.728 2
1 1045 . 1 1 A 94 94 ARG CB C 94 30.966 31.948 -0.982 2
1 1048 . 1 1 A 94 94 ARG N N 94 122.258 123.336 -1.078 2
1 1049 . 1 1 A 95 95 ALA H H 95 9.051 9.075 -0.024 2
1 1050 . 1 1 A 95 95 ALA HA H 95 4.642 5.273 -0.631 2
1 1054 . 1 1 A 95 95 ALA C C 95 172.285 175.182 -2.897 2
1 1055 . 1 1 A 95 95 ALA CA C 95 49.191 50.692 -1.501 2
1 1056 . 1 1 A 95 95 ALA CB C 95 22.562 22.235 0.327 2
1 1057 . 1 1 A 95 95 ALA N N 95 121.931 126.728 -4.797 2
1 1058 . 1 1 A 96 96 ARG H H 96 8.550 8.729 -0.179 2
1 1059 . 1 1 A 96 96 ARG HA H 96 5.407 5.147 0.260 2
1 1066 . 1 1 A 96 96 ARG C C 96 174.547 176.103 -1.556 2
1 1067 . 1 1 A 96 96 ARG CA C 96 51.439 55.150 -3.711 2
1 1068 . 1 1 A 96 96 ARG CB C 96 30.708 31.662 -0.954 2
1 1071 . 1 1 A 96 96 ARG N N 96 121.155 124.505 -3.350 2
1 1072 . 1 1 A 97 97 THR H H 97 8.797 8.915 -0.118 2
1 1073 . 1 1 A 97 97 THR HA H 97 4.116 4.515 -0.399 2
1 1078 . 1 1 A 97 97 THR C C 97 173.577 175.009 -1.432 2
1 1079 . 1 1 A 97 97 THR CA C 97 58.800 61.450 -2.650 2
1 1080 . 1 1 A 97 97 THR CB C 97 67.461 69.703 -2.242 2
1 1082 . 1 1 A 97 97 THR N N 97 114.657 117.458 -2.801 2
1 1083 . 1 1 A 98 98 GLY H H 98 7.505 8.428 -0.923 2
1 1084 . 1 1 A 98 98 GLY HA2 H 98 3.866 4.120 -0.254 2
1 1085 . 1 1 A 98 98 GLY HA3 H 98 3.743 4.172 -0.429 2
1 1086 . 1 1 A 98 98 GLY C C 98 170.637 173.580 -2.943 2
1 1087 . 1 1 A 98 98 GLY CA C 98 42.332 44.720 -2.388 2
1 1088 . 1 1 A 98 98 GLY N N 98 106.172 108.126 -1.954 2
1 1089 . 1 1 A 99 99 GLU H H 99 8.145 8.562 -0.418 2
1 1090 . 1 1 A 99 99 GLU HA H 99 4.210 4.884 -0.674 2
1 1095 . 1 1 A 99 99 GLU C C 99 174.134 175.773 -1.639 2
1 1096 . 1 1 A 99 99 GLU CA C 99 53.828 55.539 -1.711 2
1 1097 . 1 1 A 99 99 GLU CB C 99 28.774 30.721 -1.947 2
1 1099 . 1 1 A 99 99 GLU N N 99 117.634 117.945 -0.311 2
1 1100 . 1 1 A 100 100 GLN H H 100 8.647 8.445 0.202 2
1 1101 . 1 1 A 100 100 GLN HA H 100 4.247 4.477 -0.230 2
1 1108 . 1 1 A 100 100 GLN C C 100 173.348 175.315 -1.967 2
1 1109 . 1 1 A 100 100 GLN CA C 100 53.634 55.992 -2.358 2
1 1110 . 1 1 A 100 100 GLN CB C 100 27.392 31.022 -3.630 2
1 1112 . 1 1 A 100 100 GLN N N 100 121.960 121.541 0.419 2
1 1114 . 1 1 A 101 101 SER H H 101 8.416 8.624 -0.208 2
1 1115 . 1 1 A 101 101 SER HA H 101 4.418 4.303 0.115 2
1 1117 . 1 1 A 101 101 SER C C 101 172.148 174.190 -2.042 2
1 1118 . 1 1 A 101 101 SER CA C 101 55.926 58.848 -2.922 2
1 1119 . 1 1 A 101 101 SER CB C 101 61.617 62.577 -0.960 2
1 1120 . 1 1 A 101 101 SER N N 101 118.609 118.341 0.268 2
1 1121 . 1 1 A 102 102 GLY H H 102 8.233 8.139 0.094 2
1 1122 . 1 1 A 102 102 GLY HA2 H 102 4.080 4.012 0.068 2
1 1123 . 1 1 A 102 102 GLY HA3 H 102 3.981 4.023 -0.042 2
1 1124 . 1 1 A 102 102 GLY C C 102 169.461 173.796 -4.335 2
1 1125 . 1 1 A 102 102 GLY CA C 102 42.332 45.793 -3.461 2
1 1126 . 1 1 A 102 102 GLY N N 102 110.483 110.078 0.405 2
1 1127 . 1 1 A 103 103 PRO HA H 103 4.618 4.567 0.051 2
1 1134 . 1 1 A 103 103 PRO CA C 103 57.843 63.254 -5.411 2
1 1135 . 1 1 A 103 103 PRO CB C 103 28.671 31.831 -3.160 2
stop_
save_