data_15902_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15902
_Entry.PDB_ID 2K75
_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 7 . 1 1 1 A 2 2 ASP H H 2 8.890 7.915 0.975 1
1 8 . 1 1 1 A 2 2 ASP HA H 2 4.740 4.734 0.006 1
1 11 . 1 1 1 A 2 2 ASP C C 2 174.600 175.806 -1.206 1
1 12 . 1 1 1 A 2 2 ASP CA C 2 53.800 54.290 -0.490 1
1 13 . 1 1 1 A 2 2 ASP CB C 2 41.500 42.290 -0.790 1
1 14 . 1 1 1 A 2 2 ASP N N 2 122.100 122.178 -0.078 1
1 15 . 1 1 1 A 3 3 LEU H H 3 8.280 8.306 -0.026 1
1 16 . 1 1 1 A 3 3 LEU HA H 3 4.420 4.734 -0.314 1
1 26 . 1 1 1 A 3 3 LEU C C 3 176.900 176.210 0.690 1
1 27 . 1 1 1 A 3 3 LEU CA C 3 55.000 55.226 -0.226 1
1 28 . 1 1 1 A 3 3 LEU CB C 3 42.700 42.708 -0.008 1
1 32 . 1 1 1 A 3 3 LEU N N 3 122.300 123.483 -1.183 1
1 33 . 1 1 1 A 4 4 VAL H H 4 8.640 8.719 -0.079 1
1 34 . 1 1 1 A 4 4 VAL HA H 4 4.540 4.993 -0.453 1
1 42 . 1 1 1 A 4 4 VAL C C 4 175.800 175.058 0.742 1
1 43 . 1 1 1 A 4 4 VAL CA C 4 59.400 58.617 0.783 1
1 44 . 1 1 1 A 4 4 VAL CB C 4 35.400 35.851 -0.451 1
1 47 . 1 1 1 A 4 4 VAL N N 4 122.600 119.413 3.187 1
1 48 . 1 1 1 A 5 5 LYS H H 5 8.630 8.659 -0.029 1
1 49 . 1 1 1 A 5 5 LYS HA H 5 4.450 4.453 -0.003 1
1 58 . 1 1 1 A 5 5 LYS C C 5 179.400 178.489 0.911 1
1 59 . 1 1 1 A 5 5 LYS CA C 5 53.600 55.708 -2.108 1
1 60 . 1 1 1 A 5 5 LYS CB C 5 30.900 33.331 -2.431 1
1 64 . 1 1 1 A 5 5 LYS N N 5 121.100 121.553 -0.453 1
1 65 . 1 1 1 A 6 6 ILE H H 6 10.320 8.844 1.476 1
1 66 . 1 1 1 A 6 6 ILE HA H 6 3.440 3.708 -0.268 1
1 76 . 1 1 1 A 6 6 ILE C C 6 178.300 177.971 0.329 1
1 77 . 1 1 1 A 6 6 ILE CA C 6 65.700 64.992 0.708 1
1 78 . 1 1 1 A 6 6 ILE CB C 6 35.900 37.669 -1.769 1
1 82 . 1 1 1 A 6 6 ILE N N 6 125.400 122.679 2.721 1
1 83 . 1 1 1 A 7 7 ARG H H 7 8.210 8.004 0.206 1
1 84 . 1 1 1 A 7 7 ARG HA H 7 3.850 4.070 -0.220 1
1 92 . 1 1 1 A 7 7 ARG C C 7 175.600 177.395 -1.795 1
1 93 . 1 1 1 A 7 7 ARG CA C 7 57.800 58.944 -1.144 1
1 94 . 1 1 1 A 7 7 ARG CB C 7 30.300 29.811 0.489 1
1 98 . 1 1 1 A 7 7 ARG N N 7 118.800 121.347 -2.547 1
1 100 . 1 1 1 A 8 8 ASP H H 8 7.850 7.702 0.148 1
1 101 . 1 1 1 A 8 8 ASP HA H 8 4.700 4.697 0.003 1
1 104 . 1 1 1 A 8 8 ASP C C 8 176.100 176.452 -0.352 1
1 105 . 1 1 1 A 8 8 ASP CA C 8 54.100 54.553 -0.453 1
1 106 . 1 1 1 A 8 8 ASP CB C 8 41.200 41.365 -0.165 1
1 107 . 1 1 1 A 8 8 ASP N N 8 116.800 117.342 -0.542 1
1 108 . 1 1 1 A 9 9 VAL H H 9 7.240 7.271 -0.031 1
1 109 . 1 1 1 A 9 9 VAL HA H 9 3.710 3.961 -0.251 1
1 117 . 1 1 1 A 9 9 VAL C C 9 174.900 175.450 -0.550 1
1 118 . 1 1 1 A 9 9 VAL CA C 9 64.300 63.363 0.937 1
1 119 . 1 1 1 A 9 9 VAL CB C 9 31.500 31.647 -0.147 1
1 122 . 1 1 1 A 9 9 VAL N N 9 121.800 122.084 -0.284 1
1 123 . 1 1 1 A 10 10 SER H H 10 8.600 8.491 0.109 1
1 124 . 1 1 1 A 10 10 SER HA H 10 4.600 4.637 -0.037 1
1 127 . 1 1 1 A 10 10 SER CA C 10 56.700 57.199 -0.499 1
1 128 . 1 1 1 A 10 10 SER CB C 10 66.100 65.566 0.534 1
1 129 . 1 1 1 A 10 10 SER N N 10 122.200 120.786 1.414 1
1 130 . 1 1 1 A 11 11 LEU H H 11 8.660 9.005 -0.345 1
1 131 . 1 1 1 A 11 11 LEU HA H 11 3.900 4.077 -0.177 1
1 141 . 1 1 1 A 11 11 LEU C C 11 178.100 179.188 -1.088 1
1 142 . 1 1 1 A 11 11 LEU CA C 11 56.700 57.244 -0.544 1
1 143 . 1 1 1 A 11 11 LEU CB C 11 41.400 41.461 -0.061 1
1 147 . 1 1 1 A 11 11 LEU N N 11 120.300 123.064 -2.764 1
1 148 . 1 1 1 A 12 12 SER H H 12 8.160 8.023 0.137 1
1 149 . 1 1 1 A 12 12 SER HA H 12 4.270 4.261 0.009 1
1 152 . 1 1 1 A 12 12 SER C C 12 174.200 174.816 -0.616 1
1 153 . 1 1 1 A 12 12 SER CA C 12 59.900 60.695 -0.795 1
1 154 . 1 1 1 A 12 12 SER CB C 12 63.100 62.818 0.282 1
1 155 . 1 1 1 A 12 12 SER N N 12 112.100 113.565 -1.465 1
1 156 . 1 1 1 A 13 13 THR H H 13 7.460 7.489 -0.029 1
1 157 . 1 1 1 A 13 13 THR HA H 13 4.760 4.719 0.041 1
1 162 . 1 1 1 A 13 13 THR CA C 13 56.600 58.968 -2.368 1
1 163 . 1 1 1 A 13 13 THR CB C 13 70.100 68.988 1.112 1
1 165 . 1 1 1 A 13 13 THR N N 13 114.700 109.200 5.500 1
1 166 . 1 1 1 A 14 14 PRO HA H 14 4.050 4.258 -0.208 1
1 173 . 1 1 1 A 14 14 PRO C C 14 175.800 175.871 -0.071 1
1 174 . 1 1 1 A 14 14 PRO CA C 14 65.100 64.820 0.280 1
1 175 . 1 1 1 A 14 14 PRO CB C 14 32.100 31.347 0.753 1
1 178 . 1 1 1 A 15 15 TYR H H 15 7.380 7.694 -0.314 1
1 179 . 1 1 1 A 15 15 TYR HA H 15 5.570 5.538 0.032 1
1 186 . 1 1 1 A 15 15 TYR C C 15 176.100 175.335 0.765 1
1 187 . 1 1 1 A 15 15 TYR CA C 15 56.400 56.872 -0.472 1
1 188 . 1 1 1 A 15 15 TYR CB C 15 41.500 40.617 0.883 1
1 193 . 1 1 1 A 15 15 TYR N N 15 113.800 117.193 -3.393 1
1 194 . 1 1 1 A 16 16 VAL H H 16 9.010 8.781 0.229 1
1 195 . 1 1 1 A 16 16 VAL HA H 16 4.920 4.981 -0.061 1
1 203 . 1 1 1 A 16 16 VAL C C 16 174.300 173.392 0.908 1
1 204 . 1 1 1 A 16 16 VAL CA C 16 59.600 59.680 -0.080 1
1 205 . 1 1 1 A 16 16 VAL CB C 16 36.800 36.387 0.413 1
1 208 . 1 1 1 A 16 16 VAL N N 16 113.800 117.880 -4.080 1
1 209 . 1 1 1 A 17 17 SER H H 17 7.960 9.047 -1.087 1
1 210 . 1 1 1 A 17 17 SER HA H 17 5.860 5.568 0.292 1
1 213 . 1 1 1 A 17 17 SER C C 17 172.700 173.175 -0.475 1
1 214 . 1 1 1 A 17 17 SER CA C 17 57.300 56.385 0.915 1
1 215 . 1 1 1 A 17 17 SER CB C 17 64.000 64.971 -0.971 1
1 216 . 1 1 1 A 17 17 SER N N 17 117.100 117.433 -0.333 1
1 217 . 1 1 1 A 18 18 VAL H H 18 8.570 8.828 -0.258 1
1 218 . 1 1 1 A 18 18 VAL HA H 18 4.900 5.171 -0.271 1
1 226 . 1 1 1 A 18 18 VAL C C 18 173.700 173.627 0.073 1
1 227 . 1 1 1 A 18 18 VAL CA C 18 58.800 59.022 -0.222 1
1 228 . 1 1 1 A 18 18 VAL CB C 18 36.700 36.018 0.682 1
1 231 . 1 1 1 A 18 18 VAL N N 18 113.500 119.671 -6.171 1
1 232 . 1 1 1 A 19 19 ILE H H 19 8.490 8.611 -0.121 1
1 233 . 1 1 1 A 19 19 ILE HA H 19 5.300 4.909 0.391 1
1 243 . 1 1 1 A 19 19 ILE C C 19 175.800 174.822 0.978 1
1 244 . 1 1 1 A 19 19 ILE CA C 19 59.700 59.426 0.274 1
1 245 . 1 1 1 A 19 19 ILE CB C 19 41.700 42.251 -0.551 1
1 249 . 1 1 1 A 19 19 ILE N N 19 120.600 121.850 -1.250 1
1 250 . 1 1 1 A 20 20 GLY H H 20 8.670 7.986 0.684 1
1 251 . 1 1 1 A 20 20 GLY HA2 H 20 3.760 4.147 -0.387 1
1 252 . 1 1 1 A 20 20 GLY HA3 H 20 4.190 4.151 0.039 1
1 253 . 1 1 1 A 20 20 GLY C C 20 169.900 172.222 -2.322 1
1 254 . 1 1 1 A 20 20 GLY CA C 20 46.000 45.979 0.021 1
1 255 . 1 1 1 A 20 20 GLY N N 20 110.200 113.651 -3.451 1
1 256 . 1 1 1 A 21 21 LYS H H 21 8.920 8.384 0.536 1
1 257 . 1 1 1 A 21 21 LYS HA H 21 5.210 5.313 -0.103 1
1 266 . 1 1 1 A 21 21 LYS C C 21 176.400 174.994 1.406 1
1 267 . 1 1 1 A 21 21 LYS CA C 21 54.400 54.581 -0.181 1
1 268 . 1 1 1 A 21 21 LYS CB C 21 35.400 35.492 -0.092 1
1 272 . 1 1 1 A 21 21 LYS N N 21 119.100 116.938 2.162 1
1 273 . 1 1 1 A 22 22 ILE H H 22 8.900 8.458 0.442 1
1 274 . 1 1 1 A 22 22 ILE HA H 22 5.050 5.129 -0.079 1
1 284 . 1 1 1 A 22 22 ILE C C 22 176.900 175.383 1.517 1
1 285 . 1 1 1 A 22 22 ILE CA C 22 57.800 60.602 -2.802 1
1 286 . 1 1 1 A 22 22 ILE CB C 22 36.200 39.371 -3.171 1
1 290 . 1 1 1 A 22 22 ILE N N 22 130.000 124.976 5.024 1
1 291 . 1 1 1 A 23 23 THR H H 23 9.020 9.060 -0.040 1
1 292 . 1 1 1 A 23 23 THR HA H 23 4.660 4.998 -0.338 1
1 297 . 1 1 1 A 23 23 THR C C 23 174.000 173.977 0.023 1
1 298 . 1 1 1 A 23 23 THR CA C 23 60.800 59.850 0.950 1
1 299 . 1 1 1 A 23 23 THR CB C 23 73.400 71.756 1.644 1
1 301 . 1 1 1 A 23 23 THR N N 23 118.200 117.350 0.850 1
1 302 . 1 1 1 A 24 24 GLY H H 24 8.430 8.728 -0.298 1
1 303 . 1 1 1 A 24 24 GLY HA2 H 24 3.910 3.806 0.104 1
1 304 . 1 1 1 A 24 24 GLY HA3 H 24 3.910 3.936 -0.026 1
1 305 . 1 1 1 A 24 24 GLY C C 24 175.400 174.609 0.791 1
1 306 . 1 1 1 A 24 24 GLY CA C 24 47.100 46.913 0.187 1
1 307 . 1 1 1 A 24 24 GLY N N 24 107.200 111.395 -4.195 1
1 308 . 1 1 1 A 25 25 ILE H H 25 9.370 8.277 1.093 1
1 309 . 1 1 1 A 25 25 ILE HA H 25 4.480 4.282 0.198 1
1 319 . 1 1 1 A 25 25 ILE C C 25 178.200 175.722 2.478 1
1 320 . 1 1 1 A 25 25 ILE CA C 25 59.200 61.063 -1.863 1
1 321 . 1 1 1 A 25 25 ILE CB C 25 35.400 38.744 -3.344 1
1 325 . 1 1 1 A 25 25 ILE N N 25 120.600 121.697 -1.097 1
1 326 . 1 1 1 A 26 26 HIS H H 26 9.000 9.626 -0.626 1
1 327 . 1 1 1 A 26 26 HIS HA H 26 4.770 5.267 -0.497 1
1 330 . 1 1 1 A 26 26 HIS C C 26 172.700 173.626 -0.926 1
1 331 . 1 1 1 A 26 26 HIS CA C 26 55.000 54.145 0.855 1
1 332 . 1 1 1 A 26 26 HIS CB C 26 31.100 33.501 -2.401 1
1 333 . 1 1 1 A 26 26 HIS N N 26 123.800 125.936 -2.136 1
1 334 . 1 1 1 A 27 27 LYS H H 27 8.930 9.007 -0.077 1
1 335 . 1 1 1 A 27 27 LYS HA H 27 4.770 4.751 0.019 1
1 344 . 1 1 1 A 27 27 LYS C C 27 175.300 174.870 0.430 1
1 345 . 1 1 1 A 27 27 LYS CA C 27 55.100 54.762 0.338 1
1 346 . 1 1 1 A 27 27 LYS CB C 27 34.400 35.010 -0.610 1
1 350 . 1 1 1 A 27 27 LYS N N 27 125.900 123.797 2.103 1
1 351 . 1 1 1 A 28 28 LYS H H 28 8.880 8.293 0.587 1
1 352 . 1 1 1 A 28 28 LYS HA H 28 4.570 5.043 -0.473 1
1 361 . 1 1 1 A 28 28 LYS C C 28 174.500 173.875 0.625 1
1 362 . 1 1 1 A 28 28 LYS CA C 28 54.600 54.960 -0.360 1
1 363 . 1 1 1 A 28 28 LYS CB C 28 35.300 36.601 -1.301 1
1 367 . 1 1 1 A 28 28 LYS N N 28 127.400 126.601 0.799 1
1 368 . 1 1 1 A 29 29 GLU H H 29 8.440 8.511 -0.071 1
1 369 . 1 1 1 A 29 29 GLU HA H 29 5.260 5.202 0.058 1
1 374 . 1 1 1 A 29 29 GLU C C 29 175.800 175.529 0.271 1
1 375 . 1 1 1 A 29 29 GLU CA C 29 54.800 54.876 -0.076 1
1 376 . 1 1 1 A 29 29 GLU CB C 29 31.500 33.145 -1.645 1
1 378 . 1 1 1 A 29 29 GLU N N 29 122.200 124.601 -2.401 1
1 379 . 1 1 1 A 30 30 TYR H H 30 8.960 8.792 0.168 1
1 380 . 1 1 1 A 30 30 TYR HA H 30 4.820 5.282 -0.462 1
1 387 . 1 1 1 A 30 30 TYR C C 30 172.600 172.779 -0.179 1
1 388 . 1 1 1 A 30 30 TYR CA C 30 56.300 55.538 0.762 1
1 389 . 1 1 1 A 30 30 TYR CB C 30 40.500 41.491 -0.991 1
1 394 . 1 1 1 A 30 30 TYR N N 30 121.100 118.777 2.323 1
1 395 . 1 1 1 A 31 31 GLU H H 31 8.610 8.672 -0.062 1
1 396 . 1 1 1 A 31 31 GLU HA H 31 4.810 4.543 0.267 1
1 401 . 1 1 1 A 31 31 GLU C C 31 176.100 175.014 1.086 1
1 402 . 1 1 1 A 31 31 GLU CA C 31 55.100 56.091 -0.991 1
1 403 . 1 1 1 A 31 31 GLU CB C 31 30.300 30.415 -0.115 1
1 405 . 1 1 1 A 31 31 GLU N N 31 121.800 120.411 1.389 1
1 406 . 1 1 1 A 32 32 SER H H 32 8.570 9.233 -0.663 1
1 407 . 1 1 1 A 32 32 SER HA H 32 4.520 4.900 -0.380 1
1 410 . 1 1 1 A 32 32 SER C C 32 174.300 173.815 0.485 1
1 411 . 1 1 1 A 32 32 SER CA C 32 57.300 56.496 0.804 1
1 412 . 1 1 1 A 32 32 SER CB C 32 64.100 65.168 -1.068 1
1 413 . 1 1 1 A 32 32 SER N N 32 118.500 120.408 -1.908 1
1 414 . 1 1 1 A 33 33 ASP H H 33 9.290 9.374 -0.084 1
1 415 . 1 1 1 A 33 33 ASP HA H 33 4.340 4.288 0.052 1
1 418 . 1 1 1 A 33 33 ASP C C 33 175.900 175.276 0.624 1
1 419 . 1 1 1 A 33 33 ASP CA C 33 55.000 55.022 -0.022 1
1 420 . 1 1 1 A 33 33 ASP CB C 33 39.300 39.732 -0.432 1
1 421 . 1 1 1 A 33 33 ASP N N 33 125.700 129.022 -3.322 1
1 422 . 1 1 1 A 34 34 GLY H H 34 8.690 8.475 0.215 1
1 423 . 1 1 1 A 34 34 GLY HA2 H 34 3.660 3.713 -0.053 1
1 424 . 1 1 1 A 34 34 GLY HA3 H 34 4.140 3.715 0.425 1
1 425 . 1 1 1 A 34 34 GLY C C 34 174.200 173.576 0.624 1
1 426 . 1 1 1 A 34 34 GLY CA C 34 45.600 45.384 0.216 1
1 427 . 1 1 1 A 34 34 GLY N N 34 104.800 104.357 0.443 1
1 428 . 1 1 1 A 35 35 THR H H 35 7.840 8.092 -0.252 1
1 429 . 1 1 1 A 35 35 THR HA H 35 4.660 4.507 0.153 1
1 434 . 1 1 1 A 35 35 THR C C 35 173.000 173.470 -0.470 1
1 435 . 1 1 1 A 35 35 THR CA C 35 60.200 61.174 -0.974 1
1 436 . 1 1 1 A 35 35 THR CB C 35 71.200 71.010 0.190 1
1 438 . 1 1 1 A 35 35 THR N N 35 114.800 117.155 -2.355 1
1 439 . 1 1 1 A 36 36 THR H H 36 8.480 8.606 -0.126 1
1 440 . 1 1 1 A 36 36 THR HA H 36 4.620 4.449 0.171 1
1 445 . 1 1 1 A 36 36 THR C C 36 173.800 174.395 -0.595 1
1 446 . 1 1 1 A 36 36 THR CA C 36 62.300 63.070 -0.770 1
1 447 . 1 1 1 A 36 36 THR CB C 36 69.500 68.854 0.646 1
1 449 . 1 1 1 A 36 36 THR N N 36 119.400 121.096 -1.696 1
1 450 . 1 1 1 A 37 37 LYS H H 37 8.880 8.514 0.366 1
1 451 . 1 1 1 A 37 37 LYS HA H 37 4.570 4.893 -0.323 1
1 460 . 1 1 1 A 37 37 LYS C C 37 174.500 175.690 -1.190 1
1 461 . 1 1 1 A 37 37 LYS CA C 37 54.600 54.162 0.438 1
1 462 . 1 1 1 A 37 37 LYS CB C 37 35.500 35.911 -0.411 1
1 466 . 1 1 1 A 37 37 LYS N N 37 128.000 125.919 2.081 1
1 467 . 1 1 1 A 38 38 SER H H 38 8.370 8.885 -0.515 1
1 468 . 1 1 1 A 38 38 SER HA H 38 5.250 4.938 0.312 1
1 471 . 1 1 1 A 38 38 SER C C 38 173.200 173.620 -0.420 1
1 472 . 1 1 1 A 38 38 SER CA C 38 57.900 58.599 -0.699 1
1 473 . 1 1 1 A 38 38 SER CB C 38 65.500 64.006 1.494 1
1 474 . 1 1 1 A 38 38 SER N N 38 114.300 119.415 -5.115 1
1 475 . 1 1 1 A 39 39 VAL H H 39 9.020 8.710 0.310 1
1 476 . 1 1 1 A 39 39 VAL HA H 39 4.900 4.919 -0.019 1
1 484 . 1 1 1 A 39 39 VAL C C 39 173.200 172.898 0.302 1
1 485 . 1 1 1 A 39 39 VAL CA C 39 59.200 59.538 -0.338 1
1 486 . 1 1 1 A 39 39 VAL CB C 39 34.600 35.084 -0.484 1
1 489 . 1 1 1 A 39 39 VAL N N 39 123.600 121.673 1.927 1
1 490 . 1 1 1 A 40 40 TYR H H 40 8.900 8.910 -0.010 1
1 491 . 1 1 1 A 40 40 TYR HA H 40 4.730 5.291 -0.561 1
1 498 . 1 1 1 A 40 40 TYR CA C 40 56.500 57.026 -0.526 1
1 499 . 1 1 1 A 40 40 TYR CB C 40 39.000 40.337 -1.337 1
1 504 . 1 1 1 A 40 40 TYR N N 40 126.300 127.645 -1.345 1
1 505 . 1 1 1 A 41 41 GLN H H 41 8.630 8.881 -0.251 1
1 506 . 1 1 1 A 41 41 GLN HA H 41 5.330 5.348 -0.018 1
1 513 . 1 1 1 A 41 41 GLN C C 41 175.500 175.901 -0.401 1
1 514 . 1 1 1 A 41 41 GLN CA C 41 53.800 54.163 -0.363 1
1 515 . 1 1 1 A 41 41 GLN CB C 41 32.100 31.927 0.173 1
1 518 . 1 1 1 A 41 41 GLN N N 41 122.000 121.821 0.179 1
1 520 . 1 1 1 A 42 42 GLY H H 42 8.560 7.888 0.672 1
1 521 . 1 1 1 A 42 42 GLY HA2 H 42 3.680 4.301 -0.621 1
1 522 . 1 1 1 A 42 42 GLY HA3 H 42 4.020 4.404 -0.384 1
1 523 . 1 1 1 A 42 42 GLY C C 42 171.600 171.163 0.437 1
1 524 . 1 1 1 A 42 42 GLY CA C 42 47.300 46.112 1.188 1
1 525 . 1 1 1 A 42 42 GLY N N 42 113.000 108.942 4.058 1
1 526 . 1 1 1 A 43 43 TYR H H 43 9.320 8.515 0.805 1
1 527 . 1 1 1 A 43 43 TYR HA H 43 5.280 5.465 -0.185 1
1 534 . 1 1 1 A 43 43 TYR C C 43 173.200 174.400 -1.200 1
1 535 . 1 1 1 A 43 43 TYR CA C 43 57.600 56.541 1.059 1
1 536 . 1 1 1 A 43 43 TYR CB C 43 42.400 41.804 0.596 1
1 541 . 1 1 1 A 43 43 TYR N N 43 126.300 119.066 7.234 1
1 542 . 1 1 1 A 44 44 ILE H H 44 9.160 8.872 0.288 1
1 543 . 1 1 1 A 44 44 ILE HA H 44 5.270 5.411 -0.141 1
1 553 . 1 1 1 A 44 44 ILE C C 44 172.900 174.263 -1.363 1
1 554 . 1 1 1 A 44 44 ILE CA C 44 59.000 59.651 -0.651 1
1 555 . 1 1 1 A 44 44 ILE CB C 44 42.200 41.981 0.219 1
1 559 . 1 1 1 A 44 44 ILE N N 44 117.700 122.694 -4.994 1
1 560 . 1 1 1 A 45 45 GLU H H 45 8.420 8.886 -0.466 1
1 561 . 1 1 1 A 45 45 GLU HA H 45 5.600 5.377 0.223 1
1 566 . 1 1 1 A 45 45 GLU C C 45 174.300 174.239 0.061 1
1 567 . 1 1 1 A 45 45 GLU CA C 45 54.000 54.226 -0.226 1
1 568 . 1 1 1 A 45 45 GLU CB C 45 34.400 33.969 0.431 1
1 570 . 1 1 1 A 45 45 GLU N N 45 123.600 127.257 -3.657 1
1 571 . 1 1 1 A 46 46 ASP H H 46 8.530 8.529 0.001 1
1 572 . 1 1 1 A 46 46 ASP HA H 46 5.070 4.895 0.175 1
1 575 . 1 1 1 A 46 46 ASP C C 46 175.000 174.839 0.161 1
1 576 . 1 1 1 A 46 46 ASP CA C 46 51.800 52.910 -1.110 1
1 577 . 1 1 1 A 46 46 ASP CB C 46 41.300 43.664 -2.364 1
1 578 . 1 1 1 A 46 46 ASP N N 46 125.500 119.663 5.837 1
1 579 . 1 1 1 A 47 47 ASP H H 47 9.160 8.807 0.353 1
1 580 . 1 1 1 A 47 47 ASP HA H 47 4.430 4.638 -0.208 1
1 583 . 1 1 1 A 47 47 ASP C C 47 176.000 177.229 -1.229 1
1 584 . 1 1 1 A 47 47 ASP CA C 47 55.000 55.622 -0.622 1
1 585 . 1 1 1 A 47 47 ASP CB C 47 38.900 40.883 -1.983 1
1 586 . 1 1 1 A 47 47 ASP N N 47 114.200 121.382 -7.182 1
1 587 . 1 1 1 A 48 48 THR H H 48 9.470 7.810 1.660 1
1 588 . 1 1 1 A 48 48 THR HA H 48 4.520 4.529 -0.009 1
1 593 . 1 1 1 A 48 48 THR C C 48 174.500 174.104 0.396 1
1 594 . 1 1 1 A 48 48 THR CA C 48 62.600 61.706 0.894 1
1 595 . 1 1 1 A 48 48 THR CB C 48 70.400 69.267 1.133 1
1 597 . 1 1 1 A 48 48 THR N N 48 111.800 108.857 2.943 1
1 598 . 1 1 1 A 49 49 ALA H H 49 7.850 7.815 0.035 1
1 599 . 1 1 1 A 49 49 ALA HA H 49 4.440 4.598 -0.158 1
1 603 . 1 1 1 A 49 49 ALA C C 49 173.200 175.707 -2.507 1
1 604 . 1 1 1 A 49 49 ALA CA C 49 52.700 50.706 1.994 1
1 605 . 1 1 1 A 49 49 ALA CB C 49 21.300 20.660 0.640 1
1 606 . 1 1 1 A 49 49 ALA N N 49 123.400 121.495 1.905 1
1 607 . 1 1 1 A 50 50 ARG H H 50 8.160 8.990 -0.830 1
1 608 . 1 1 1 A 50 50 ARG HA H 50 5.350 5.609 -0.259 1
1 616 . 1 1 1 A 50 50 ARG C C 50 174.700 174.247 0.453 1
1 617 . 1 1 1 A 50 50 ARG CA C 50 54.000 54.522 -0.522 1
1 618 . 1 1 1 A 50 50 ARG CB C 50 34.500 34.436 0.064 1
1 622 . 1 1 1 A 50 50 ARG N N 50 117.400 114.319 3.081 1
1 624 . 1 1 1 A 51 51 ILE H H 51 9.390 8.744 0.646 1
1 625 . 1 1 1 A 51 51 ILE HA H 51 4.790 5.037 -0.247 1
1 635 . 1 1 1 A 51 51 ILE C C 51 172.600 174.615 -2.015 1
1 636 . 1 1 1 A 51 51 ILE CA C 51 60.000 58.869 1.131 1
1 637 . 1 1 1 A 51 51 ILE CB C 51 42.800 42.015 0.785 1
1 641 . 1 1 1 A 51 51 ILE N N 51 124.600 120.866 3.734 1
1 642 . 1 1 1 A 52 52 ARG H H 52 7.980 8.215 -0.235 1
1 643 . 1 1 1 A 52 52 ARG HA H 52 4.170 4.310 -0.140 1
1 651 . 1 1 1 A 52 52 ARG C C 52 174.600 176.191 -1.591 1
1 652 . 1 1 1 A 52 52 ARG CA C 52 57.100 55.931 1.169 1
1 653 . 1 1 1 A 52 52 ARG CB C 52 31.300 30.803 0.497 1
1 657 . 1 1 1 A 52 52 ARG N N 52 125.900 125.327 0.573 1
1 659 . 1 1 1 A 53 53 ILE H H 53 8.290 8.630 -0.340 1
1 660 . 1 1 1 A 53 53 ILE HA H 53 5.160 5.060 0.100 1
1 670 . 1 1 1 A 53 53 ILE C C 53 172.400 174.637 -2.237 1
1 671 . 1 1 1 A 53 53 ILE CA C 53 58.600 59.212 -0.612 1
1 672 . 1 1 1 A 53 53 ILE CB C 53 41.900 42.508 -0.608 1
1 676 . 1 1 1 A 53 53 ILE N N 53 118.500 118.918 -0.418 1
1 677 . 1 1 1 A 54 54 SER H H 54 8.350 8.707 -0.357 1
1 678 . 1 1 1 A 54 54 SER HA H 54 5.070 5.130 -0.060 1
1 681 . 1 1 1 A 54 54 SER C C 54 172.400 172.589 -0.189 1
1 682 . 1 1 1 A 54 54 SER CA C 54 57.000 57.280 -0.280 1
1 683 . 1 1 1 A 54 54 SER CB C 54 65.900 65.328 0.572 1
1 684 . 1 1 1 A 54 54 SER N N 54 120.700 119.304 1.396 1
1 685 . 1 1 1 A 55 55 SER H H 55 9.130 9.233 -0.103 1
1 686 . 1 1 1 A 55 55 SER HA H 55 5.270 5.198 0.072 1
1 690 . 1 1 1 A 55 55 SER C C 55 174.400 172.652 1.748 1
1 691 . 1 1 1 A 55 55 SER CA C 55 55.500 56.528 -1.028 1
1 692 . 1 1 1 A 55 55 SER CB C 55 64.500 64.883 -0.383 1
1 693 . 1 1 1 A 55 55 SER N N 55 117.200 121.619 -4.419 1
1 694 . 1 1 1 A 56 56 PHE H H 56 8.970 8.813 0.157 1
1 695 . 1 1 1 A 56 56 PHE HA H 56 4.600 4.989 -0.389 1
1 703 . 1 1 1 A 56 56 PHE C C 56 176.500 176.972 -0.472 1
1 704 . 1 1 1 A 56 56 PHE CA C 56 58.300 57.162 1.138 1
1 705 . 1 1 1 A 56 56 PHE CB C 56 37.900 41.059 -3.159 1
1 711 . 1 1 1 A 56 56 PHE N N 56 129.400 126.260 3.140 1
1 712 . 1 1 1 A 57 57 GLY H H 57 8.570 8.753 -0.183 1
1 713 . 1 1 1 A 57 57 GLY HA2 H 57 4.020 4.147 -0.127 1
1 714 . 1 1 1 A 57 57 GLY HA3 H 57 4.380 4.173 0.207 1
1 715 . 1 1 1 A 57 57 GLY C C 57 173.700 174.398 -0.698 1
1 716 . 1 1 1 A 57 57 GLY CA C 57 46.300 45.684 0.616 1
1 717 . 1 1 1 A 57 57 GLY N N 57 112.500 112.275 0.225 1
1 718 . 1 1 1 A 58 58 LYS H H 58 6.800 8.029 -1.229 1
1 719 . 1 1 1 A 58 58 LYS HA H 58 4.410 4.370 0.040 1
1 728 . 1 1 1 A 58 58 LYS C C 58 174.800 175.680 -0.880 1
1 729 . 1 1 1 A 58 58 LYS CA C 58 55.200 56.407 -1.207 1
1 730 . 1 1 1 A 58 58 LYS CB C 58 33.300 33.424 -0.124 1
1 734 . 1 1 1 A 58 58 LYS N N 58 118.700 121.185 -2.485 1
1 735 . 1 1 1 A 59 59 GLN H H 59 8.390 8.584 -0.194 1
1 736 . 1 1 1 A 59 59 GLN HA H 59 1.830 3.717 -1.887 1
1 743 . 1 1 1 A 59 59 GLN C C 59 174.100 174.629 -0.529 1
1 744 . 1 1 1 A 59 59 GLN CA C 59 57.100 54.938 2.162 1
1 745 . 1 1 1 A 59 59 GLN CB C 59 28.900 29.446 -0.546 1
1 748 . 1 1 1 A 59 59 GLN N N 59 124.000 123.456 0.544 1
1 750 . 1 1 1 A 60 60 LEU H H 60 5.320 8.244 -2.924 1
1 751 . 1 1 1 A 60 60 LEU HA H 60 4.370 5.039 -0.669 1
1 761 . 1 1 1 A 60 60 LEU CA C 60 52.800 53.286 -0.486 1
1 762 . 1 1 1 A 60 60 LEU CB C 60 46.700 44.964 1.736 1
1 766 . 1 1 1 A 60 60 LEU N N 60 121.800 123.775 -1.975 1
1 767 . 1 1 1 A 61 61 GLN H H 61 8.660 8.545 0.115 1
1 768 . 1 1 1 A 61 61 GLN HA H 61 4.440 4.732 -0.292 1
1 775 . 1 1 1 A 61 61 GLN C C 61 174.000 174.802 -0.802 1
1 776 . 1 1 1 A 61 61 GLN CA C 61 53.800 53.943 -0.143 1
1 777 . 1 1 1 A 61 61 GLN CB C 61 31.800 31.440 0.360 1
1 780 . 1 1 1 A 61 61 GLN N N 61 120.300 120.712 -0.412 1
1 782 . 1 1 1 A 62 62 ASP H H 62 8.450 8.667 -0.217 1
1 783 . 1 1 1 A 62 62 ASP HA H 62 4.130 4.265 -0.135 1
1 786 . 1 1 1 A 62 62 ASP C C 62 177.200 176.954 0.246 1
1 787 . 1 1 1 A 62 62 ASP CA C 62 55.700 55.227 0.473 1
1 788 . 1 1 1 A 62 62 ASP CB C 62 39.400 40.743 -1.343 1
1 789 . 1 1 1 A 62 62 ASP N N 62 122.400 124.379 -1.979 1
1 790 . 1 1 1 A 63 63 SER H H 63 9.210 9.183 0.027 1
1 791 . 1 1 1 A 63 63 SER HA H 63 3.850 4.210 -0.360 1
1 794 . 1 1 1 A 63 63 SER C C 63 173.200 173.635 -0.435 1
1 795 . 1 1 1 A 63 63 SER CA C 63 61.700 59.227 2.473 1
1 796 . 1 1 1 A 63 63 SER CB C 63 61.800 61.000 0.800 1
1 797 . 1 1 1 A 63 63 SER N N 63 114.300 120.853 -6.553 1
1 798 . 1 1 1 A 64 64 ASP H H 64 7.960 7.614 0.346 1
1 799 . 1 1 1 A 64 64 ASP HA H 64 4.540 4.756 -0.216 1
1 802 . 1 1 1 A 64 64 ASP C C 64 174.900 175.496 -0.596 1
1 803 . 1 1 1 A 64 64 ASP CA C 64 54.900 53.518 1.382 1
1 804 . 1 1 1 A 64 64 ASP CB C 64 40.900 41.679 -0.779 1
1 805 . 1 1 1 A 64 64 ASP N N 64 122.600 122.262 0.338 1
1 806 . 1 1 1 A 65 65 VAL H H 65 8.180 8.587 -0.407 1
1 807 . 1 1 1 A 65 65 VAL HA H 65 4.670 4.632 0.038 1
1 815 . 1 1 1 A 65 65 VAL C C 65 175.900 175.602 0.298 1
1 816 . 1 1 1 A 65 65 VAL CA C 65 62.300 61.530 0.770 1
1 817 . 1 1 1 A 65 65 VAL CB C 65 31.700 32.792 -1.092 1
1 820 . 1 1 1 A 65 65 VAL N N 65 123.100 122.162 0.938 1
1 821 . 1 1 1 A 66 66 VAL H H 66 8.770 8.921 -0.151 1
1 822 . 1 1 1 A 66 66 VAL HA H 66 5.160 5.135 0.025 1
1 830 . 1 1 1 A 66 66 VAL C C 66 173.600 173.271 0.329 1
1 831 . 1 1 1 A 66 66 VAL CA C 66 58.100 58.775 -0.675 1
1 832 . 1 1 1 A 66 66 VAL CB C 66 35.700 36.125 -0.425 1
1 835 . 1 1 1 A 66 66 VAL N N 66 118.100 122.470 -4.370 1
1 836 . 1 1 1 A 67 67 ARG H H 67 8.880 8.981 -0.101 1
1 837 . 1 1 1 A 67 67 ARG HA H 67 5.110 5.078 0.032 1
1 845 . 1 1 1 A 67 67 ARG C C 67 175.300 174.577 0.723 1
1 846 . 1 1 1 A 67 67 ARG CA C 67 54.200 54.351 -0.151 1
1 847 . 1 1 1 A 67 67 ARG CB C 67 32.200 33.662 -1.462 1
1 851 . 1 1 1 A 67 67 ARG N N 67 120.200 121.775 -1.575 1
1 853 . 1 1 1 A 68 68 ILE H H 68 9.220 8.990 0.230 1
1 854 . 1 1 1 A 68 68 ILE HA H 68 4.990 4.658 0.332 1
1 864 . 1 1 1 A 68 68 ILE C C 68 174.900 174.784 0.116 1
1 865 . 1 1 1 A 68 68 ILE CA C 68 58.600 59.631 -1.031 1
1 866 . 1 1 1 A 68 68 ILE CB C 68 39.300 38.917 0.383 1
1 870 . 1 1 1 A 68 68 ILE N N 68 127.200 128.215 -1.015 1
1 871 . 1 1 1 A 69 69 ASP H H 69 9.110 8.927 0.183 1
1 872 . 1 1 1 A 69 69 ASP HA H 69 5.370 5.107 0.263 1
1 875 . 1 1 1 A 69 69 ASP C C 69 175.800 176.347 -0.547 1
1 876 . 1 1 1 A 69 69 ASP CA C 69 52.400 52.678 -0.278 1
1 877 . 1 1 1 A 69 69 ASP CB C 69 43.700 43.528 0.172 1
1 878 . 1 1 1 A 69 69 ASP N N 69 123.400 125.506 -2.106 1
1 879 . 1 1 1 A 70 70 ASN H H 70 8.300 9.085 -0.785 1
1 880 . 1 1 1 A 70 70 ASN HA H 70 4.160 4.407 -0.247 1
1 885 . 1 1 1 A 70 70 ASN C C 70 176.300 174.647 1.653 1
1 886 . 1 1 1 A 70 70 ASN CA C 70 54.300 54.175 0.125 1
1 887 . 1 1 1 A 70 70 ASN CB C 70 37.500 37.538 -0.038 1
1 889 . 1 1 1 A 70 70 ASN N N 70 119.800 121.054 -1.254 1
1 891 . 1 1 1 A 71 71 ALA H H 71 9.100 7.996 1.104 1
1 892 . 1 1 1 A 71 71 ALA HA H 71 4.500 4.502 -0.002 1
1 896 . 1 1 1 A 71 71 ALA C C 71 175.700 176.386 -0.686 1
1 897 . 1 1 1 A 71 71 ALA CA C 71 51.900 53.018 -1.118 1
1 898 . 1 1 1 A 71 71 ALA CB C 71 19.600 19.971 -0.371 1
1 899 . 1 1 1 A 71 71 ALA N N 71 123.000 121.086 1.914 1
1 900 . 1 1 1 A 72 72 ARG H H 72 8.490 8.336 0.154 1
1 901 . 1 1 1 A 72 72 ARG HA H 72 4.720 4.962 -0.242 1
1 909 . 1 1 1 A 72 72 ARG C C 72 175.800 174.785 1.015 1
1 910 . 1 1 1 A 72 72 ARG CA C 72 54.400 54.831 -0.431 1
1 911 . 1 1 1 A 72 72 ARG CB C 72 32.700 32.430 0.270 1
1 915 . 1 1 1 A 72 72 ARG N N 72 122.500 122.849 -0.349 1
1 917 . 1 1 1 A 73 73 VAL H H 73 8.310 8.229 0.081 1
1 918 . 1 1 1 A 73 73 VAL HA H 73 4.250 4.663 -0.413 1
1 926 . 1 1 1 A 73 73 VAL C C 73 174.600 175.568 -0.968 1
1 927 . 1 1 1 A 73 73 VAL CA C 73 62.800 62.035 0.765 1
1 928 . 1 1 1 A 73 73 VAL CB C 73 32.100 32.072 0.028 1
1 931 . 1 1 1 A 73 73 VAL N N 73 127.100 127.185 -0.085 1
1 932 . 1 1 1 A 74 74 ALA H H 74 8.880 8.791 0.089 1
1 933 . 1 1 1 A 74 74 ALA HA H 74 4.500 4.897 -0.397 1
1 937 . 1 1 1 A 74 74 ALA C C 74 174.800 175.828 -1.028 1
1 938 . 1 1 1 A 74 74 ALA CA C 74 50.500 50.907 -0.407 1
1 939 . 1 1 1 A 74 74 ALA CB C 74 22.500 23.843 -1.343 1
1 940 . 1 1 1 A 74 74 ALA N N 74 131.000 128.525 2.475 1
1 941 . 1 1 1 A 75 75 GLN H H 75 8.280 8.447 -0.167 1
1 942 . 1 1 1 A 75 75 GLN HA H 75 4.910 5.092 -0.182 1
1 949 . 1 1 1 A 75 75 GLN C C 75 175.100 174.704 0.396 1
1 950 . 1 1 1 A 75 75 GLN CA C 75 54.600 54.614 -0.014 1
1 951 . 1 1 1 A 75 75 GLN CB C 75 31.400 30.195 1.205 1
1 954 . 1 1 1 A 75 75 GLN N N 75 118.800 118.309 0.491 1
1 956 . 1 1 1 A 76 76 PHE H H 76 8.710 9.490 -0.780 1
1 957 . 1 1 1 A 76 76 PHE HA H 76 4.660 4.885 -0.225 1
1 965 . 1 1 1 A 76 76 PHE C C 76 174.900 175.498 -0.598 1
1 966 . 1 1 1 A 76 76 PHE CA C 76 57.000 56.677 0.323 1
1 967 . 1 1 1 A 76 76 PHE CB C 76 41.000 41.732 -0.732 1
1 973 . 1 1 1 A 76 76 PHE N N 76 125.000 122.698 2.302 1
1 974 . 1 1 1 A 77 77 ASN H H 77 9.040 8.913 0.127 1
1 975 . 1 1 1 A 77 77 ASN HA H 77 4.170 4.472 -0.302 1
1 980 . 1 1 1 A 77 77 ASN C C 77 174.200 175.625 -1.425 1
1 981 . 1 1 1 A 77 77 ASN CA C 77 53.800 54.496 -0.696 1
1 982 . 1 1 1 A 77 77 ASN CB C 77 37.400 37.508 -0.108 1
1 984 . 1 1 1 A 77 77 ASN N N 77 123.200 124.168 -0.968 1
1 986 . 1 1 1 A 78 78 GLY H H 78 8.370 8.587 -0.217 1
1 987 . 1 1 1 A 78 78 GLY HA2 H 78 3.410 3.590 -0.180 1
1 988 . 1 1 1 A 78 78 GLY HA3 H 78 3.980 3.703 0.277 1
1 989 . 1 1 1 A 78 78 GLY C C 78 173.800 173.238 0.562 1
1 990 . 1 1 1 A 78 78 GLY CA C 78 45.000 45.426 -0.426 1
1 991 . 1 1 1 A 78 78 GLY N N 78 103.300 104.773 -1.473 1
1 992 . 1 1 1 A 79 79 TYR H H 79 7.670 8.023 -0.353 1
1 993 . 1 1 1 A 79 79 TYR HA H 79 4.860 4.973 -0.113 1
1 1000 . 1 1 1 A 79 79 TYR C C 79 174.800 175.549 -0.749 1
1 1001 . 1 1 1 A 79 79 TYR CA C 79 56.300 56.987 -0.687 1
1 1002 . 1 1 1 A 79 79 TYR CB C 79 40.800 41.419 -0.619 1
1 1007 . 1 1 1 A 79 79 TYR N N 79 118.700 118.661 0.039 1
1 1008 . 1 1 1 A 80 80 LEU H H 80 8.760 8.686 0.074 1
1 1009 . 1 1 1 A 80 80 LEU HA H 80 4.830 4.607 0.223 1
1 1019 . 1 1 1 A 80 80 LEU C C 80 176.200 176.143 0.057 1
1 1020 . 1 1 1 A 80 80 LEU CA C 80 54.700 54.952 -0.252 1
1 1021 . 1 1 1 A 80 80 LEU CB C 80 43.500 42.405 1.095 1
1 1025 . 1 1 1 A 80 80 LEU N N 80 122.600 125.698 -3.098 1
1 1026 . 1 1 1 A 81 81 SER H H 81 8.650 8.865 -0.215 1
1 1027 . 1 1 1 A 81 81 SER HA H 81 4.860 5.210 -0.350 1
1 1030 . 1 1 1 A 81 81 SER C C 81 172.600 172.436 0.164 1
1 1031 . 1 1 1 A 81 81 SER CA C 81 56.600 57.378 -0.778 1
1 1032 . 1 1 1 A 81 81 SER CB C 81 66.300 66.511 -0.211 1
1 1033 . 1 1 1 A 81 81 SER N N 81 114.700 117.229 -2.529 1
1 1034 . 1 1 1 A 82 82 LEU H H 82 8.680 8.548 0.132 1
1 1035 . 1 1 1 A 82 82 LEU HA H 82 5.190 5.135 0.055 1
1 1045 . 1 1 1 A 82 82 LEU C C 82 177.100 175.487 1.613 1
1 1046 . 1 1 1 A 82 82 LEU CA C 82 53.300 53.727 -0.427 1
1 1047 . 1 1 1 A 82 82 LEU CB C 82 43.800 43.151 0.649 1
1 1051 . 1 1 1 A 82 82 LEU N N 82 119.800 121.966 -2.166 1
1 1052 . 1 1 1 A 83 83 SER H H 83 9.560 9.496 0.064 1
1 1053 . 1 1 1 A 83 83 SER HA H 83 5.390 5.360 0.030 1
1 1056 . 1 1 1 A 83 83 SER C C 83 174.200 173.726 0.474 1
1 1057 . 1 1 1 A 83 83 SER CA C 83 57.100 57.796 -0.696 1
1 1058 . 1 1 1 A 83 83 SER CB C 83 64.400 64.374 0.026 1
1 1059 . 1 1 1 A 83 83 SER N N 83 119.000 122.015 -3.015 1
1 1060 . 1 1 1 A 84 84 VAL H H 84 9.150 9.094 0.056 1
1 1061 . 1 1 1 A 84 84 VAL HA H 84 4.490 4.603 -0.113 1
1 1069 . 1 1 1 A 84 84 VAL C C 84 174.700 176.111 -1.411 1
1 1070 . 1 1 1 A 84 84 VAL CA C 84 61.300 61.360 -0.060 1
1 1071 . 1 1 1 A 84 84 VAL CB C 84 33.000 31.472 1.528 1
1 1074 . 1 1 1 A 84 84 VAL N N 84 128.300 127.151 1.149 1
1 1075 . 1 1 1 A 85 85 GLY H H 85 7.970 8.790 -0.820 1
1 1076 . 1 1 1 A 85 85 GLY HA2 H 85 4.030 4.254 -0.224 1
1 1077 . 1 1 1 A 85 85 GLY HA3 H 85 4.840 4.334 0.506 1
1 1078 . 1 1 1 A 85 85 GLY C C 85 175.800 174.930 0.870 1
1 1079 . 1 1 1 A 85 85 GLY CA C 85 44.800 44.253 0.547 1
1 1080 . 1 1 1 A 85 85 GLY N N 85 114.300 115.244 -0.944 1
1 1081 . 1 1 1 A 86 86 ASP H H 86 8.860 8.720 0.140 1
1 1082 . 1 1 1 A 86 86 ASP HA H 86 4.370 4.432 -0.062 1
1 1085 . 1 1 1 A 86 86 ASP C C 86 177.400 177.142 0.258 1
1 1086 . 1 1 1 A 86 86 ASP CA C 86 57.400 55.928 1.472 1
1 1087 . 1 1 1 A 86 86 ASP CB C 86 40.600 40.388 0.212 1
1 1088 . 1 1 1 A 86 86 ASP N N 86 122.500 119.632 2.868 1
1 1089 . 1 1 1 A 87 87 SER H H 87 8.540 7.702 0.838 1
1 1090 . 1 1 1 A 87 87 SER HA H 87 4.620 4.399 0.221 1
1 1093 . 1 1 1 A 87 87 SER C C 87 174.700 174.752 -0.052 1
1 1094 . 1 1 1 A 87 87 SER CA C 87 58.200 59.019 -0.819 1
1 1095 . 1 1 1 A 87 87 SER CB C 87 63.300 63.694 -0.394 1
1 1096 . 1 1 1 A 87 87 SER N N 87 112.100 111.575 0.525 1
1 1097 . 1 1 1 A 88 88 SER H H 88 7.880 7.344 0.536 1
1 1098 . 1 1 1 A 88 88 SER HA H 88 5.050 4.537 0.513 1
1 1101 . 1 1 1 A 88 88 SER C C 88 172.700 173.893 -1.193 1
1 1102 . 1 1 1 A 88 88 SER CA C 88 57.600 57.692 -0.092 1
1 1103 . 1 1 1 A 88 88 SER CB C 88 64.300 65.106 -0.806 1
1 1104 . 1 1 1 A 88 88 SER N N 88 119.200 116.358 2.842 1
1 1105 . 1 1 1 A 89 89 ARG H H 89 8.350 8.312 0.038 1
1 1106 . 1 1 1 A 89 89 ARG HA H 89 4.720 5.188 -0.468 1
1 1114 . 1 1 1 A 89 89 ARG C C 89 174.200 174.473 -0.273 1
1 1115 . 1 1 1 A 89 89 ARG CA C 89 55.000 54.430 0.570 1
1 1116 . 1 1 1 A 89 89 ARG CB C 89 33.500 34.076 -0.576 1
1 1120 . 1 1 1 A 89 89 ARG N N 89 122.800 121.986 0.814 1
1 1122 . 1 1 1 A 90 90 ILE H H 90 8.530 9.019 -0.489 1
1 1123 . 1 1 1 A 90 90 ILE HA H 90 4.790 5.071 -0.281 1
1 1133 . 1 1 1 A 90 90 ILE C C 90 175.400 175.145 0.255 1
1 1134 . 1 1 1 A 90 90 ILE CA C 90 60.600 60.254 0.346 1
1 1135 . 1 1 1 A 90 90 ILE CB C 90 40.600 40.694 -0.094 1
1 1139 . 1 1 1 A 90 90 ILE N N 90 123.100 126.439 -3.339 1
1 1140 . 1 1 1 A 91 91 GLU H H 91 9.000 8.958 0.042 1
1 1141 . 1 1 1 A 91 91 GLU HA H 91 4.730 4.937 -0.207 1
1 1146 . 1 1 1 A 91 91 GLU C C 91 175.100 176.419 -1.319 1
1 1147 . 1 1 1 A 91 91 GLU CA C 91 54.300 54.455 -0.155 1
1 1148 . 1 1 1 A 91 91 GLU CB C 91 32.400 32.897 -0.497 1
1 1150 . 1 1 1 A 91 91 GLU N N 91 126.400 127.118 -0.718 1
1 1151 . 1 1 1 A 92 92 SER H H 92 8.830 8.837 -0.007 1
1 1152 . 1 1 1 A 92 92 SER HA H 92 4.700 4.722 -0.022 1
1 1155 . 1 1 1 A 92 92 SER C C 92 174.600 174.651 -0.051 1
1 1156 . 1 1 1 A 92 92 SER CA C 92 59.300 57.909 1.391 1
1 1157 . 1 1 1 A 92 92 SER CB C 92 63.100 64.098 -0.998 1
1 1158 . 1 1 1 A 92 92 SER N N 92 119.800 119.260 0.540 1
1 1159 . 1 1 1 A 93 93 VAL H H 93 8.350 8.495 -0.145 1
1 1160 . 1 1 1 A 93 93 VAL HA H 93 4.290 4.459 -0.169 1
1 1168 . 1 1 1 A 93 93 VAL C C 93 175.100 175.876 -0.776 1
1 1169 . 1 1 1 A 93 93 VAL CA C 93 61.300 61.577 -0.277 1
1 1170 . 1 1 1 A 93 93 VAL CB C 93 33.900 32.050 1.850 1
1 1173 . 1 1 1 A 93 93 VAL N N 93 121.800 123.487 -1.687 1
1 1174 . 1 1 1 A 94 94 ASN H H 94 8.510 8.987 -0.477 1
1 1175 . 1 1 1 A 94 94 ASN HA H 94 4.770 4.917 -0.147 1
1 1180 . 1 1 1 A 94 94 ASN C C 94 175.000 174.964 0.036 1
1 1181 . 1 1 1 A 94 94 ASN CA C 94 52.700 52.484 0.216 1
1 1182 . 1 1 1 A 94 94 ASN CB C 94 38.500 39.301 -0.801 1
1 1184 . 1 1 1 A 94 94 ASN N N 94 121.800 126.751 -4.951 1
1 1186 . 1 1 1 A 95 95 VAL H H 95 7.860 7.196 0.664 1
1 1187 . 1 1 1 A 95 95 VAL HA H 95 4.100 4.523 -0.423 1
1 1195 . 1 1 1 A 95 95 VAL C C 95 175.100 174.902 0.198 1
1 1196 . 1 1 1 A 95 95 VAL CA C 95 61.700 60.339 1.361 1
1 1197 . 1 1 1 A 95 95 VAL CB C 95 33.100 34.014 -0.914 1
1 1200 . 1 1 1 A 95 95 VAL N N 95 119.700 115.781 3.919 1
1 1201 . 1 1 1 A 96 96 ASN H H 96 8.490 9.008 -0.518 1
1 1202 . 1 1 1 A 96 96 ASN HA H 96 4.700 4.825 -0.125 1
1 1207 . 1 1 1 A 96 96 ASN C C 96 174.600 174.808 -0.208 1
1 1208 . 1 1 1 A 96 96 ASN CA C 96 53.000 53.523 -0.523 1
1 1209 . 1 1 1 A 96 96 ASN CB C 96 39.000 39.341 -0.341 1
1 1211 . 1 1 1 A 96 96 ASN N N 96 122.200 123.447 -1.247 1
1 1213 . 1 1 1 A 97 97 ILE H H 97 8.080 8.410 -0.330 1
1 1214 . 1 1 1 A 97 97 ILE HA H 97 4.370 4.605 -0.235 1
1 1224 . 1 1 1 A 97 97 ILE CA C 97 58.600 58.064 0.536 1
1 1225 . 1 1 1 A 97 97 ILE CB C 97 38.600 37.941 0.659 1
1 1229 . 1 1 1 A 97 97 ILE N N 97 123.500 120.076 3.424 1
1 1230 . 1 1 1 A 98 98 PRO HA H 98 4.360 4.233 0.127 1
1 1237 . 1 1 1 A 98 98 PRO C C 98 176.600 176.950 -0.350 1
1 1238 . 1 1 1 A 98 98 PRO CA C 98 63.100 66.053 -2.953 1
1 1239 . 1 1 1 A 98 98 PRO CB C 98 31.800 31.466 0.334 1
1 1242 . 1 1 1 A 99 99 LEU H H 99 8.200 8.057 0.143 1
1 1243 . 1 1 1 A 99 99 LEU HA H 99 4.200 4.402 -0.202 1
1 1253 . 1 1 1 A 99 99 LEU C C 99 177.300 175.996 1.304 1
1 1254 . 1 1 1 A 99 99 LEU CA C 99 55.000 56.493 -1.493 1
1 1255 . 1 1 1 A 99 99 LEU CB C 99 42.400 40.865 1.535 1
1 1259 . 1 1 1 A 99 99 LEU N N 99 122.500 118.120 4.380 1
1 1260 . 1 1 1 A 100 100 GLU H H 100 8.250 8.771 -0.521 1
1 1261 . 1 1 1 A 100 100 GLU HA H 100 4.140 4.289 -0.149 1
1 1266 . 1 1 1 A 100 100 GLU C C 100 176.100 176.054 0.046 1
1 1267 . 1 1 1 A 100 100 GLU CA C 100 56.100 58.600 -2.500 1
1 1268 . 1 1 1 A 100 100 GLU CB C 100 29.900 28.485 1.415 1
1 1270 . 1 1 1 A 100 100 GLU N N 100 121.000 118.747 2.253 1
1 1271 . 1 1 1 A 101 101 HIS H H 101 8.540 8.654 -0.114 1
1 1272 . 1 1 1 A 101 101 HIS HA H 101 4.600 5.035 -0.435 1
1 1275 . 1 1 1 A 101 101 HIS C C 101 174.200 176.201 -2.001 1
1 1276 . 1 1 1 A 101 101 HIS CA C 101 55.200 55.370 -0.170 1
1 1277 . 1 1 1 A 101 101 HIS CB C 101 29.000 30.501 -1.501 1
1 1278 . 1 1 1 A 101 101 HIS N N 101 119.400 119.144 0.256 1
1 1279 . 1 1 1 A 102 102 HIS H H 102 8.660 8.646 0.014 1
1 1280 . 1 1 1 A 102 102 HIS HA H 102 4.630 4.412 0.218 1
1 1283 . 1 1 1 A 102 102 HIS C C 102 174.200 176.575 -2.375 1
1 1284 . 1 1 1 A 102 102 HIS CA C 102 55.200 56.784 -1.584 1
1 1285 . 1 1 1 A 102 102 HIS CB C 102 29.100 29.437 -0.337 1
1 1286 . 1 1 1 A 102 102 HIS N N 102 119.700 119.368 0.332 1
1 1287 . 1 1 1 A 103 103 HIS H H 103 8.680 7.805 0.875 1
1 1288 . 1 1 1 A 103 103 HIS HA H 103 4.640 4.015 0.625 1
1 1291 . 1 1 1 A 103 103 HIS C C 103 174.200 175.074 -0.874 1
1 1292 . 1 1 1 A 103 103 HIS CA C 103 55.200 58.988 -3.788 1
1 1293 . 1 1 1 A 103 103 HIS CB C 103 29.200 29.522 -0.322 1
1 1294 . 1 1 1 A 103 103 HIS N N 103 120.500 116.759 3.741 1
1 1295 . 1 1 1 A 104 104 HIS H H 104 8.580 8.142 0.438 1
1 1296 . 1 1 1 A 104 104 HIS HA H 104 4.590 5.001 -0.411 1
1 1299 . 1 1 1 A 104 104 HIS C C 104 174.200 175.593 -1.393 1
1 1300 . 1 1 1 A 104 104 HIS CA C 104 55.200 54.406 0.794 1
1 1301 . 1 1 1 A 104 104 HIS CB C 104 29.300 32.257 -2.957 1
1 1302 . 1 1 1 A 104 104 HIS N N 104 120.700 115.593 5.107 1
1 1303 . 1 1 1 A 105 105 HIS H H 105 8.550 9.004 -0.454 1
1 1304 . 1 1 1 A 105 105 HIS HA H 105 4.610 4.190 0.420 1
1 1307 . 1 1 1 A 105 105 HIS C C 105 173.500 176.866 -3.366 1
1 1308 . 1 1 1 A 105 105 HIS CA C 105 55.400 58.761 -3.361 1
1 1309 . 1 1 1 A 105 105 HIS CB C 105 28.800 28.995 -0.195 1
1 1310 . 1 1 1 A 105 105 HIS N N 105 119.000 120.991 -1.991 1
1 7 . 2 1 1 A 2 2 ASP H H 2 8.890 7.751 1.139 1
1 8 . 2 1 1 A 2 2 ASP HA H 2 4.740 4.669 0.071 1
1 11 . 2 1 1 A 2 2 ASP C C 2 174.600 175.224 -0.624 1
1 12 . 2 1 1 A 2 2 ASP CA C 2 53.800 54.128 -0.328 1
1 13 . 2 1 1 A 2 2 ASP CB C 2 41.500 41.640 -0.140 1
1 14 . 2 1 1 A 2 2 ASP N N 2 122.100 121.465 0.635 1
1 15 . 2 1 1 A 3 3 LEU H H 3 8.280 8.413 -0.133 1
1 16 . 2 1 1 A 3 3 LEU HA H 3 4.420 4.613 -0.193 1
1 26 . 2 1 1 A 3 3 LEU C C 3 176.900 175.989 0.911 1
1 27 . 2 1 1 A 3 3 LEU CA C 3 55.000 56.034 -1.034 1
1 28 . 2 1 1 A 3 3 LEU CB C 3 42.700 42.361 0.339 1
1 32 . 2 1 1 A 3 3 LEU N N 3 122.300 126.158 -3.858 1
1 33 . 2 1 1 A 4 4 VAL H H 4 8.640 8.566 0.074 1
1 34 . 2 1 1 A 4 4 VAL HA H 4 4.540 4.978 -0.438 1
1 42 . 2 1 1 A 4 4 VAL C C 4 175.800 174.972 0.828 1
1 43 . 2 1 1 A 4 4 VAL CA C 4 59.400 58.605 0.795 1
1 44 . 2 1 1 A 4 4 VAL CB C 4 35.400 35.866 -0.466 1
1 47 . 2 1 1 A 4 4 VAL N N 4 122.600 119.440 3.160 1
1 48 . 2 1 1 A 5 5 LYS H H 5 8.630 8.610 0.020 1
1 49 . 2 1 1 A 5 5 LYS HA H 5 4.450 4.345 0.105 1
1 58 . 2 1 1 A 5 5 LYS C C 5 179.400 178.446 0.954 1
1 59 . 2 1 1 A 5 5 LYS CA C 5 53.600 56.164 -2.564 1
1 60 . 2 1 1 A 5 5 LYS CB C 5 30.900 33.299 -2.399 1
1 64 . 2 1 1 A 5 5 LYS N N 5 121.100 121.813 -0.713 1
1 65 . 2 1 1 A 6 6 ILE H H 6 10.320 8.889 1.431 1
1 66 . 2 1 1 A 6 6 ILE HA H 6 3.440 3.711 -0.271 1
1 76 . 2 1 1 A 6 6 ILE C C 6 178.300 177.627 0.673 1
1 77 . 2 1 1 A 6 6 ILE CA C 6 65.700 64.977 0.723 1
1 78 . 2 1 1 A 6 6 ILE CB C 6 35.900 37.840 -1.940 1
1 82 . 2 1 1 A 6 6 ILE N N 6 125.400 122.489 2.911 1
1 83 . 2 1 1 A 7 7 ARG H H 7 8.210 8.099 0.111 1
1 84 . 2 1 1 A 7 7 ARG HA H 7 3.850 4.210 -0.360 1
1 92 . 2 1 1 A 7 7 ARG C C 7 175.600 177.280 -1.680 1
1 93 . 2 1 1 A 7 7 ARG CA C 7 57.800 58.734 -0.934 1
1 94 . 2 1 1 A 7 7 ARG CB C 7 30.300 30.109 0.191 1
1 98 . 2 1 1 A 7 7 ARG N N 7 118.800 120.415 -1.615 1
1 100 . 2 1 1 A 8 8 ASP H H 8 7.850 7.750 0.100 1
1 101 . 2 1 1 A 8 8 ASP HA H 8 4.700 4.661 0.039 1
1 104 . 2 1 1 A 8 8 ASP C C 8 176.100 176.515 -0.415 1
1 105 . 2 1 1 A 8 8 ASP CA C 8 54.100 54.781 -0.681 1
1 106 . 2 1 1 A 8 8 ASP CB C 8 41.200 41.073 0.127 1
1 107 . 2 1 1 A 8 8 ASP N N 8 116.800 119.456 -2.656 1
1 108 . 2 1 1 A 9 9 VAL H H 9 7.240 7.319 -0.079 1
1 109 . 2 1 1 A 9 9 VAL HA H 9 3.710 3.967 -0.257 1
1 117 . 2 1 1 A 9 9 VAL C C 9 174.900 175.997 -1.097 1
1 118 . 2 1 1 A 9 9 VAL CA C 9 64.300 63.311 0.989 1
1 119 . 2 1 1 A 9 9 VAL CB C 9 31.500 31.581 -0.081 1
1 122 . 2 1 1 A 9 9 VAL N N 9 121.800 121.480 0.320 1
1 123 . 2 1 1 A 10 10 SER H H 10 8.600 8.999 -0.399 1
1 124 . 2 1 1 A 10 10 SER HA H 10 4.600 4.861 -0.261 1
1 127 . 2 1 1 A 10 10 SER CA C 10 56.700 57.194 -0.494 1
1 128 . 2 1 1 A 10 10 SER CB C 10 66.100 67.275 -1.175 1
1 129 . 2 1 1 A 10 10 SER N N 10 122.200 121.796 0.404 1
1 130 . 2 1 1 A 11 11 LEU H H 11 8.660 8.967 -0.307 1
1 131 . 2 1 1 A 11 11 LEU HA H 11 3.900 4.118 -0.218 1
1 141 . 2 1 1 A 11 11 LEU C C 11 178.100 178.804 -0.704 1
1 142 . 2 1 1 A 11 11 LEU CA C 11 56.700 56.627 0.073 1
1 143 . 2 1 1 A 11 11 LEU CB C 11 41.400 41.429 -0.029 1
1 147 . 2 1 1 A 11 11 LEU N N 11 120.300 126.309 -6.009 1
1 148 . 2 1 1 A 12 12 SER H H 12 8.160 7.796 0.364 1
1 149 . 2 1 1 A 12 12 SER HA H 12 4.270 4.291 -0.021 1
1 152 . 2 1 1 A 12 12 SER C C 12 174.200 174.594 -0.394 1
1 153 . 2 1 1 A 12 12 SER CA C 12 59.900 61.632 -1.732 1
1 154 . 2 1 1 A 12 12 SER CB C 12 63.100 63.190 -0.090 1
1 155 . 2 1 1 A 12 12 SER N N 12 112.100 113.702 -1.602 1
1 156 . 2 1 1 A 13 13 THR H H 13 7.460 7.367 0.093 1
1 157 . 2 1 1 A 13 13 THR HA H 13 4.760 4.769 -0.009 1
1 162 . 2 1 1 A 13 13 THR CA C 13 56.600 58.540 -1.940 1
1 163 . 2 1 1 A 13 13 THR CB C 13 70.100 70.199 -0.099 1
1 165 . 2 1 1 A 13 13 THR N N 13 114.700 111.579 3.121 1
1 166 . 2 1 1 A 14 14 PRO HA H 14 4.050 4.220 -0.170 1
1 173 . 2 1 1 A 14 14 PRO C C 14 175.800 175.946 -0.146 1
1 174 . 2 1 1 A 14 14 PRO CA C 14 65.100 65.115 -0.015 1
1 175 . 2 1 1 A 14 14 PRO CB C 14 32.100 31.699 0.401 1
1 178 . 2 1 1 A 15 15 TYR H H 15 7.380 7.747 -0.367 1
1 179 . 2 1 1 A 15 15 TYR HA H 15 5.570 5.609 -0.039 1
1 186 . 2 1 1 A 15 15 TYR C C 15 176.100 175.383 0.717 1
1 187 . 2 1 1 A 15 15 TYR CA C 15 56.400 56.849 -0.449 1
1 188 . 2 1 1 A 15 15 TYR CB C 15 41.500 41.728 -0.228 1
1 193 . 2 1 1 A 15 15 TYR N N 15 113.800 116.866 -3.066 1
1 194 . 2 1 1 A 16 16 VAL H H 16 9.010 8.746 0.264 1
1 195 . 2 1 1 A 16 16 VAL HA H 16 4.920 5.084 -0.164 1
1 203 . 2 1 1 A 16 16 VAL C C 16 174.300 174.164 0.136 1
1 204 . 2 1 1 A 16 16 VAL CA C 16 59.600 59.423 0.177 1
1 205 . 2 1 1 A 16 16 VAL CB C 16 36.800 36.296 0.504 1
1 208 . 2 1 1 A 16 16 VAL N N 16 113.800 117.279 -3.479 1
1 209 . 2 1 1 A 17 17 SER H H 17 7.960 8.498 -0.538 1
1 210 . 2 1 1 A 17 17 SER HA H 17 5.860 5.569 0.291 1
1 213 . 2 1 1 A 17 17 SER C C 17 172.700 173.659 -0.959 1
1 214 . 2 1 1 A 17 17 SER CA C 17 57.300 57.079 0.221 1
1 215 . 2 1 1 A 17 17 SER CB C 17 64.000 66.013 -2.013 1
1 216 . 2 1 1 A 17 17 SER N N 17 117.100 117.865 -0.765 1
1 217 . 2 1 1 A 18 18 VAL H H 18 8.570 8.618 -0.048 1
1 218 . 2 1 1 A 18 18 VAL HA H 18 4.900 5.115 -0.215 1
1 226 . 2 1 1 A 18 18 VAL C C 18 173.700 173.604 0.096 1
1 227 . 2 1 1 A 18 18 VAL CA C 18 58.800 59.060 -0.260 1
1 228 . 2 1 1 A 18 18 VAL CB C 18 36.700 35.979 0.721 1
1 231 . 2 1 1 A 18 18 VAL N N 18 113.500 118.232 -4.732 1
1 232 . 2 1 1 A 19 19 ILE H H 19 8.490 8.636 -0.146 1
1 233 . 2 1 1 A 19 19 ILE HA H 19 5.300 4.987 0.313 1
1 243 . 2 1 1 A 19 19 ILE C C 19 175.800 174.921 0.879 1
1 244 . 2 1 1 A 19 19 ILE CA C 19 59.700 59.486 0.214 1
1 245 . 2 1 1 A 19 19 ILE CB C 19 41.700 42.147 -0.447 1
1 249 . 2 1 1 A 19 19 ILE N N 19 120.600 122.220 -1.620 1
1 250 . 2 1 1 A 20 20 GLY H H 20 8.670 7.974 0.696 1
1 251 . 2 1 1 A 20 20 GLY HA2 H 20 3.760 4.243 -0.483 1
1 252 . 2 1 1 A 20 20 GLY HA3 H 20 4.190 4.247 -0.057 1
1 253 . 2 1 1 A 20 20 GLY C C 20 169.900 172.176 -2.276 1
1 254 . 2 1 1 A 20 20 GLY CA C 20 46.000 46.038 -0.038 1
1 255 . 2 1 1 A 20 20 GLY N N 20 110.200 114.229 -4.029 1
1 256 . 2 1 1 A 21 21 LYS H H 21 8.920 8.461 0.459 1
1 257 . 2 1 1 A 21 21 LYS HA H 21 5.210 5.328 -0.118 1
1 266 . 2 1 1 A 21 21 LYS C C 21 176.400 174.779 1.621 1
1 267 . 2 1 1 A 21 21 LYS CA C 21 54.400 54.482 -0.082 1
1 268 . 2 1 1 A 21 21 LYS CB C 21 35.400 36.090 -0.690 1
1 272 . 2 1 1 A 21 21 LYS N N 21 119.100 117.347 1.753 1
1 273 . 2 1 1 A 22 22 ILE H H 22 8.900 8.202 0.698 1
1 274 . 2 1 1 A 22 22 ILE HA H 22 5.050 5.020 0.030 1
1 284 . 2 1 1 A 22 22 ILE C C 22 176.900 175.456 1.444 1
1 285 . 2 1 1 A 22 22 ILE CA C 22 57.800 60.571 -2.771 1
1 286 . 2 1 1 A 22 22 ILE CB C 22 36.200 38.878 -2.678 1
1 290 . 2 1 1 A 22 22 ILE N N 22 130.000 124.592 5.408 1
1 291 . 2 1 1 A 23 23 THR H H 23 9.020 9.400 -0.380 1
1 292 . 2 1 1 A 23 23 THR HA H 23 4.660 5.082 -0.422 1
1 297 . 2 1 1 A 23 23 THR C C 23 174.000 174.966 -0.966 1
1 298 . 2 1 1 A 23 23 THR CA C 23 60.800 61.310 -0.510 1
1 299 . 2 1 1 A 23 23 THR CB C 23 73.400 71.774 1.626 1
1 301 . 2 1 1 A 23 23 THR N N 23 118.200 121.549 -3.349 1
1 302 . 2 1 1 A 24 24 GLY H H 24 8.430 8.713 -0.283 1
1 303 . 2 1 1 A 24 24 GLY HA2 H 24 3.910 3.902 0.008 1
1 304 . 2 1 1 A 24 24 GLY HA3 H 24 3.910 4.015 -0.105 1
1 305 . 2 1 1 A 24 24 GLY C C 24 175.400 174.439 0.961 1
1 306 . 2 1 1 A 24 24 GLY CA C 24 47.100 46.343 0.757 1
1 307 . 2 1 1 A 24 24 GLY N N 24 107.200 113.257 -6.057 1
1 308 . 2 1 1 A 25 25 ILE H H 25 9.370 8.360 1.010 1
1 309 . 2 1 1 A 25 25 ILE HA H 25 4.480 4.266 0.214 1
1 319 . 2 1 1 A 25 25 ILE C C 25 178.200 175.434 2.766 1
1 320 . 2 1 1 A 25 25 ILE CA C 25 59.200 60.956 -1.756 1
1 321 . 2 1 1 A 25 25 ILE CB C 25 35.400 38.794 -3.394 1
1 325 . 2 1 1 A 25 25 ILE N N 25 120.600 122.610 -2.010 1
1 326 . 2 1 1 A 26 26 HIS H H 26 9.000 9.405 -0.405 1
1 327 . 2 1 1 A 26 26 HIS HA H 26 4.770 5.200 -0.430 1
1 330 . 2 1 1 A 26 26 HIS C C 26 172.700 173.427 -0.727 1
1 331 . 2 1 1 A 26 26 HIS CA C 26 55.000 54.552 0.448 1
1 332 . 2 1 1 A 26 26 HIS CB C 26 31.100 33.562 -2.462 1
1 333 . 2 1 1 A 26 26 HIS N N 26 123.800 125.588 -1.788 1
1 334 . 2 1 1 A 27 27 LYS H H 27 8.930 8.994 -0.064 1
1 335 . 2 1 1 A 27 27 LYS HA H 27 4.770 4.707 0.063 1
1 344 . 2 1 1 A 27 27 LYS C C 27 175.300 175.005 0.295 1
1 345 . 2 1 1 A 27 27 LYS CA C 27 55.100 54.680 0.420 1
1 346 . 2 1 1 A 27 27 LYS CB C 27 34.400 35.057 -0.657 1
1 350 . 2 1 1 A 27 27 LYS N N 27 125.900 124.114 1.786 1
1 351 . 2 1 1 A 28 28 LYS H H 28 8.880 8.726 0.154 1
1 352 . 2 1 1 A 28 28 LYS HA H 28 4.570 5.003 -0.433 1
1 361 . 2 1 1 A 28 28 LYS C C 28 174.500 175.031 -0.531 1
1 362 . 2 1 1 A 28 28 LYS CA C 28 54.600 54.550 0.050 1
1 363 . 2 1 1 A 28 28 LYS CB C 28 35.300 37.098 -1.798 1
1 367 . 2 1 1 A 28 28 LYS N N 28 127.400 124.793 2.607 1
1 368 . 2 1 1 A 29 29 GLU H H 29 8.440 8.411 0.029 1
1 369 . 2 1 1 A 29 29 GLU HA H 29 5.260 5.178 0.082 1
1 374 . 2 1 1 A 29 29 GLU C C 29 175.800 175.636 0.164 1
1 375 . 2 1 1 A 29 29 GLU CA C 29 54.800 54.855 -0.055 1
1 376 . 2 1 1 A 29 29 GLU CB C 29 31.500 32.956 -1.456 1
1 378 . 2 1 1 A 29 29 GLU N N 29 122.200 120.576 1.624 1
1 379 . 2 1 1 A 30 30 TYR H H 30 8.960 8.707 0.253 1
1 380 . 2 1 1 A 30 30 TYR HA H 30 4.820 5.352 -0.532 1
1 387 . 2 1 1 A 30 30 TYR C C 30 172.600 172.279 0.321 1
1 388 . 2 1 1 A 30 30 TYR CA C 30 56.300 55.584 0.716 1
1 389 . 2 1 1 A 30 30 TYR CB C 30 40.500 41.561 -1.061 1
1 394 . 2 1 1 A 30 30 TYR N N 30 121.100 118.741 2.359 1
1 395 . 2 1 1 A 31 31 GLU H H 31 8.610 8.834 -0.224 1
1 396 . 2 1 1 A 31 31 GLU HA H 31 4.810 4.842 -0.032 1
1 401 . 2 1 1 A 31 31 GLU C C 31 176.100 175.207 0.893 1
1 402 . 2 1 1 A 31 31 GLU CA C 31 55.100 55.567 -0.467 1
1 403 . 2 1 1 A 31 31 GLU CB C 31 30.300 31.192 -0.892 1
1 405 . 2 1 1 A 31 31 GLU N N 31 121.800 121.760 0.040 1
1 406 . 2 1 1 A 32 32 SER H H 32 8.570 9.190 -0.620 1
1 407 . 2 1 1 A 32 32 SER HA H 32 4.520 4.746 -0.226 1
1 410 . 2 1 1 A 32 32 SER C C 32 174.300 172.691 1.609 1
1 411 . 2 1 1 A 32 32 SER CA C 32 57.300 57.659 -0.359 1
1 412 . 2 1 1 A 32 32 SER CB C 32 64.100 66.361 -2.261 1
1 413 . 2 1 1 A 32 32 SER N N 32 118.500 120.516 -2.016 1
1 414 . 2 1 1 A 33 33 ASP H H 33 9.290 9.335 -0.045 1
1 415 . 2 1 1 A 33 33 ASP HA H 33 4.340 4.335 0.005 1
1 418 . 2 1 1 A 33 33 ASP C C 33 175.900 176.332 -0.432 1
1 419 . 2 1 1 A 33 33 ASP CA C 33 55.000 55.356 -0.356 1
1 420 . 2 1 1 A 33 33 ASP CB C 33 39.300 39.521 -0.221 1
1 421 . 2 1 1 A 33 33 ASP N N 33 125.700 128.061 -2.361 1
1 422 . 2 1 1 A 34 34 GLY H H 34 8.690 8.378 0.312 1
1 423 . 2 1 1 A 34 34 GLY HA2 H 34 3.660 3.838 -0.178 1
1 424 . 2 1 1 A 34 34 GLY HA3 H 34 4.140 3.839 0.301 1
1 425 . 2 1 1 A 34 34 GLY C C 34 174.200 173.544 0.656 1
1 426 . 2 1 1 A 34 34 GLY CA C 34 45.600 45.755 -0.155 1
1 427 . 2 1 1 A 34 34 GLY N N 34 104.800 104.741 0.059 1
1 428 . 2 1 1 A 35 35 THR H H 35 7.840 7.970 -0.130 1
1 429 . 2 1 1 A 35 35 THR HA H 35 4.660 4.906 -0.246 1
1 434 . 2 1 1 A 35 35 THR C C 35 173.000 173.181 -0.181 1
1 435 . 2 1 1 A 35 35 THR CA C 35 60.200 59.184 1.016 1
1 436 . 2 1 1 A 35 35 THR CB C 35 71.200 72.947 -1.747 1
1 438 . 2 1 1 A 35 35 THR N N 35 114.800 109.554 5.246 1
1 439 . 2 1 1 A 36 36 THR H H 36 8.480 8.659 -0.179 1
1 440 . 2 1 1 A 36 36 THR HA H 36 4.620 4.858 -0.238 1
1 445 . 2 1 1 A 36 36 THR C C 36 173.800 173.671 0.129 1
1 446 . 2 1 1 A 36 36 THR CA C 36 62.300 61.758 0.542 1
1 447 . 2 1 1 A 36 36 THR CB C 36 69.500 69.713 -0.213 1
1 449 . 2 1 1 A 36 36 THR N N 36 119.400 117.498 1.902 1
1 450 . 2 1 1 A 37 37 LYS H H 37 8.880 8.090 0.790 1
1 451 . 2 1 1 A 37 37 LYS HA H 37 4.570 4.726 -0.156 1
1 460 . 2 1 1 A 37 37 LYS C C 37 174.500 176.139 -1.639 1
1 461 . 2 1 1 A 37 37 LYS CA C 37 54.600 54.256 0.344 1
1 462 . 2 1 1 A 37 37 LYS CB C 37 35.500 35.647 -0.147 1
1 466 . 2 1 1 A 37 37 LYS N N 37 128.000 125.828 2.172 1
1 467 . 2 1 1 A 38 38 SER H H 38 8.370 8.788 -0.418 1
1 468 . 2 1 1 A 38 38 SER HA H 38 5.250 5.110 0.140 1
1 471 . 2 1 1 A 38 38 SER C C 38 173.200 173.777 -0.577 1
1 472 . 2 1 1 A 38 38 SER CA C 38 57.900 57.165 0.735 1
1 473 . 2 1 1 A 38 38 SER CB C 38 65.500 64.654 0.846 1
1 474 . 2 1 1 A 38 38 SER N N 38 114.300 117.461 -3.161 1
1 475 . 2 1 1 A 39 39 VAL H H 39 9.020 9.065 -0.045 1
1 476 . 2 1 1 A 39 39 VAL HA H 39 4.900 5.046 -0.146 1
1 484 . 2 1 1 A 39 39 VAL C C 39 173.200 172.693 0.507 1
1 485 . 2 1 1 A 39 39 VAL CA C 39 59.200 59.667 -0.467 1
1 486 . 2 1 1 A 39 39 VAL CB C 39 34.600 35.326 -0.726 1
1 489 . 2 1 1 A 39 39 VAL N N 39 123.600 121.169 2.431 1
1 490 . 2 1 1 A 40 40 TYR H H 40 8.900 9.034 -0.134 1
1 491 . 2 1 1 A 40 40 TYR HA H 40 4.730 5.311 -0.581 1
1 498 . 2 1 1 A 40 40 TYR CA C 40 56.500 57.055 -0.555 1
1 499 . 2 1 1 A 40 40 TYR CB C 40 39.000 40.458 -1.458 1
1 504 . 2 1 1 A 40 40 TYR N N 40 126.300 127.650 -1.350 1
1 505 . 2 1 1 A 41 41 GLN H H 41 8.630 8.893 -0.263 1
1 506 . 2 1 1 A 41 41 GLN HA H 41 5.330 5.404 -0.074 1
1 513 . 2 1 1 A 41 41 GLN C C 41 175.500 175.592 -0.092 1
1 514 . 2 1 1 A 41 41 GLN CA C 41 53.800 54.174 -0.374 1
1 515 . 2 1 1 A 41 41 GLN CB C 41 32.100 32.215 -0.115 1
1 518 . 2 1 1 A 41 41 GLN N N 41 122.000 121.828 0.172 1
1 520 . 2 1 1 A 42 42 GLY H H 42 8.560 7.845 0.715 1
1 521 . 2 1 1 A 42 42 GLY HA2 H 42 3.680 4.243 -0.563 1
1 522 . 2 1 1 A 42 42 GLY HA3 H 42 4.020 4.262 -0.242 1
1 523 . 2 1 1 A 42 42 GLY C C 42 171.600 171.098 0.502 1
1 524 . 2 1 1 A 42 42 GLY CA C 42 47.300 46.090 1.210 1
1 525 . 2 1 1 A 42 42 GLY N N 42 113.000 108.499 4.501 1
1 526 . 2 1 1 A 43 43 TYR H H 43 9.320 8.348 0.972 1
1 527 . 2 1 1 A 43 43 TYR HA H 43 5.280 5.453 -0.173 1
1 534 . 2 1 1 A 43 43 TYR C C 43 173.200 174.256 -1.056 1
1 535 . 2 1 1 A 43 43 TYR CA C 43 57.600 56.455 1.145 1
1 536 . 2 1 1 A 43 43 TYR CB C 43 42.400 41.968 0.432 1
1 541 . 2 1 1 A 43 43 TYR N N 43 126.300 118.980 7.320 1
1 542 . 2 1 1 A 44 44 ILE H H 44 9.160 8.916 0.244 1
1 543 . 2 1 1 A 44 44 ILE HA H 44 5.270 5.389 -0.119 1
1 553 . 2 1 1 A 44 44 ILE C C 44 172.900 174.422 -1.522 1
1 554 . 2 1 1 A 44 44 ILE CA C 44 59.000 59.360 -0.360 1
1 555 . 2 1 1 A 44 44 ILE CB C 44 42.200 41.553 0.647 1
1 559 . 2 1 1 A 44 44 ILE N N 44 117.700 123.321 -5.621 1
1 560 . 2 1 1 A 45 45 GLU H H 45 8.420 8.923 -0.503 1
1 561 . 2 1 1 A 45 45 GLU HA H 45 5.600 5.490 0.110 1
1 566 . 2 1 1 A 45 45 GLU C C 45 174.300 174.381 -0.081 1
1 567 . 2 1 1 A 45 45 GLU CA C 45 54.000 54.314 -0.314 1
1 568 . 2 1 1 A 45 45 GLU CB C 45 34.400 34.091 0.309 1
1 570 . 2 1 1 A 45 45 GLU N N 45 123.600 127.424 -3.824 1
1 571 . 2 1 1 A 46 46 ASP H H 46 8.530 8.407 0.123 1
1 572 . 2 1 1 A 46 46 ASP HA H 46 5.070 5.091 -0.021 1
1 575 . 2 1 1 A 46 46 ASP C C 46 175.000 175.733 -0.733 1
1 576 . 2 1 1 A 46 46 ASP CA C 46 51.800 53.671 -1.871 1
1 577 . 2 1 1 A 46 46 ASP CB C 46 41.300 42.452 -1.152 1
1 578 . 2 1 1 A 46 46 ASP N N 46 125.500 117.705 7.795 1
1 579 . 2 1 1 A 47 47 ASP H H 47 9.160 9.273 -0.113 1
1 580 . 2 1 1 A 47 47 ASP HA H 47 4.430 4.481 -0.051 1
1 583 . 2 1 1 A 47 47 ASP C C 47 176.000 176.708 -0.708 1
1 584 . 2 1 1 A 47 47 ASP CA C 47 55.000 56.954 -1.954 1
1 585 . 2 1 1 A 47 47 ASP CB C 47 38.900 40.318 -1.418 1
1 586 . 2 1 1 A 47 47 ASP N N 47 114.200 120.097 -5.897 1
1 587 . 2 1 1 A 48 48 THR H H 48 9.470 8.871 0.599 1
1 588 . 2 1 1 A 48 48 THR HA H 48 4.520 4.098 0.422 1
1 593 . 2 1 1 A 48 48 THR C C 48 174.500 174.261 0.239 1
1 594 . 2 1 1 A 48 48 THR CA C 48 62.600 65.110 -2.510 1
1 595 . 2 1 1 A 48 48 THR CB C 48 70.400 68.221 2.179 1
1 597 . 2 1 1 A 48 48 THR N N 48 111.800 111.856 -0.056 1
1 598 . 2 1 1 A 49 49 ALA H H 49 7.850 7.459 0.391 1
1 599 . 2 1 1 A 49 49 ALA HA H 49 4.440 4.414 0.026 1
1 603 . 2 1 1 A 49 49 ALA C C 49 173.200 175.494 -2.294 1
1 604 . 2 1 1 A 49 49 ALA CA C 49 52.700 51.441 1.259 1
1 605 . 2 1 1 A 49 49 ALA CB C 49 21.300 20.068 1.232 1
1 606 . 2 1 1 A 49 49 ALA N N 49 123.400 120.995 2.405 1
1 607 . 2 1 1 A 50 50 ARG H H 50 8.160 8.808 -0.648 1
1 608 . 2 1 1 A 50 50 ARG HA H 50 5.350 5.559 -0.209 1
1 616 . 2 1 1 A 50 50 ARG C C 50 174.700 174.271 0.429 1
1 617 . 2 1 1 A 50 50 ARG CA C 50 54.000 54.559 -0.559 1
1 618 . 2 1 1 A 50 50 ARG CB C 50 34.500 34.276 0.224 1
1 622 . 2 1 1 A 50 50 ARG N N 50 117.400 114.923 2.477 1
1 624 . 2 1 1 A 51 51 ILE H H 51 9.390 8.814 0.576 1
1 625 . 2 1 1 A 51 51 ILE HA H 51 4.790 5.084 -0.294 1
1 635 . 2 1 1 A 51 51 ILE C C 51 172.600 174.626 -2.026 1
1 636 . 2 1 1 A 51 51 ILE CA C 51 60.000 59.111 0.889 1
1 637 . 2 1 1 A 51 51 ILE CB C 51 42.800 42.167 0.633 1
1 641 . 2 1 1 A 51 51 ILE N N 51 124.600 120.945 3.655 1
1 642 . 2 1 1 A 52 52 ARG H H 52 7.980 8.408 -0.428 1
1 643 . 2 1 1 A 52 52 ARG HA H 52 4.170 4.375 -0.205 1
1 651 . 2 1 1 A 52 52 ARG C C 52 174.600 176.273 -1.673 1
1 652 . 2 1 1 A 52 52 ARG CA C 52 57.100 56.102 0.998 1
1 653 . 2 1 1 A 52 52 ARG CB C 52 31.300 30.877 0.423 1
1 657 . 2 1 1 A 52 52 ARG N N 52 125.900 125.918 -0.018 1
1 659 . 2 1 1 A 53 53 ILE H H 53 8.290 8.662 -0.372 1
1 660 . 2 1 1 A 53 53 ILE HA H 53 5.160 5.119 0.041 1
1 670 . 2 1 1 A 53 53 ILE C C 53 172.400 174.164 -1.764 1
1 671 . 2 1 1 A 53 53 ILE CA C 53 58.600 59.290 -0.690 1
1 672 . 2 1 1 A 53 53 ILE CB C 53 41.900 42.472 -0.572 1
1 676 . 2 1 1 A 53 53 ILE N N 53 118.500 119.032 -0.532 1
1 677 . 2 1 1 A 54 54 SER H H 54 8.350 8.801 -0.451 1
1 678 . 2 1 1 A 54 54 SER HA H 54 5.070 5.207 -0.137 1
1 681 . 2 1 1 A 54 54 SER C C 54 172.400 172.705 -0.305 1
1 682 . 2 1 1 A 54 54 SER CA C 54 57.000 56.648 0.352 1
1 683 . 2 1 1 A 54 54 SER CB C 54 65.900 64.951 0.949 1
1 684 . 2 1 1 A 54 54 SER N N 54 120.700 118.647 2.053 1
1 685 . 2 1 1 A 55 55 SER H H 55 9.130 9.066 0.064 1
1 686 . 2 1 1 A 55 55 SER HA H 55 5.270 5.240 0.030 1
1 690 . 2 1 1 A 55 55 SER C C 55 174.400 172.810 1.590 1
1 691 . 2 1 1 A 55 55 SER CA C 55 55.500 56.115 -0.615 1
1 692 . 2 1 1 A 55 55 SER CB C 55 64.500 65.803 -1.303 1
1 693 . 2 1 1 A 55 55 SER N N 55 117.200 120.086 -2.886 1
1 694 . 2 1 1 A 56 56 PHE H H 56 8.970 8.575 0.395 1
1 695 . 2 1 1 A 56 56 PHE HA H 56 4.600 4.916 -0.316 1
1 703 . 2 1 1 A 56 56 PHE C C 56 176.500 177.261 -0.761 1
1 704 . 2 1 1 A 56 56 PHE CA C 56 58.300 57.721 0.579 1
1 705 . 2 1 1 A 56 56 PHE CB C 56 37.900 40.395 -2.495 1
1 711 . 2 1 1 A 56 56 PHE N N 56 129.400 122.786 6.614 1
1 712 . 2 1 1 A 57 57 GLY H H 57 8.570 8.924 -0.354 1
1 713 . 2 1 1 A 57 57 GLY HA2 H 57 4.020 4.150 -0.130 1
1 714 . 2 1 1 A 57 57 GLY HA3 H 57 4.380 4.204 0.176 1
1 715 . 2 1 1 A 57 57 GLY C C 57 173.700 173.981 -0.281 1
1 716 . 2 1 1 A 57 57 GLY CA C 57 46.300 45.651 0.649 1
1 717 . 2 1 1 A 57 57 GLY N N 57 112.500 112.247 0.253 1
1 718 . 2 1 1 A 58 58 LYS H H 58 6.800 8.028 -1.228 1
1 719 . 2 1 1 A 58 58 LYS HA H 58 4.410 4.346 0.064 1
1 728 . 2 1 1 A 58 58 LYS C C 58 174.800 175.479 -0.679 1
1 729 . 2 1 1 A 58 58 LYS CA C 58 55.200 56.387 -1.187 1
1 730 . 2 1 1 A 58 58 LYS CB C 58 33.300 33.343 -0.043 1
1 734 . 2 1 1 A 58 58 LYS N N 58 118.700 120.996 -2.296 1
1 735 . 2 1 1 A 59 59 GLN H H 59 8.390 8.518 -0.128 1
1 736 . 2 1 1 A 59 59 GLN HA H 59 1.830 4.020 -2.190 1
1 743 . 2 1 1 A 59 59 GLN C C 59 174.100 174.377 -0.277 1
1 744 . 2 1 1 A 59 59 GLN CA C 59 57.100 54.594 2.506 1
1 745 . 2 1 1 A 59 59 GLN CB C 59 28.900 30.041 -1.141 1
1 748 . 2 1 1 A 59 59 GLN N N 59 124.000 123.180 0.820 1
1 750 . 2 1 1 A 60 60 LEU H H 60 5.320 8.395 -3.075 1
1 751 . 2 1 1 A 60 60 LEU HA H 60 4.370 4.970 -0.600 1
1 761 . 2 1 1 A 60 60 LEU CA C 60 52.800 53.496 -0.696 1
1 762 . 2 1 1 A 60 60 LEU CB C 60 46.700 45.500 1.200 1
1 766 . 2 1 1 A 60 60 LEU N N 60 121.800 125.103 -3.303 1
1 767 . 2 1 1 A 61 61 GLN H H 61 8.660 8.866 -0.206 1
1 768 . 2 1 1 A 61 61 GLN HA H 61 4.440 4.833 -0.393 1
1 775 . 2 1 1 A 61 61 GLN C C 61 174.000 174.566 -0.566 1
1 776 . 2 1 1 A 61 61 GLN CA C 61 53.800 54.063 -0.263 1
1 777 . 2 1 1 A 61 61 GLN CB C 61 31.800 31.871 -0.071 1
1 780 . 2 1 1 A 61 61 GLN N N 61 120.300 120.607 -0.307 1
1 782 . 2 1 1 A 62 62 ASP H H 62 8.450 8.740 -0.290 1
1 783 . 2 1 1 A 62 62 ASP HA H 62 4.130 4.518 -0.388 1
1 786 . 2 1 1 A 62 62 ASP C C 62 177.200 176.834 0.366 1
1 787 . 2 1 1 A 62 62 ASP CA C 62 55.700 55.514 0.186 1
1 788 . 2 1 1 A 62 62 ASP CB C 62 39.400 40.681 -1.281 1
1 789 . 2 1 1 A 62 62 ASP N N 62 122.400 124.149 -1.749 1
1 790 . 2 1 1 A 63 63 SER H H 63 9.210 8.993 0.217 1
1 791 . 2 1 1 A 63 63 SER HA H 63 3.850 4.279 -0.429 1
1 794 . 2 1 1 A 63 63 SER C C 63 173.200 173.664 -0.464 1
1 795 . 2 1 1 A 63 63 SER CA C 63 61.700 59.624 2.076 1
1 796 . 2 1 1 A 63 63 SER CB C 63 61.800 61.137 0.663 1
1 797 . 2 1 1 A 63 63 SER N N 63 114.300 121.360 -7.060 1
1 798 . 2 1 1 A 64 64 ASP H H 64 7.960 7.760 0.200 1
1 799 . 2 1 1 A 64 64 ASP HA H 64 4.540 4.728 -0.188 1
1 802 . 2 1 1 A 64 64 ASP C C 64 174.900 175.617 -0.717 1
1 803 . 2 1 1 A 64 64 ASP CA C 64 54.900 53.611 1.289 1
1 804 . 2 1 1 A 64 64 ASP CB C 64 40.900 41.508 -0.608 1
1 805 . 2 1 1 A 64 64 ASP N N 64 122.600 122.967 -0.367 1
1 806 . 2 1 1 A 65 65 VAL H H 65 8.180 8.592 -0.412 1
1 807 . 2 1 1 A 65 65 VAL HA H 65 4.670 4.535 0.135 1
1 815 . 2 1 1 A 65 65 VAL C C 65 175.900 175.618 0.282 1
1 816 . 2 1 1 A 65 65 VAL CA C 65 62.300 62.306 -0.006 1
1 817 . 2 1 1 A 65 65 VAL CB C 65 31.700 31.248 0.452 1
1 820 . 2 1 1 A 65 65 VAL N N 65 123.100 125.129 -2.029 1
1 821 . 2 1 1 A 66 66 VAL H H 66 8.770 8.990 -0.220 1
1 822 . 2 1 1 A 66 66 VAL HA H 66 5.160 5.097 0.063 1
1 830 . 2 1 1 A 66 66 VAL C C 66 173.600 173.294 0.306 1
1 831 . 2 1 1 A 66 66 VAL CA C 66 58.100 58.758 -0.658 1
1 832 . 2 1 1 A 66 66 VAL CB C 66 35.700 36.183 -0.483 1
1 835 . 2 1 1 A 66 66 VAL N N 66 118.100 120.678 -2.578 1
1 836 . 2 1 1 A 67 67 ARG H H 67 8.880 8.644 0.236 1
1 837 . 2 1 1 A 67 67 ARG HA H 67 5.110 5.204 -0.094 1
1 845 . 2 1 1 A 67 67 ARG C C 67 175.300 174.571 0.729 1
1 846 . 2 1 1 A 67 67 ARG CA C 67 54.200 54.346 -0.146 1
1 847 . 2 1 1 A 67 67 ARG CB C 67 32.200 33.500 -1.300 1
1 851 . 2 1 1 A 67 67 ARG N N 67 120.200 121.831 -1.631 1
1 853 . 2 1 1 A 68 68 ILE H H 68 9.220 8.933 0.287 1
1 854 . 2 1 1 A 68 68 ILE HA H 68 4.990 4.693 0.297 1
1 864 . 2 1 1 A 68 68 ILE C C 68 174.900 174.758 0.142 1
1 865 . 2 1 1 A 68 68 ILE CA C 68 58.600 59.597 -0.997 1
1 866 . 2 1 1 A 68 68 ILE CB C 68 39.300 38.820 0.480 1
1 870 . 2 1 1 A 68 68 ILE N N 68 127.200 128.286 -1.086 1
1 871 . 2 1 1 A 69 69 ASP H H 69 9.110 9.028 0.082 1
1 872 . 2 1 1 A 69 69 ASP HA H 69 5.370 5.257 0.113 1
1 875 . 2 1 1 A 69 69 ASP C C 69 175.800 176.385 -0.585 1
1 876 . 2 1 1 A 69 69 ASP CA C 69 52.400 52.611 -0.211 1
1 877 . 2 1 1 A 69 69 ASP CB C 69 43.700 43.231 0.469 1
1 878 . 2 1 1 A 69 69 ASP N N 69 123.400 125.638 -2.238 1
1 879 . 2 1 1 A 70 70 ASN H H 70 8.300 8.664 -0.364 1
1 880 . 2 1 1 A 70 70 ASN HA H 70 4.160 4.358 -0.198 1
1 885 . 2 1 1 A 70 70 ASN C C 70 176.300 174.615 1.685 1
1 886 . 2 1 1 A 70 70 ASN CA C 70 54.300 54.139 0.161 1
1 887 . 2 1 1 A 70 70 ASN CB C 70 37.500 37.527 -0.027 1
1 889 . 2 1 1 A 70 70 ASN N N 70 119.800 121.075 -1.275 1
1 891 . 2 1 1 A 71 71 ALA H H 71 9.100 7.644 1.456 1
1 892 . 2 1 1 A 71 71 ALA HA H 71 4.500 4.520 -0.020 1
1 896 . 2 1 1 A 71 71 ALA C C 71 175.700 176.735 -1.035 1
1 897 . 2 1 1 A 71 71 ALA CA C 71 51.900 52.693 -0.793 1
1 898 . 2 1 1 A 71 71 ALA CB C 71 19.600 19.920 -0.320 1
1 899 . 2 1 1 A 71 71 ALA N N 71 123.000 121.123 1.877 1
1 900 . 2 1 1 A 72 72 ARG H H 72 8.490 8.559 -0.069 1
1 901 . 2 1 1 A 72 72 ARG HA H 72 4.720 4.733 -0.013 1
1 909 . 2 1 1 A 72 72 ARG C C 72 175.800 175.357 0.443 1
1 910 . 2 1 1 A 72 72 ARG CA C 72 54.400 55.140 -0.740 1
1 911 . 2 1 1 A 72 72 ARG CB C 72 32.700 31.837 0.863 1
1 915 . 2 1 1 A 72 72 ARG N N 72 122.500 123.397 -0.897 1
1 917 . 2 1 1 A 73 73 VAL H H 73 8.310 8.040 0.270 1
1 918 . 2 1 1 A 73 73 VAL HA H 73 4.250 4.525 -0.275 1
1 926 . 2 1 1 A 73 73 VAL C C 73 174.600 175.796 -1.196 1
1 927 . 2 1 1 A 73 73 VAL CA C 73 62.800 62.194 0.606 1
1 928 . 2 1 1 A 73 73 VAL CB C 73 32.100 31.841 0.259 1
1 931 . 2 1 1 A 73 73 VAL N N 73 127.100 126.437 0.663 1
1 932 . 2 1 1 A 74 74 ALA H H 74 8.880 8.815 0.065 1
1 933 . 2 1 1 A 74 74 ALA HA H 74 4.500 5.020 -0.520 1
1 937 . 2 1 1 A 74 74 ALA C C 74 174.800 174.783 0.017 1
1 938 . 2 1 1 A 74 74 ALA CA C 74 50.500 50.681 -0.181 1
1 939 . 2 1 1 A 74 74 ALA CB C 74 22.500 23.806 -1.306 1
1 940 . 2 1 1 A 74 74 ALA N N 74 131.000 128.938 2.062 1
1 941 . 2 1 1 A 75 75 GLN H H 75 8.280 8.560 -0.280 1
1 942 . 2 1 1 A 75 75 GLN HA H 75 4.910 5.136 -0.226 1
1 949 . 2 1 1 A 75 75 GLN C C 75 175.100 174.114 0.986 1
1 950 . 2 1 1 A 75 75 GLN CA C 75 54.600 54.101 0.499 1
1 951 . 2 1 1 A 75 75 GLN CB C 75 31.400 31.485 -0.085 1
1 954 . 2 1 1 A 75 75 GLN N N 75 118.800 120.707 -1.907 1
1 956 . 2 1 1 A 76 76 PHE H H 76 8.710 9.152 -0.442 1
1 957 . 2 1 1 A 76 76 PHE HA H 76 4.660 4.902 -0.242 1
1 965 . 2 1 1 A 76 76 PHE C C 76 174.900 176.300 -1.400 1
1 966 . 2 1 1 A 76 76 PHE CA C 76 57.000 56.697 0.303 1
1 967 . 2 1 1 A 76 76 PHE CB C 76 41.000 41.827 -0.827 1
1 973 . 2 1 1 A 76 76 PHE N N 76 125.000 125.690 -0.690 1
1 974 . 2 1 1 A 77 77 ASN H H 77 9.040 9.549 -0.509 1
1 975 . 2 1 1 A 77 77 ASN HA H 77 4.170 4.530 -0.360 1
1 980 . 2 1 1 A 77 77 ASN C C 77 174.200 174.878 -0.678 1
1 981 . 2 1 1 A 77 77 ASN CA C 77 53.800 54.212 -0.412 1
1 982 . 2 1 1 A 77 77 ASN CB C 77 37.400 37.624 -0.224 1
1 984 . 2 1 1 A 77 77 ASN N N 77 123.200 122.891 0.309 1
1 986 . 2 1 1 A 78 78 GLY H H 78 8.370 8.617 -0.247 1
1 987 . 2 1 1 A 78 78 GLY HA2 H 78 3.410 3.690 -0.280 1
1 988 . 2 1 1 A 78 78 GLY HA3 H 78 3.980 3.743 0.237 1
1 989 . 2 1 1 A 78 78 GLY C C 78 173.800 173.218 0.582 1
1 990 . 2 1 1 A 78 78 GLY CA C 78 45.000 45.445 -0.445 1
1 991 . 2 1 1 A 78 78 GLY N N 78 103.300 104.304 -1.004 1
1 992 . 2 1 1 A 79 79 TYR H H 79 7.670 8.236 -0.566 1
1 993 . 2 1 1 A 79 79 TYR HA H 79 4.860 4.873 -0.013 1
1 1000 . 2 1 1 A 79 79 TYR C C 79 174.800 175.615 -0.815 1
1 1001 . 2 1 1 A 79 79 TYR CA C 79 56.300 57.313 -1.013 1
1 1002 . 2 1 1 A 79 79 TYR CB C 79 40.800 41.152 -0.352 1
1 1007 . 2 1 1 A 79 79 TYR N N 79 118.700 118.989 -0.289 1
1 1008 . 2 1 1 A 80 80 LEU H H 80 8.760 8.668 0.092 1
1 1009 . 2 1 1 A 80 80 LEU HA H 80 4.830 4.452 0.378 1
1 1019 . 2 1 1 A 80 80 LEU C C 80 176.200 176.276 -0.076 1
1 1020 . 2 1 1 A 80 80 LEU CA C 80 54.700 55.066 -0.366 1
1 1021 . 2 1 1 A 80 80 LEU CB C 80 43.500 42.354 1.146 1
1 1025 . 2 1 1 A 80 80 LEU N N 80 122.600 125.245 -2.645 1
1 1026 . 2 1 1 A 81 81 SER H H 81 8.650 9.021 -0.371 1
1 1027 . 2 1 1 A 81 81 SER HA H 81 4.860 5.383 -0.523 1
1 1030 . 2 1 1 A 81 81 SER C C 81 172.600 172.460 0.140 1
1 1031 . 2 1 1 A 81 81 SER CA C 81 56.600 57.310 -0.710 1
1 1032 . 2 1 1 A 81 81 SER CB C 81 66.300 66.565 -0.265 1
1 1033 . 2 1 1 A 81 81 SER N N 81 114.700 117.323 -2.623 1
1 1034 . 2 1 1 A 82 82 LEU H H 82 8.680 8.669 0.011 1
1 1035 . 2 1 1 A 82 82 LEU HA H 82 5.190 5.319 -0.129 1
1 1045 . 2 1 1 A 82 82 LEU C C 82 177.100 175.665 1.435 1
1 1046 . 2 1 1 A 82 82 LEU CA C 82 53.300 53.772 -0.472 1
1 1047 . 2 1 1 A 82 82 LEU CB C 82 43.800 43.759 0.041 1
1 1051 . 2 1 1 A 82 82 LEU N N 82 119.800 122.560 -2.760 1
1 1052 . 2 1 1 A 83 83 SER H H 83 9.560 9.503 0.057 1
1 1053 . 2 1 1 A 83 83 SER HA H 83 5.390 5.307 0.083 1
1 1056 . 2 1 1 A 83 83 SER C C 83 174.200 173.966 0.234 1
1 1057 . 2 1 1 A 83 83 SER CA C 83 57.100 57.877 -0.777 1
1 1058 . 2 1 1 A 83 83 SER CB C 83 64.400 64.358 0.042 1
1 1059 . 2 1 1 A 83 83 SER N N 83 119.000 122.000 -3.000 1
1 1060 . 2 1 1 A 84 84 VAL H H 84 9.150 9.357 -0.207 1
1 1061 . 2 1 1 A 84 84 VAL HA H 84 4.490 4.660 -0.170 1
1 1069 . 2 1 1 A 84 84 VAL C C 84 174.700 175.996 -1.296 1
1 1070 . 2 1 1 A 84 84 VAL CA C 84 61.300 61.245 0.055 1
1 1071 . 2 1 1 A 84 84 VAL CB C 84 33.000 32.015 0.985 1
1 1074 . 2 1 1 A 84 84 VAL N N 84 128.300 126.908 1.392 1
1 1075 . 2 1 1 A 85 85 GLY H H 85 7.970 8.832 -0.862 1
1 1076 . 2 1 1 A 85 85 GLY HA2 H 85 4.030 4.341 -0.311 1
1 1077 . 2 1 1 A 85 85 GLY HA3 H 85 4.840 4.475 0.365 1
1 1078 . 2 1 1 A 85 85 GLY C C 85 175.800 175.102 0.698 1
1 1079 . 2 1 1 A 85 85 GLY CA C 85 44.800 44.352 0.448 1
1 1080 . 2 1 1 A 85 85 GLY N N 85 114.300 115.331 -1.031 1
1 1081 . 2 1 1 A 86 86 ASP H H 86 8.860 8.786 0.074 1
1 1082 . 2 1 1 A 86 86 ASP HA H 86 4.370 4.381 -0.011 1
1 1085 . 2 1 1 A 86 86 ASP C C 86 177.400 177.355 0.045 1
1 1086 . 2 1 1 A 86 86 ASP CA C 86 57.400 56.206 1.194 1
1 1087 . 2 1 1 A 86 86 ASP CB C 86 40.600 40.379 0.221 1
1 1088 . 2 1 1 A 86 86 ASP N N 86 122.500 119.593 2.907 1
1 1089 . 2 1 1 A 87 87 SER H H 87 8.540 7.730 0.810 1
1 1090 . 2 1 1 A 87 87 SER HA H 87 4.620 4.429 0.191 1
1 1093 . 2 1 1 A 87 87 SER C C 87 174.700 174.471 0.229 1
1 1094 . 2 1 1 A 87 87 SER CA C 87 58.200 58.724 -0.524 1
1 1095 . 2 1 1 A 87 87 SER CB C 87 63.300 63.864 -0.564 1
1 1096 . 2 1 1 A 87 87 SER N N 87 112.100 111.375 0.725 1
1 1097 . 2 1 1 A 88 88 SER H H 88 7.880 7.456 0.424 1
1 1098 . 2 1 1 A 88 88 SER HA H 88 5.050 4.483 0.567 1
1 1101 . 2 1 1 A 88 88 SER C C 88 172.700 173.744 -1.044 1
1 1102 . 2 1 1 A 88 88 SER CA C 88 57.600 57.901 -0.301 1
1 1103 . 2 1 1 A 88 88 SER CB C 88 64.300 64.381 -0.081 1
1 1104 . 2 1 1 A 88 88 SER N N 88 119.200 118.228 0.972 1
1 1105 . 2 1 1 A 89 89 ARG H H 89 8.350 8.314 0.036 1
1 1106 . 2 1 1 A 89 89 ARG HA H 89 4.720 5.265 -0.545 1
1 1114 . 2 1 1 A 89 89 ARG C C 89 174.200 174.878 -0.678 1
1 1115 . 2 1 1 A 89 89 ARG CA C 89 55.000 54.503 0.497 1
1 1116 . 2 1 1 A 89 89 ARG CB C 89 33.500 34.026 -0.526 1
1 1120 . 2 1 1 A 89 89 ARG N N 89 122.800 122.807 -0.007 1
1 1122 . 2 1 1 A 90 90 ILE H H 90 8.530 9.045 -0.515 1
1 1123 . 2 1 1 A 90 90 ILE HA H 90 4.790 5.141 -0.351 1
1 1133 . 2 1 1 A 90 90 ILE C C 90 175.400 175.035 0.365 1
1 1134 . 2 1 1 A 90 90 ILE CA C 90 60.600 60.168 0.432 1
1 1135 . 2 1 1 A 90 90 ILE CB C 90 40.600 40.874 -0.274 1
1 1139 . 2 1 1 A 90 90 ILE N N 90 123.100 123.359 -0.259 1
1 1140 . 2 1 1 A 91 91 GLU H H 91 9.000 9.119 -0.119 1
1 1141 . 2 1 1 A 91 91 GLU HA H 91 4.730 4.864 -0.134 1
1 1146 . 2 1 1 A 91 91 GLU C C 91 175.100 176.623 -1.523 1
1 1147 . 2 1 1 A 91 91 GLU CA C 91 54.300 54.570 -0.270 1
1 1148 . 2 1 1 A 91 91 GLU CB C 91 32.400 32.931 -0.531 1
1 1150 . 2 1 1 A 91 91 GLU N N 91 126.400 127.390 -0.990 1
1 1151 . 2 1 1 A 92 92 SER H H 92 8.830 8.800 0.030 1
1 1152 . 2 1 1 A 92 92 SER HA H 92 4.700 4.560 0.140 1
1 1155 . 2 1 1 A 92 92 SER C C 92 174.600 174.452 0.148 1
1 1156 . 2 1 1 A 92 92 SER CA C 92 59.300 58.342 0.958 1
1 1157 . 2 1 1 A 92 92 SER CB C 92 63.100 63.943 -0.843 1
1 1158 . 2 1 1 A 92 92 SER N N 92 119.800 119.803 -0.003 1
1 1159 . 2 1 1 A 93 93 VAL H H 93 8.350 8.361 -0.011 1
1 1160 . 2 1 1 A 93 93 VAL HA H 93 4.290 4.819 -0.529 1
1 1168 . 2 1 1 A 93 93 VAL C C 93 175.100 175.282 -0.182 1
1 1169 . 2 1 1 A 93 93 VAL CA C 93 61.300 61.157 0.143 1
1 1170 . 2 1 1 A 93 93 VAL CB C 93 33.900 34.269 -0.369 1
1 1173 . 2 1 1 A 93 93 VAL N N 93 121.800 123.257 -1.457 1
1 1174 . 2 1 1 A 94 94 ASN H H 94 8.510 9.091 -0.581 1
1 1175 . 2 1 1 A 94 94 ASN HA H 94 4.770 4.977 -0.207 1
1 1180 . 2 1 1 A 94 94 ASN C C 94 175.000 174.956 0.044 1
1 1181 . 2 1 1 A 94 94 ASN CA C 94 52.700 54.003 -1.303 1
1 1182 . 2 1 1 A 94 94 ASN CB C 94 38.500 40.692 -2.192 1
1 1184 . 2 1 1 A 94 94 ASN N N 94 121.800 125.183 -3.383 1
1 1186 . 2 1 1 A 95 95 VAL H H 95 7.860 7.685 0.175 1
1 1187 . 2 1 1 A 95 95 VAL HA H 95 4.100 4.630 -0.530 1
1 1195 . 2 1 1 A 95 95 VAL C C 95 175.100 174.355 0.745 1
1 1196 . 2 1 1 A 95 95 VAL CA C 95 61.700 60.382 1.318 1
1 1197 . 2 1 1 A 95 95 VAL CB C 95 33.100 34.241 -1.141 1
1 1200 . 2 1 1 A 95 95 VAL N N 95 119.700 113.176 6.524 1
1 1201 . 2 1 1 A 96 96 ASN H H 96 8.490 9.181 -0.691 1
1 1202 . 2 1 1 A 96 96 ASN HA H 96 4.700 4.921 -0.221 1
1 1207 . 2 1 1 A 96 96 ASN C C 96 174.600 174.648 -0.048 1
1 1208 . 2 1 1 A 96 96 ASN CA C 96 53.000 53.247 -0.247 1
1 1209 . 2 1 1 A 96 96 ASN CB C 96 39.000 39.541 -0.541 1
1 1211 . 2 1 1 A 96 96 ASN N N 96 122.200 125.906 -3.706 1
1 1213 . 2 1 1 A 97 97 ILE H H 97 8.080 8.653 -0.573 1
1 1214 . 2 1 1 A 97 97 ILE HA H 97 4.370 4.755 -0.385 1
1 1224 . 2 1 1 A 97 97 ILE CA C 97 58.600 58.272 0.328 1
1 1225 . 2 1 1 A 97 97 ILE CB C 97 38.600 39.386 -0.786 1
1 1229 . 2 1 1 A 97 97 ILE N N 97 123.500 126.241 -2.741 1
1 1230 . 2 1 1 A 98 98 PRO HA H 98 4.360 4.383 -0.023 1
1 1237 . 2 1 1 A 98 98 PRO C C 98 176.600 177.321 -0.721 1
1 1238 . 2 1 1 A 98 98 PRO CA C 98 63.100 63.728 -0.628 1
1 1239 . 2 1 1 A 98 98 PRO CB C 98 31.800 32.062 -0.262 1
1 1242 . 2 1 1 A 99 99 LEU H H 99 8.200 8.858 -0.658 1
1 1243 . 2 1 1 A 99 99 LEU HA H 99 4.200 3.840 0.360 1
1 1253 . 2 1 1 A 99 99 LEU C C 99 177.300 175.716 1.584 1
1 1254 . 2 1 1 A 99 99 LEU CA C 99 55.000 55.675 -0.675 1
1 1255 . 2 1 1 A 99 99 LEU CB C 99 42.400 40.653 1.747 1
1 1259 . 2 1 1 A 99 99 LEU N N 99 122.500 123.065 -0.565 1
1 1260 . 2 1 1 A 100 100 GLU H H 100 8.250 7.824 0.426 1
1 1261 . 2 1 1 A 100 100 GLU HA H 100 4.140 4.280 -0.140 1
1 1266 . 2 1 1 A 100 100 GLU C C 100 176.100 175.361 0.739 1
1 1267 . 2 1 1 A 100 100 GLU CA C 100 56.100 55.530 0.570 1
1 1268 . 2 1 1 A 100 100 GLU CB C 100 29.900 30.021 -0.121 1
1 1270 . 2 1 1 A 100 100 GLU N N 100 121.000 125.685 -4.685 1
1 1271 . 2 1 1 A 101 101 HIS H H 101 8.540 8.268 0.272 1
1 1272 . 2 1 1 A 101 101 HIS HA H 101 4.600 4.402 0.198 1
1 1275 . 2 1 1 A 101 101 HIS C C 101 174.200 174.631 -0.431 1
1 1276 . 2 1 1 A 101 101 HIS CA C 101 55.200 56.772 -1.572 1
1 1277 . 2 1 1 A 101 101 HIS CB C 101 29.000 28.620 0.380 1
1 1278 . 2 1 1 A 101 101 HIS N N 101 119.400 124.616 -5.216 1
1 1279 . 2 1 1 A 102 102 HIS H H 102 8.660 8.778 -0.118 1
1 1280 . 2 1 1 A 102 102 HIS HA H 102 4.630 5.066 -0.436 1
1 1283 . 2 1 1 A 102 102 HIS C C 102 174.200 175.014 -0.814 1
1 1284 . 2 1 1 A 102 102 HIS CA C 102 55.200 54.312 0.888 1
1 1285 . 2 1 1 A 102 102 HIS CB C 102 29.100 31.631 -2.531 1
1 1286 . 2 1 1 A 102 102 HIS N N 102 119.700 119.467 0.233 1
1 1287 . 2 1 1 A 103 103 HIS H H 103 8.680 9.192 -0.512 1
1 1288 . 2 1 1 A 103 103 HIS HA H 103 4.640 4.286 0.354 1
1 1291 . 2 1 1 A 103 103 HIS C C 103 174.200 175.872 -1.672 1
1 1292 . 2 1 1 A 103 103 HIS CA C 103 55.200 58.920 -3.720 1
1 1293 . 2 1 1 A 103 103 HIS CB C 103 29.200 29.423 -0.223 1
1 1294 . 2 1 1 A 103 103 HIS N N 103 120.500 117.742 2.758 1
1 1295 . 2 1 1 A 104 104 HIS H H 104 8.580 6.582 1.998 1
1 1296 . 2 1 1 A 104 104 HIS HA H 104 4.590 3.411 1.179 1
1 1299 . 2 1 1 A 104 104 HIS C C 104 174.200 173.761 0.439 1
1 1300 . 2 1 1 A 104 104 HIS CA C 104 55.200 56.433 -1.233 1
1 1301 . 2 1 1 A 104 104 HIS CB C 104 29.300 28.500 0.800 1
1 1302 . 2 1 1 A 104 104 HIS N N 104 120.700 118.721 1.979 1
1 1303 . 2 1 1 A 105 105 HIS H H 105 8.550 7.889 0.661 1
1 1304 . 2 1 1 A 105 105 HIS HA H 105 4.610 4.543 0.067 1
1 1307 . 2 1 1 A 105 105 HIS C C 105 173.500 175.214 -1.714 1
1 1308 . 2 1 1 A 105 105 HIS CA C 105 55.400 55.833 -0.433 1
1 1309 . 2 1 1 A 105 105 HIS CB C 105 28.800 31.306 -2.506 1
1 1310 . 2 1 1 A 105 105 HIS N N 105 119.000 119.325 -0.325 1
1 7 . 3 1 1 A 2 2 ASP H H 2 8.890 7.890 1.000 1
1 8 . 3 1 1 A 2 2 ASP HA H 2 4.740 4.668 0.072 1
1 11 . 3 1 1 A 2 2 ASP C C 2 174.600 175.344 -0.744 1
1 12 . 3 1 1 A 2 2 ASP CA C 2 53.800 54.129 -0.329 1
1 13 . 3 1 1 A 2 2 ASP CB C 2 41.500 41.641 -0.141 1
1 14 . 3 1 1 A 2 2 ASP N N 2 122.100 122.684 -0.584 1
1 15 . 3 1 1 A 3 3 LEU H H 3 8.280 8.380 -0.100 1
1 16 . 3 1 1 A 3 3 LEU HA H 3 4.420 4.657 -0.237 1
1 26 . 3 1 1 A 3 3 LEU C C 3 176.900 175.997 0.903 1
1 27 . 3 1 1 A 3 3 LEU CA C 3 55.000 55.691 -0.691 1
1 28 . 3 1 1 A 3 3 LEU CB C 3 42.700 42.492 0.208 1
1 32 . 3 1 1 A 3 3 LEU N N 3 122.300 126.166 -3.866 1
1 33 . 3 1 1 A 4 4 VAL H H 4 8.640 8.622 0.018 1
1 34 . 3 1 1 A 4 4 VAL HA H 4 4.540 4.936 -0.396 1
1 42 . 3 1 1 A 4 4 VAL C C 4 175.800 175.083 0.717 1
1 43 . 3 1 1 A 4 4 VAL CA C 4 59.400 58.635 0.765 1
1 44 . 3 1 1 A 4 4 VAL CB C 4 35.400 35.732 -0.332 1
1 47 . 3 1 1 A 4 4 VAL N N 4 122.600 119.139 3.461 1
1 48 . 3 1 1 A 5 5 LYS H H 5 8.630 8.666 -0.036 1
1 49 . 3 1 1 A 5 5 LYS HA H 5 4.450 4.407 0.043 1
1 58 . 3 1 1 A 5 5 LYS C C 5 179.400 178.479 0.921 1
1 59 . 3 1 1 A 5 5 LYS CA C 5 53.600 55.855 -2.255 1
1 60 . 3 1 1 A 5 5 LYS CB C 5 30.900 33.257 -2.357 1
1 64 . 3 1 1 A 5 5 LYS N N 5 121.100 121.780 -0.680 1
1 65 . 3 1 1 A 6 6 ILE H H 6 10.320 8.903 1.417 1
1 66 . 3 1 1 A 6 6 ILE HA H 6 3.440 3.720 -0.280 1
1 76 . 3 1 1 A 6 6 ILE C C 6 178.300 177.788 0.512 1
1 77 . 3 1 1 A 6 6 ILE CA C 6 65.700 64.910 0.790 1
1 78 . 3 1 1 A 6 6 ILE CB C 6 35.900 37.679 -1.779 1
1 82 . 3 1 1 A 6 6 ILE N N 6 125.400 122.387 3.013 1
1 83 . 3 1 1 A 7 7 ARG H H 7 8.210 8.550 -0.340 1
1 84 . 3 1 1 A 7 7 ARG HA H 7 3.850 4.226 -0.376 1
1 92 . 3 1 1 A 7 7 ARG C C 7 175.600 176.772 -1.172 1
1 93 . 3 1 1 A 7 7 ARG CA C 7 57.800 57.680 0.120 1
1 94 . 3 1 1 A 7 7 ARG CB C 7 30.300 28.946 1.354 1
1 98 . 3 1 1 A 7 7 ARG N N 7 118.800 120.875 -2.075 1
1 100 . 3 1 1 A 8 8 ASP H H 8 7.850 7.848 0.002 1
1 101 . 3 1 1 A 8 8 ASP HA H 8 4.700 4.761 -0.061 1
1 104 . 3 1 1 A 8 8 ASP C C 8 176.100 176.399 -0.299 1
1 105 . 3 1 1 A 8 8 ASP CA C 8 54.100 54.265 -0.165 1
1 106 . 3 1 1 A 8 8 ASP CB C 8 41.200 41.571 -0.371 1
1 107 . 3 1 1 A 8 8 ASP N N 8 116.800 118.482 -1.682 1
1 108 . 3 1 1 A 9 9 VAL H H 9 7.240 7.154 0.086 1
1 109 . 3 1 1 A 9 9 VAL HA H 9 3.710 3.971 -0.261 1
1 117 . 3 1 1 A 9 9 VAL C C 9 174.900 175.579 -0.679 1
1 118 . 3 1 1 A 9 9 VAL CA C 9 64.300 63.264 1.036 1
1 119 . 3 1 1 A 9 9 VAL CB C 9 31.500 31.633 -0.133 1
1 122 . 3 1 1 A 9 9 VAL N N 9 121.800 122.384 -0.584 1
1 123 . 3 1 1 A 10 10 SER H H 10 8.600 8.476 0.124 1
1 124 . 3 1 1 A 10 10 SER HA H 10 4.600 4.673 -0.073 1
1 127 . 3 1 1 A 10 10 SER CA C 10 56.700 57.146 -0.446 1
1 128 . 3 1 1 A 10 10 SER CB C 10 66.100 65.561 0.539 1
1 129 . 3 1 1 A 10 10 SER N N 10 122.200 120.788 1.412 1
1 130 . 3 1 1 A 11 11 LEU H H 11 8.660 9.008 -0.348 1
1 131 . 3 1 1 A 11 11 LEU HA H 11 3.900 4.085 -0.185 1
1 141 . 3 1 1 A 11 11 LEU C C 11 178.100 178.760 -0.660 1
1 142 . 3 1 1 A 11 11 LEU CA C 11 56.700 57.033 -0.333 1
1 143 . 3 1 1 A 11 11 LEU CB C 11 41.400 41.588 -0.188 1
1 147 . 3 1 1 A 11 11 LEU N N 11 120.300 123.065 -2.765 1
1 148 . 3 1 1 A 12 12 SER H H 12 8.160 8.107 0.053 1
1 149 . 3 1 1 A 12 12 SER HA H 12 4.270 4.358 -0.088 1
1 152 . 3 1 1 A 12 12 SER C C 12 174.200 175.158 -0.958 1
1 153 . 3 1 1 A 12 12 SER CA C 12 59.900 61.976 -2.076 1
1 154 . 3 1 1 A 12 12 SER CB C 12 63.100 63.084 0.016 1
1 155 . 3 1 1 A 12 12 SER N N 12 112.100 114.327 -2.227 1
1 156 . 3 1 1 A 13 13 THR H H 13 7.460 7.473 -0.013 1
1 157 . 3 1 1 A 13 13 THR HA H 13 4.760 4.715 0.045 1
1 162 . 3 1 1 A 13 13 THR CA C 13 56.600 59.004 -2.404 1
1 163 . 3 1 1 A 13 13 THR CB C 13 70.100 68.999 1.101 1
1 165 . 3 1 1 A 13 13 THR N N 13 114.700 110.325 4.375 1
1 166 . 3 1 1 A 14 14 PRO HA H 14 4.050 4.267 -0.217 1
1 173 . 3 1 1 A 14 14 PRO C C 14 175.800 175.919 -0.119 1
1 174 . 3 1 1 A 14 14 PRO CA C 14 65.100 64.755 0.345 1
1 175 . 3 1 1 A 14 14 PRO CB C 14 32.100 31.392 0.708 1
1 178 . 3 1 1 A 15 15 TYR H H 15 7.380 7.697 -0.317 1
1 179 . 3 1 1 A 15 15 TYR HA H 15 5.570 5.580 -0.010 1
1 186 . 3 1 1 A 15 15 TYR C C 15 176.100 175.136 0.964 1
1 187 . 3 1 1 A 15 15 TYR CA C 15 56.400 56.858 -0.458 1
1 188 . 3 1 1 A 15 15 TYR CB C 15 41.500 41.107 0.393 1
1 193 . 3 1 1 A 15 15 TYR N N 15 113.800 117.278 -3.478 1
1 194 . 3 1 1 A 16 16 VAL H H 16 9.010 8.769 0.241 1
1 195 . 3 1 1 A 16 16 VAL HA H 16 4.920 5.043 -0.123 1
1 203 . 3 1 1 A 16 16 VAL C C 16 174.300 174.272 0.028 1
1 204 . 3 1 1 A 16 16 VAL CA C 16 59.600 59.398 0.202 1
1 205 . 3 1 1 A 16 16 VAL CB C 16 36.800 36.216 0.584 1
1 208 . 3 1 1 A 16 16 VAL N N 16 113.800 117.902 -4.102 1
1 209 . 3 1 1 A 17 17 SER H H 17 7.960 8.299 -0.339 1
1 210 . 3 1 1 A 17 17 SER HA H 17 5.860 5.735 0.125 1
1 213 . 3 1 1 A 17 17 SER C C 17 172.700 173.642 -0.942 1
1 214 . 3 1 1 A 17 17 SER CA C 17 57.300 56.966 0.334 1
1 215 . 3 1 1 A 17 17 SER CB C 17 64.000 65.925 -1.925 1
1 216 . 3 1 1 A 17 17 SER N N 17 117.100 116.558 0.542 1
1 217 . 3 1 1 A 18 18 VAL H H 18 8.570 9.036 -0.466 1
1 218 . 3 1 1 A 18 18 VAL HA H 18 4.900 5.112 -0.212 1
1 226 . 3 1 1 A 18 18 VAL C C 18 173.700 173.606 0.094 1
1 227 . 3 1 1 A 18 18 VAL CA C 18 58.800 59.231 -0.431 1
1 228 . 3 1 1 A 18 18 VAL CB C 18 36.700 36.147 0.553 1
1 231 . 3 1 1 A 18 18 VAL N N 18 113.500 118.274 -4.774 1
1 232 . 3 1 1 A 19 19 ILE H H 19 8.490 8.615 -0.125 1
1 233 . 3 1 1 A 19 19 ILE HA H 19 5.300 4.856 0.444 1
1 243 . 3 1 1 A 19 19 ILE C C 19 175.800 174.762 1.038 1
1 244 . 3 1 1 A 19 19 ILE CA C 19 59.700 59.694 0.006 1
1 245 . 3 1 1 A 19 19 ILE CB C 19 41.700 42.207 -0.507 1
1 249 . 3 1 1 A 19 19 ILE N N 19 120.600 122.611 -2.011 1
1 250 . 3 1 1 A 20 20 GLY H H 20 8.670 7.805 0.865 1
1 251 . 3 1 1 A 20 20 GLY HA2 H 20 3.760 4.144 -0.384 1
1 252 . 3 1 1 A 20 20 GLY HA3 H 20 4.190 4.147 0.043 1
1 253 . 3 1 1 A 20 20 GLY C C 20 169.900 172.418 -2.518 1
1 254 . 3 1 1 A 20 20 GLY CA C 20 46.000 45.899 0.101 1
1 255 . 3 1 1 A 20 20 GLY N N 20 110.200 114.412 -4.212 1
1 256 . 3 1 1 A 21 21 LYS H H 21 8.920 8.446 0.474 1
1 257 . 3 1 1 A 21 21 LYS HA H 21 5.210 5.164 0.046 1
1 266 . 3 1 1 A 21 21 LYS C C 21 176.400 175.185 1.215 1
1 267 . 3 1 1 A 21 21 LYS CA C 21 54.400 54.794 -0.394 1
1 268 . 3 1 1 A 21 21 LYS CB C 21 35.400 35.333 0.067 1
1 272 . 3 1 1 A 21 21 LYS N N 21 119.100 116.775 2.325 1
1 273 . 3 1 1 A 22 22 ILE H H 22 8.900 8.157 0.743 1
1 274 . 3 1 1 A 22 22 ILE HA H 22 5.050 4.878 0.172 1
1 284 . 3 1 1 A 22 22 ILE C C 22 176.900 175.256 1.644 1
1 285 . 3 1 1 A 22 22 ILE CA C 22 57.800 60.486 -2.686 1
1 286 . 3 1 1 A 22 22 ILE CB C 22 36.200 39.338 -3.138 1
1 290 . 3 1 1 A 22 22 ILE N N 22 130.000 124.226 5.774 1
1 291 . 3 1 1 A 23 23 THR H H 23 9.020 8.825 0.195 1
1 292 . 3 1 1 A 23 23 THR HA H 23 4.660 4.757 -0.097 1
1 297 . 3 1 1 A 23 23 THR C C 23 174.000 173.903 0.097 1
1 298 . 3 1 1 A 23 23 THR CA C 23 60.800 59.733 1.067 1
1 299 . 3 1 1 A 23 23 THR CB C 23 73.400 71.892 1.508 1
1 301 . 3 1 1 A 23 23 THR N N 23 118.200 120.541 -2.341 1
1 302 . 3 1 1 A 24 24 GLY H H 24 8.430 8.654 -0.224 1
1 303 . 3 1 1 A 24 24 GLY HA2 H 24 3.910 3.828 0.082 1
1 304 . 3 1 1 A 24 24 GLY HA3 H 24 3.910 4.013 -0.103 1
1 305 . 3 1 1 A 24 24 GLY C C 24 175.400 174.919 0.481 1
1 306 . 3 1 1 A 24 24 GLY CA C 24 47.100 47.007 0.093 1
1 307 . 3 1 1 A 24 24 GLY N N 24 107.200 114.495 -7.295 1
1 308 . 3 1 1 A 25 25 ILE H H 25 9.370 8.156 1.214 1
1 309 . 3 1 1 A 25 25 ILE HA H 25 4.480 4.014 0.466 1
1 319 . 3 1 1 A 25 25 ILE C C 25 178.200 175.521 2.679 1
1 320 . 3 1 1 A 25 25 ILE CA C 25 59.200 61.197 -1.997 1
1 321 . 3 1 1 A 25 25 ILE CB C 25 35.400 37.827 -2.427 1
1 325 . 3 1 1 A 25 25 ILE N N 25 120.600 120.292 0.308 1
1 326 . 3 1 1 A 26 26 HIS H H 26 9.000 9.141 -0.141 1
1 327 . 3 1 1 A 26 26 HIS HA H 26 4.770 5.139 -0.369 1
1 330 . 3 1 1 A 26 26 HIS C C 26 172.700 173.830 -1.130 1
1 331 . 3 1 1 A 26 26 HIS CA C 26 55.000 54.413 0.587 1
1 332 . 3 1 1 A 26 26 HIS CB C 26 31.100 32.641 -1.541 1
1 333 . 3 1 1 A 26 26 HIS N N 26 123.800 125.438 -1.638 1
1 334 . 3 1 1 A 27 27 LYS H H 27 8.930 8.957 -0.027 1
1 335 . 3 1 1 A 27 27 LYS HA H 27 4.770 4.330 0.440 1
1 344 . 3 1 1 A 27 27 LYS C C 27 175.300 175.379 -0.079 1
1 345 . 3 1 1 A 27 27 LYS CA C 27 55.100 56.073 -0.973 1
1 346 . 3 1 1 A 27 27 LYS CB C 27 34.400 33.418 0.982 1
1 350 . 3 1 1 A 27 27 LYS N N 27 125.900 124.939 0.961 1
1 351 . 3 1 1 A 28 28 LYS H H 28 8.880 8.223 0.657 1
1 352 . 3 1 1 A 28 28 LYS HA H 28 4.570 4.919 -0.349 1
1 361 . 3 1 1 A 28 28 LYS C C 28 174.500 173.970 0.530 1
1 362 . 3 1 1 A 28 28 LYS CA C 28 54.600 55.174 -0.574 1
1 363 . 3 1 1 A 28 28 LYS CB C 28 35.300 36.015 -0.715 1
1 367 . 3 1 1 A 28 28 LYS N N 28 127.400 126.573 0.827 1
1 368 . 3 1 1 A 29 29 GLU H H 29 8.440 8.669 -0.229 1
1 369 . 3 1 1 A 29 29 GLU HA H 29 5.260 5.443 -0.183 1
1 374 . 3 1 1 A 29 29 GLU C C 29 175.800 175.598 0.202 1
1 375 . 3 1 1 A 29 29 GLU CA C 29 54.800 54.807 -0.007 1
1 376 . 3 1 1 A 29 29 GLU CB C 29 31.500 33.046 -1.546 1
1 378 . 3 1 1 A 29 29 GLU N N 29 122.200 125.366 -3.166 1
1 379 . 3 1 1 A 30 30 TYR H H 30 8.960 8.728 0.232 1
1 380 . 3 1 1 A 30 30 TYR HA H 30 4.820 5.232 -0.412 1
1 387 . 3 1 1 A 30 30 TYR C C 30 172.600 172.394 0.206 1
1 388 . 3 1 1 A 30 30 TYR CA C 30 56.300 55.715 0.585 1
1 389 . 3 1 1 A 30 30 TYR CB C 30 40.500 41.298 -0.798 1
1 394 . 3 1 1 A 30 30 TYR N N 30 121.100 118.677 2.423 1
1 395 . 3 1 1 A 31 31 GLU H H 31 8.610 8.655 -0.045 1
1 396 . 3 1 1 A 31 31 GLU HA H 31 4.810 4.499 0.311 1
1 401 . 3 1 1 A 31 31 GLU C C 31 176.100 174.946 1.154 1
1 402 . 3 1 1 A 31 31 GLU CA C 31 55.100 56.058 -0.958 1
1 403 . 3 1 1 A 31 31 GLU CB C 31 30.300 30.488 -0.188 1
1 405 . 3 1 1 A 31 31 GLU N N 31 121.800 121.343 0.457 1
1 406 . 3 1 1 A 32 32 SER H H 32 8.570 9.018 -0.448 1
1 407 . 3 1 1 A 32 32 SER HA H 32 4.520 4.908 -0.388 1
1 410 . 3 1 1 A 32 32 SER C C 32 174.300 173.866 0.434 1
1 411 . 3 1 1 A 32 32 SER CA C 32 57.300 57.336 -0.036 1
1 412 . 3 1 1 A 32 32 SER CB C 32 64.100 64.741 -0.641 1
1 413 . 3 1 1 A 32 32 SER N N 32 118.500 123.537 -5.037 1
1 414 . 3 1 1 A 33 33 ASP H H 33 9.290 9.508 -0.218 1
1 415 . 3 1 1 A 33 33 ASP HA H 33 4.340 4.356 -0.016 1
1 418 . 3 1 1 A 33 33 ASP C C 33 175.900 176.303 -0.403 1
1 419 . 3 1 1 A 33 33 ASP CA C 33 55.000 55.372 -0.372 1
1 420 . 3 1 1 A 33 33 ASP CB C 33 39.300 39.547 -0.247 1
1 421 . 3 1 1 A 33 33 ASP N N 33 125.700 127.532 -1.832 1
1 422 . 3 1 1 A 34 34 GLY H H 34 8.690 8.591 0.099 1
1 423 . 3 1 1 A 34 34 GLY HA2 H 34 3.660 3.780 -0.120 1
1 424 . 3 1 1 A 34 34 GLY HA3 H 34 4.140 3.781 0.359 1
1 425 . 3 1 1 A 34 34 GLY C C 34 174.200 173.734 0.466 1
1 426 . 3 1 1 A 34 34 GLY CA C 34 45.600 45.440 0.160 1
1 427 . 3 1 1 A 34 34 GLY N N 34 104.800 104.887 -0.087 1
1 428 . 3 1 1 A 35 35 THR H H 35 7.840 8.079 -0.239 1
1 429 . 3 1 1 A 35 35 THR HA H 35 4.660 4.532 0.128 1
1 434 . 3 1 1 A 35 35 THR C C 35 173.000 173.252 -0.252 1
1 435 . 3 1 1 A 35 35 THR CA C 35 60.200 61.326 -1.126 1
1 436 . 3 1 1 A 35 35 THR CB C 35 71.200 71.174 0.026 1
1 438 . 3 1 1 A 35 35 THR N N 35 114.800 116.646 -1.846 1
1 439 . 3 1 1 A 36 36 THR H H 36 8.480 8.683 -0.203 1
1 440 . 3 1 1 A 36 36 THR HA H 36 4.620 4.437 0.183 1
1 445 . 3 1 1 A 36 36 THR C C 36 173.800 174.269 -0.469 1
1 446 . 3 1 1 A 36 36 THR CA C 36 62.300 63.081 -0.781 1
1 447 . 3 1 1 A 36 36 THR CB C 36 69.500 69.227 0.273 1
1 449 . 3 1 1 A 36 36 THR N N 36 119.400 120.912 -1.512 1
1 450 . 3 1 1 A 37 37 LYS H H 37 8.880 8.618 0.262 1
1 451 . 3 1 1 A 37 37 LYS HA H 37 4.570 4.914 -0.344 1
1 460 . 3 1 1 A 37 37 LYS C C 37 174.500 174.500 0.000 1
1 461 . 3 1 1 A 37 37 LYS CA C 37 54.600 54.224 0.376 1
1 462 . 3 1 1 A 37 37 LYS CB C 37 35.500 35.746 -0.246 1
1 466 . 3 1 1 A 37 37 LYS N N 37 128.000 125.437 2.563 1
1 467 . 3 1 1 A 38 38 SER H H 38 8.370 8.778 -0.408 1
1 468 . 3 1 1 A 38 38 SER HA H 38 5.250 5.100 0.150 1
1 471 . 3 1 1 A 38 38 SER C C 38 173.200 173.085 0.115 1
1 472 . 3 1 1 A 38 38 SER CA C 38 57.900 57.222 0.678 1
1 473 . 3 1 1 A 38 38 SER CB C 38 65.500 64.155 1.345 1
1 474 . 3 1 1 A 38 38 SER N N 38 114.300 117.956 -3.656 1
1 475 . 3 1 1 A 39 39 VAL H H 39 9.020 8.782 0.238 1
1 476 . 3 1 1 A 39 39 VAL HA H 39 4.900 4.963 -0.063 1
1 484 . 3 1 1 A 39 39 VAL C C 39 173.200 172.810 0.390 1
1 485 . 3 1 1 A 39 39 VAL CA C 39 59.200 59.459 -0.259 1
1 486 . 3 1 1 A 39 39 VAL CB C 39 34.600 35.087 -0.487 1
1 489 . 3 1 1 A 39 39 VAL N N 39 123.600 124.626 -1.026 1
1 490 . 3 1 1 A 40 40 TYR H H 40 8.900 8.760 0.140 1
1 491 . 3 1 1 A 40 40 TYR HA H 40 4.730 5.275 -0.545 1
1 498 . 3 1 1 A 40 40 TYR CA C 40 56.500 56.743 -0.243 1
1 499 . 3 1 1 A 40 40 TYR CB C 40 39.000 40.752 -1.752 1
1 504 . 3 1 1 A 40 40 TYR N N 40 126.300 127.472 -1.172 1
1 505 . 3 1 1 A 41 41 GLN H H 41 8.630 8.786 -0.156 1
1 506 . 3 1 1 A 41 41 GLN HA H 41 5.330 5.318 0.012 1
1 513 . 3 1 1 A 41 41 GLN C C 41 175.500 175.651 -0.151 1
1 514 . 3 1 1 A 41 41 GLN CA C 41 53.800 54.089 -0.289 1
1 515 . 3 1 1 A 41 41 GLN CB C 41 32.100 31.955 0.145 1
1 518 . 3 1 1 A 41 41 GLN N N 41 122.000 121.657 0.343 1
1 520 . 3 1 1 A 42 42 GLY H H 42 8.560 7.853 0.707 1
1 521 . 3 1 1 A 42 42 GLY HA2 H 42 3.680 4.382 -0.702 1
1 522 . 3 1 1 A 42 42 GLY HA3 H 42 4.020 4.447 -0.427 1
1 523 . 3 1 1 A 42 42 GLY C C 42 171.600 171.042 0.558 1
1 524 . 3 1 1 A 42 42 GLY CA C 42 47.300 46.237 1.063 1
1 525 . 3 1 1 A 42 42 GLY N N 42 113.000 108.955 4.045 1
1 526 . 3 1 1 A 43 43 TYR H H 43 9.320 8.772 0.548 1
1 527 . 3 1 1 A 43 43 TYR HA H 43 5.280 5.609 -0.329 1
1 534 . 3 1 1 A 43 43 TYR C C 43 173.200 174.031 -0.831 1
1 535 . 3 1 1 A 43 43 TYR CA C 43 57.600 56.401 1.199 1
1 536 . 3 1 1 A 43 43 TYR CB C 43 42.400 43.059 -0.659 1
1 541 . 3 1 1 A 43 43 TYR N N 43 126.300 119.252 7.048 1
1 542 . 3 1 1 A 44 44 ILE H H 44 9.160 9.214 -0.054 1
1 543 . 3 1 1 A 44 44 ILE HA H 44 5.270 5.400 -0.130 1
1 553 . 3 1 1 A 44 44 ILE C C 44 172.900 173.692 -0.792 1
1 554 . 3 1 1 A 44 44 ILE CA C 44 59.000 59.310 -0.310 1
1 555 . 3 1 1 A 44 44 ILE CB C 44 42.200 41.240 0.960 1
1 559 . 3 1 1 A 44 44 ILE N N 44 117.700 123.648 -5.948 1
1 560 . 3 1 1 A 45 45 GLU H H 45 8.420 8.636 -0.216 1
1 561 . 3 1 1 A 45 45 GLU HA H 45 5.600 5.497 0.103 1
1 566 . 3 1 1 A 45 45 GLU C C 45 174.300 174.327 -0.027 1
1 567 . 3 1 1 A 45 45 GLU CA C 45 54.000 54.724 -0.724 1
1 568 . 3 1 1 A 45 45 GLU CB C 45 34.400 33.677 0.723 1
1 570 . 3 1 1 A 45 45 GLU N N 45 123.600 128.996 -5.396 1
1 571 . 3 1 1 A 46 46 ASP H H 46 8.530 8.512 0.018 1
1 572 . 3 1 1 A 46 46 ASP HA H 46 5.070 4.833 0.237 1
1 575 . 3 1 1 A 46 46 ASP C C 46 175.000 175.620 -0.620 1
1 576 . 3 1 1 A 46 46 ASP CA C 46 51.800 53.696 -1.896 1
1 577 . 3 1 1 A 46 46 ASP CB C 46 41.300 42.015 -0.715 1
1 578 . 3 1 1 A 46 46 ASP N N 46 125.500 124.722 0.778 1
1 579 . 3 1 1 A 47 47 ASP H H 47 9.160 9.303 -0.143 1
1 580 . 3 1 1 A 47 47 ASP HA H 47 4.430 4.488 -0.058 1
1 583 . 3 1 1 A 47 47 ASP C C 47 176.000 177.619 -1.619 1
1 584 . 3 1 1 A 47 47 ASP CA C 47 55.000 57.124 -2.124 1
1 585 . 3 1 1 A 47 47 ASP CB C 47 38.900 40.367 -1.467 1
1 586 . 3 1 1 A 47 47 ASP N N 47 114.200 126.888 -12.688 1
1 587 . 3 1 1 A 48 48 THR H H 48 9.470 8.554 0.916 1
1 588 . 3 1 1 A 48 48 THR HA H 48 4.520 3.890 0.630 1
1 593 . 3 1 1 A 48 48 THR C C 48 174.500 174.812 -0.312 1
1 594 . 3 1 1 A 48 48 THR CA C 48 62.600 66.406 -3.806 1
1 595 . 3 1 1 A 48 48 THR CB C 48 70.400 68.732 1.668 1
1 597 . 3 1 1 A 48 48 THR N N 48 111.800 114.022 -2.222 1
1 598 . 3 1 1 A 49 49 ALA H H 49 7.850 7.455 0.395 1
1 599 . 3 1 1 A 49 49 ALA HA H 49 4.440 4.425 0.015 1
1 603 . 3 1 1 A 49 49 ALA C C 49 173.200 175.357 -2.157 1
1 604 . 3 1 1 A 49 49 ALA CA C 49 52.700 51.261 1.439 1
1 605 . 3 1 1 A 49 49 ALA CB C 49 21.300 20.590 0.710 1
1 606 . 3 1 1 A 49 49 ALA N N 49 123.400 117.608 5.792 1
1 607 . 3 1 1 A 50 50 ARG H H 50 8.160 8.741 -0.581 1
1 608 . 3 1 1 A 50 50 ARG HA H 50 5.350 5.566 -0.216 1
1 616 . 3 1 1 A 50 50 ARG C C 50 174.700 174.572 0.128 1
1 617 . 3 1 1 A 50 50 ARG CA C 50 54.000 54.322 -0.322 1
1 618 . 3 1 1 A 50 50 ARG CB C 50 34.500 34.297 0.203 1
1 622 . 3 1 1 A 50 50 ARG N N 50 117.400 115.930 1.470 1
1 624 . 3 1 1 A 51 51 ILE H H 51 9.390 8.776 0.614 1
1 625 . 3 1 1 A 51 51 ILE HA H 51 4.790 4.965 -0.175 1
1 635 . 3 1 1 A 51 51 ILE C C 51 172.600 174.518 -1.918 1
1 636 . 3 1 1 A 51 51 ILE CA C 51 60.000 58.972 1.028 1
1 637 . 3 1 1 A 51 51 ILE CB C 51 42.800 41.788 1.012 1
1 641 . 3 1 1 A 51 51 ILE N N 51 124.600 121.001 3.599 1
1 642 . 3 1 1 A 52 52 ARG H H 52 7.980 8.283 -0.303 1
1 643 . 3 1 1 A 52 52 ARG HA H 52 4.170 4.535 -0.365 1
1 651 . 3 1 1 A 52 52 ARG C C 52 174.600 176.222 -1.622 1
1 652 . 3 1 1 A 52 52 ARG CA C 52 57.100 55.980 1.120 1
1 653 . 3 1 1 A 52 52 ARG CB C 52 31.300 30.846 0.454 1
1 657 . 3 1 1 A 52 52 ARG N N 52 125.900 125.098 0.802 1
1 659 . 3 1 1 A 53 53 ILE H H 53 8.290 8.412 -0.122 1
1 660 . 3 1 1 A 53 53 ILE HA H 53 5.160 4.971 0.189 1
1 670 . 3 1 1 A 53 53 ILE C C 53 172.400 174.224 -1.824 1
1 671 . 3 1 1 A 53 53 ILE CA C 53 58.600 58.964 -0.364 1
1 672 . 3 1 1 A 53 53 ILE CB C 53 41.900 42.506 -0.606 1
1 676 . 3 1 1 A 53 53 ILE N N 53 118.500 118.591 -0.091 1
1 677 . 3 1 1 A 54 54 SER H H 54 8.350 9.046 -0.696 1
1 678 . 3 1 1 A 54 54 SER HA H 54 5.070 5.324 -0.254 1
1 681 . 3 1 1 A 54 54 SER C C 54 172.400 171.861 0.539 1
1 682 . 3 1 1 A 54 54 SER CA C 54 57.000 56.645 0.355 1
1 683 . 3 1 1 A 54 54 SER CB C 54 65.900 65.423 0.477 1
1 684 . 3 1 1 A 54 54 SER N N 54 120.700 116.972 3.728 1
1 685 . 3 1 1 A 55 55 SER H H 55 9.130 9.365 -0.235 1
1 686 . 3 1 1 A 55 55 SER HA H 55 5.270 5.054 0.216 1
1 690 . 3 1 1 A 55 55 SER C C 55 174.400 172.858 1.542 1
1 691 . 3 1 1 A 55 55 SER CA C 55 55.500 56.812 -1.312 1
1 692 . 3 1 1 A 55 55 SER CB C 55 64.500 64.419 0.081 1
1 693 . 3 1 1 A 55 55 SER N N 55 117.200 120.675 -3.475 1
1 694 . 3 1 1 A 56 56 PHE H H 56 8.970 8.819 0.151 1
1 695 . 3 1 1 A 56 56 PHE HA H 56 4.600 4.918 -0.318 1
1 703 . 3 1 1 A 56 56 PHE C C 56 176.500 177.295 -0.795 1
1 704 . 3 1 1 A 56 56 PHE CA C 56 58.300 57.450 0.850 1
1 705 . 3 1 1 A 56 56 PHE CB C 56 37.900 40.610 -2.710 1
1 711 . 3 1 1 A 56 56 PHE N N 56 129.400 126.708 2.692 1
1 712 . 3 1 1 A 57 57 GLY H H 57 8.570 8.882 -0.312 1
1 713 . 3 1 1 A 57 57 GLY HA2 H 57 4.020 4.120 -0.100 1
1 714 . 3 1 1 A 57 57 GLY HA3 H 57 4.380 4.122 0.258 1
1 715 . 3 1 1 A 57 57 GLY C C 57 173.700 173.812 -0.112 1
1 716 . 3 1 1 A 57 57 GLY CA C 57 46.300 45.693 0.607 1
1 717 . 3 1 1 A 57 57 GLY N N 57 112.500 112.150 0.350 1
1 718 . 3 1 1 A 58 58 LYS H H 58 6.800 8.154 -1.354 1
1 719 . 3 1 1 A 58 58 LYS HA H 58 4.410 4.445 -0.035 1
1 728 . 3 1 1 A 58 58 LYS C C 58 174.800 175.604 -0.804 1
1 729 . 3 1 1 A 58 58 LYS CA C 58 55.200 55.872 -0.672 1
1 730 . 3 1 1 A 58 58 LYS CB C 58 33.300 32.868 0.432 1
1 734 . 3 1 1 A 58 58 LYS N N 58 118.700 120.908 -2.208 1
1 735 . 3 1 1 A 59 59 GLN H H 59 8.390 8.774 -0.384 1
1 736 . 3 1 1 A 59 59 GLN HA H 59 1.830 4.351 -2.521 1
1 743 . 3 1 1 A 59 59 GLN C C 59 174.100 174.416 -0.316 1
1 744 . 3 1 1 A 59 59 GLN CA C 59 57.100 55.160 1.940 1
1 745 . 3 1 1 A 59 59 GLN CB C 59 28.900 29.782 -0.882 1
1 748 . 3 1 1 A 59 59 GLN N N 59 124.000 123.833 0.167 1
1 750 . 3 1 1 A 60 60 LEU H H 60 5.320 8.264 -2.944 1
1 751 . 3 1 1 A 60 60 LEU HA H 60 4.370 4.832 -0.462 1
1 761 . 3 1 1 A 60 60 LEU CA C 60 52.800 53.457 -0.657 1
1 762 . 3 1 1 A 60 60 LEU CB C 60 46.700 45.578 1.122 1
1 766 . 3 1 1 A 60 60 LEU N N 60 121.800 124.977 -3.177 1
1 767 . 3 1 1 A 61 61 GLN H H 61 8.660 8.794 -0.134 1
1 768 . 3 1 1 A 61 61 GLN HA H 61 4.440 4.731 -0.291 1
1 775 . 3 1 1 A 61 61 GLN C C 61 174.000 174.902 -0.902 1
1 776 . 3 1 1 A 61 61 GLN CA C 61 53.800 54.051 -0.251 1
1 777 . 3 1 1 A 61 61 GLN CB C 61 31.800 31.471 0.329 1
1 780 . 3 1 1 A 61 61 GLN N N 61 120.300 120.638 -0.338 1
1 782 . 3 1 1 A 62 62 ASP H H 62 8.450 8.673 -0.223 1
1 783 . 3 1 1 A 62 62 ASP HA H 62 4.130 4.474 -0.344 1
1 786 . 3 1 1 A 62 62 ASP C C 62 177.200 176.836 0.364 1
1 787 . 3 1 1 A 62 62 ASP CA C 62 55.700 55.495 0.205 1
1 788 . 3 1 1 A 62 62 ASP CB C 62 39.400 40.707 -1.307 1
1 789 . 3 1 1 A 62 62 ASP N N 62 122.400 123.847 -1.447 1
1 790 . 3 1 1 A 63 63 SER H H 63 9.210 9.344 -0.134 1
1 791 . 3 1 1 A 63 63 SER HA H 63 3.850 4.289 -0.439 1
1 794 . 3 1 1 A 63 63 SER C C 63 173.200 173.144 0.056 1
1 795 . 3 1 1 A 63 63 SER CA C 63 61.700 59.611 2.089 1
1 796 . 3 1 1 A 63 63 SER CB C 63 61.800 61.139 0.661 1
1 797 . 3 1 1 A 63 63 SER N N 63 114.300 121.360 -7.060 1
1 798 . 3 1 1 A 64 64 ASP H H 64 7.960 7.611 0.349 1
1 799 . 3 1 1 A 64 64 ASP HA H 64 4.540 4.800 -0.260 1
1 802 . 3 1 1 A 64 64 ASP C C 64 174.900 175.637 -0.737 1
1 803 . 3 1 1 A 64 64 ASP CA C 64 54.900 53.975 0.925 1
1 804 . 3 1 1 A 64 64 ASP CB C 64 40.900 41.566 -0.666 1
1 805 . 3 1 1 A 64 64 ASP N N 64 122.600 123.372 -0.772 1
1 806 . 3 1 1 A 65 65 VAL H H 65 8.180 8.585 -0.405 1
1 807 . 3 1 1 A 65 65 VAL HA H 65 4.670 4.404 0.266 1
1 815 . 3 1 1 A 65 65 VAL C C 65 175.900 175.733 0.167 1
1 816 . 3 1 1 A 65 65 VAL CA C 65 62.300 62.333 -0.033 1
1 817 . 3 1 1 A 65 65 VAL CB C 65 31.700 31.288 0.412 1
1 820 . 3 1 1 A 65 65 VAL N N 65 123.100 126.855 -3.755 1
1 821 . 3 1 1 A 66 66 VAL H H 66 8.770 8.730 0.040 1
1 822 . 3 1 1 A 66 66 VAL HA H 66 5.160 5.086 0.074 1
1 830 . 3 1 1 A 66 66 VAL C C 66 173.600 173.338 0.262 1
1 831 . 3 1 1 A 66 66 VAL CA C 66 58.100 58.796 -0.696 1
1 832 . 3 1 1 A 66 66 VAL CB C 66 35.700 35.828 -0.128 1
1 835 . 3 1 1 A 66 66 VAL N N 66 118.100 120.978 -2.878 1
1 836 . 3 1 1 A 67 67 ARG H H 67 8.880 8.867 0.013 1
1 837 . 3 1 1 A 67 67 ARG HA H 67 5.110 5.086 0.024 1
1 845 . 3 1 1 A 67 67 ARG C C 67 175.300 174.729 0.571 1
1 846 . 3 1 1 A 67 67 ARG CA C 67 54.200 54.422 -0.222 1
1 847 . 3 1 1 A 67 67 ARG CB C 67 32.200 33.551 -1.351 1
1 851 . 3 1 1 A 67 67 ARG N N 67 120.200 121.979 -1.779 1
1 853 . 3 1 1 A 68 68 ILE H H 68 9.220 8.935 0.285 1
1 854 . 3 1 1 A 68 68 ILE HA H 68 4.990 4.704 0.286 1
1 864 . 3 1 1 A 68 68 ILE C C 68 174.900 174.798 0.102 1
1 865 . 3 1 1 A 68 68 ILE CA C 68 58.600 59.669 -1.069 1
1 866 . 3 1 1 A 68 68 ILE CB C 68 39.300 39.137 0.163 1
1 870 . 3 1 1 A 68 68 ILE N N 68 127.200 128.360 -1.160 1
1 871 . 3 1 1 A 69 69 ASP H H 69 9.110 8.849 0.261 1
1 872 . 3 1 1 A 69 69 ASP HA H 69 5.370 5.388 -0.018 1
1 875 . 3 1 1 A 69 69 ASP C C 69 175.800 176.342 -0.542 1
1 876 . 3 1 1 A 69 69 ASP CA C 69 52.400 52.682 -0.282 1
1 877 . 3 1 1 A 69 69 ASP CB C 69 43.700 43.697 0.003 1
1 878 . 3 1 1 A 69 69 ASP N N 69 123.400 125.723 -2.323 1
1 879 . 3 1 1 A 70 70 ASN H H 70 8.300 8.839 -0.539 1
1 880 . 3 1 1 A 70 70 ASN HA H 70 4.160 4.440 -0.280 1
1 885 . 3 1 1 A 70 70 ASN C C 70 176.300 174.696 1.604 1
1 886 . 3 1 1 A 70 70 ASN CA C 70 54.300 54.294 0.006 1
1 887 . 3 1 1 A 70 70 ASN CB C 70 37.500 37.766 -0.266 1
1 889 . 3 1 1 A 70 70 ASN N N 70 119.800 121.044 -1.244 1
1 891 . 3 1 1 A 71 71 ALA H H 71 9.100 8.258 0.842 1
1 892 . 3 1 1 A 71 71 ALA HA H 71 4.500 4.436 0.064 1
1 896 . 3 1 1 A 71 71 ALA C C 71 175.700 176.644 -0.944 1
1 897 . 3 1 1 A 71 71 ALA CA C 71 51.900 52.845 -0.945 1
1 898 . 3 1 1 A 71 71 ALA CB C 71 19.600 19.888 -0.288 1
1 899 . 3 1 1 A 71 71 ALA N N 71 123.000 121.155 1.845 1
1 900 . 3 1 1 A 72 72 ARG H H 72 8.490 8.439 0.051 1
1 901 . 3 1 1 A 72 72 ARG HA H 72 4.720 4.810 -0.090 1
1 909 . 3 1 1 A 72 72 ARG C C 72 175.800 174.977 0.823 1
1 910 . 3 1 1 A 72 72 ARG CA C 72 54.400 54.877 -0.477 1
1 911 . 3 1 1 A 72 72 ARG CB C 72 32.700 32.096 0.604 1
1 915 . 3 1 1 A 72 72 ARG N N 72 122.500 122.936 -0.436 1
1 917 . 3 1 1 A 73 73 VAL H H 73 8.310 8.130 0.180 1
1 918 . 3 1 1 A 73 73 VAL HA H 73 4.250 4.627 -0.377 1
1 926 . 3 1 1 A 73 73 VAL C C 73 174.600 175.677 -1.077 1
1 927 . 3 1 1 A 73 73 VAL CA C 73 62.800 62.115 0.685 1
1 928 . 3 1 1 A 73 73 VAL CB C 73 32.100 32.007 0.093 1
1 931 . 3 1 1 A 73 73 VAL N N 73 127.100 127.043 0.057 1
1 932 . 3 1 1 A 74 74 ALA H H 74 8.880 8.855 0.025 1
1 933 . 3 1 1 A 74 74 ALA HA H 74 4.500 4.897 -0.397 1
1 937 . 3 1 1 A 74 74 ALA C C 74 174.800 175.987 -1.187 1
1 938 . 3 1 1 A 74 74 ALA CA C 74 50.500 50.833 -0.333 1
1 939 . 3 1 1 A 74 74 ALA CB C 74 22.500 24.101 -1.601 1
1 940 . 3 1 1 A 74 74 ALA N N 74 131.000 128.513 2.487 1
1 941 . 3 1 1 A 75 75 GLN H H 75 8.280 8.318 -0.038 1
1 942 . 3 1 1 A 75 75 GLN HA H 75 4.910 5.003 -0.093 1
1 949 . 3 1 1 A 75 75 GLN C C 75 175.100 174.694 0.406 1
1 950 . 3 1 1 A 75 75 GLN CA C 75 54.600 54.807 -0.207 1
1 951 . 3 1 1 A 75 75 GLN CB C 75 31.400 29.767 1.633 1
1 954 . 3 1 1 A 75 75 GLN N N 75 118.800 118.219 0.581 1
1 956 . 3 1 1 A 76 76 PHE H H 76 8.710 9.491 -0.781 1
1 957 . 3 1 1 A 76 76 PHE HA H 76 4.660 4.888 -0.228 1
1 965 . 3 1 1 A 76 76 PHE C C 76 174.900 175.615 -0.715 1
1 966 . 3 1 1 A 76 76 PHE CA C 76 57.000 56.900 0.100 1
1 967 . 3 1 1 A 76 76 PHE CB C 76 41.000 41.345 -0.345 1
1 973 . 3 1 1 A 76 76 PHE N N 76 125.000 122.908 2.092 1
1 974 . 3 1 1 A 77 77 ASN H H 77 9.040 8.765 0.275 1
1 975 . 3 1 1 A 77 77 ASN HA H 77 4.170 4.483 -0.313 1
1 980 . 3 1 1 A 77 77 ASN C C 77 174.200 175.721 -1.521 1
1 981 . 3 1 1 A 77 77 ASN CA C 77 53.800 54.519 -0.719 1
1 982 . 3 1 1 A 77 77 ASN CB C 77 37.400 37.527 -0.127 1
1 984 . 3 1 1 A 77 77 ASN N N 77 123.200 124.270 -1.070 1
1 986 . 3 1 1 A 78 78 GLY H H 78 8.370 8.613 -0.243 1
1 987 . 3 1 1 A 78 78 GLY HA2 H 78 3.410 3.624 -0.214 1
1 988 . 3 1 1 A 78 78 GLY HA3 H 78 3.980 3.718 0.262 1
1 989 . 3 1 1 A 78 78 GLY C C 78 173.800 173.221 0.579 1
1 990 . 3 1 1 A 78 78 GLY CA C 78 45.000 45.453 -0.453 1
1 991 . 3 1 1 A 78 78 GLY N N 78 103.300 104.736 -1.436 1
1 992 . 3 1 1 A 79 79 TYR H H 79 7.670 8.104 -0.434 1
1 993 . 3 1 1 A 79 79 TYR HA H 79 4.860 4.997 -0.137 1
1 1000 . 3 1 1 A 79 79 TYR C C 79 174.800 175.427 -0.627 1
1 1001 . 3 1 1 A 79 79 TYR CA C 79 56.300 57.012 -0.712 1
1 1002 . 3 1 1 A 79 79 TYR CB C 79 40.800 41.722 -0.922 1
1 1007 . 3 1 1 A 79 79 TYR N N 79 118.700 118.584 0.116 1
1 1008 . 3 1 1 A 80 80 LEU H H 80 8.760 8.734 0.026 1
1 1009 . 3 1 1 A 80 80 LEU HA H 80 4.830 4.485 0.345 1
1 1019 . 3 1 1 A 80 80 LEU C C 80 176.200 176.728 -0.528 1
1 1020 . 3 1 1 A 80 80 LEU CA C 80 54.700 55.520 -0.820 1
1 1021 . 3 1 1 A 80 80 LEU CB C 80 43.500 42.514 0.986 1
1 1025 . 3 1 1 A 80 80 LEU N N 80 122.600 125.869 -3.269 1
1 1026 . 3 1 1 A 81 81 SER H H 81 8.650 8.802 -0.152 1
1 1027 . 3 1 1 A 81 81 SER HA H 81 4.860 5.240 -0.380 1
1 1030 . 3 1 1 A 81 81 SER C C 81 172.600 172.715 -0.115 1
1 1031 . 3 1 1 A 81 81 SER CA C 81 56.600 57.302 -0.702 1
1 1032 . 3 1 1 A 81 81 SER CB C 81 66.300 65.927 0.373 1
1 1033 . 3 1 1 A 81 81 SER N N 81 114.700 118.135 -3.435 1
1 1034 . 3 1 1 A 82 82 LEU H H 82 8.680 8.549 0.131 1
1 1035 . 3 1 1 A 82 82 LEU HA H 82 5.190 5.139 0.051 1
1 1045 . 3 1 1 A 82 82 LEU C C 82 177.100 175.413 1.687 1
1 1046 . 3 1 1 A 82 82 LEU CA C 82 53.300 53.691 -0.391 1
1 1047 . 3 1 1 A 82 82 LEU CB C 82 43.800 43.494 0.306 1
1 1051 . 3 1 1 A 82 82 LEU N N 82 119.800 122.764 -2.964 1
1 1052 . 3 1 1 A 83 83 SER H H 83 9.560 9.510 0.050 1
1 1053 . 3 1 1 A 83 83 SER HA H 83 5.390 5.523 -0.133 1
1 1056 . 3 1 1 A 83 83 SER C C 83 174.200 173.270 0.930 1
1 1057 . 3 1 1 A 83 83 SER CA C 83 57.100 56.981 0.119 1
1 1058 . 3 1 1 A 83 83 SER CB C 83 64.400 64.732 -0.332 1
1 1059 . 3 1 1 A 83 83 SER N N 83 119.000 120.454 -1.454 1
1 1060 . 3 1 1 A 84 84 VAL H H 84 9.150 9.356 -0.206 1
1 1061 . 3 1 1 A 84 84 VAL HA H 84 4.490 4.672 -0.182 1
1 1069 . 3 1 1 A 84 84 VAL C C 84 174.700 176.225 -1.525 1
1 1070 . 3 1 1 A 84 84 VAL CA C 84 61.300 61.312 -0.012 1
1 1071 . 3 1 1 A 84 84 VAL CB C 84 33.000 31.549 1.451 1
1 1074 . 3 1 1 A 84 84 VAL N N 84 128.300 127.322 0.978 1
1 1075 . 3 1 1 A 85 85 GLY H H 85 7.970 8.797 -0.827 1
1 1076 . 3 1 1 A 85 85 GLY HA2 H 85 4.030 4.219 -0.189 1
1 1077 . 3 1 1 A 85 85 GLY HA3 H 85 4.840 4.286 0.554 1
1 1078 . 3 1 1 A 85 85 GLY C C 85 175.800 175.140 0.660 1
1 1079 . 3 1 1 A 85 85 GLY CA C 85 44.800 44.392 0.408 1
1 1080 . 3 1 1 A 85 85 GLY N N 85 114.300 115.189 -0.889 1
1 1081 . 3 1 1 A 86 86 ASP H H 86 8.860 8.943 -0.083 1
1 1082 . 3 1 1 A 86 86 ASP HA H 86 4.370 4.383 -0.013 1
1 1085 . 3 1 1 A 86 86 ASP C C 86 177.400 177.953 -0.553 1
1 1086 . 3 1 1 A 86 86 ASP CA C 86 57.400 57.346 0.054 1
1 1087 . 3 1 1 A 86 86 ASP CB C 86 40.600 40.521 0.079 1
1 1088 . 3 1 1 A 86 86 ASP N N 86 122.500 120.429 2.071 1
1 1089 . 3 1 1 A 87 87 SER H H 87 8.540 8.156 0.384 1
1 1090 . 3 1 1 A 87 87 SER HA H 87 4.620 4.170 0.450 1
1 1093 . 3 1 1 A 87 87 SER C C 87 174.700 174.908 -0.208 1
1 1094 . 3 1 1 A 87 87 SER CA C 87 58.200 61.678 -3.478 1
1 1095 . 3 1 1 A 87 87 SER CB C 87 63.300 62.902 0.398 1
1 1096 . 3 1 1 A 87 87 SER N N 87 112.100 116.105 -4.005 1
1 1097 . 3 1 1 A 88 88 SER H H 88 7.880 7.637 0.243 1
1 1098 . 3 1 1 A 88 88 SER HA H 88 5.050 4.481 0.569 1
1 1101 . 3 1 1 A 88 88 SER C C 88 172.700 174.021 -1.321 1
1 1102 . 3 1 1 A 88 88 SER CA C 88 57.600 58.408 -0.808 1
1 1103 . 3 1 1 A 88 88 SER CB C 88 64.300 63.917 0.383 1
1 1104 . 3 1 1 A 88 88 SER N N 88 119.200 114.754 4.446 1
1 1105 . 3 1 1 A 89 89 ARG H H 89 8.350 8.318 0.032 1
1 1106 . 3 1 1 A 89 89 ARG HA H 89 4.720 5.078 -0.358 1
1 1114 . 3 1 1 A 89 89 ARG C C 89 174.200 175.054 -0.854 1
1 1115 . 3 1 1 A 89 89 ARG CA C 89 55.000 54.587 0.413 1
1 1116 . 3 1 1 A 89 89 ARG CB C 89 33.500 33.395 0.105 1
1 1120 . 3 1 1 A 89 89 ARG N N 89 122.800 121.204 1.596 1
1 1122 . 3 1 1 A 90 90 ILE H H 90 8.530 8.996 -0.466 1
1 1123 . 3 1 1 A 90 90 ILE HA H 90 4.790 4.929 -0.139 1
1 1133 . 3 1 1 A 90 90 ILE C C 90 175.400 174.581 0.819 1
1 1134 . 3 1 1 A 90 90 ILE CA C 90 60.600 60.015 0.585 1
1 1135 . 3 1 1 A 90 90 ILE CB C 90 40.600 40.865 -0.265 1
1 1139 . 3 1 1 A 90 90 ILE N N 90 123.100 123.548 -0.448 1
1 1140 . 3 1 1 A 91 91 GLU H H 91 9.000 9.067 -0.067 1
1 1141 . 3 1 1 A 91 91 GLU HA H 91 4.730 4.983 -0.253 1
1 1146 . 3 1 1 A 91 91 GLU C C 91 175.100 175.359 -0.259 1
1 1147 . 3 1 1 A 91 91 GLU CA C 91 54.300 54.616 -0.316 1
1 1148 . 3 1 1 A 91 91 GLU CB C 91 32.400 32.969 -0.569 1
1 1150 . 3 1 1 A 91 91 GLU N N 91 126.400 128.688 -2.288 1
1 1151 . 3 1 1 A 92 92 SER H H 92 8.830 8.934 -0.104 1
1 1152 . 3 1 1 A 92 92 SER HA H 92 4.700 4.517 0.183 1
1 1155 . 3 1 1 A 92 92 SER C C 92 174.600 174.174 0.426 1
1 1156 . 3 1 1 A 92 92 SER CA C 92 59.300 58.349 0.951 1
1 1157 . 3 1 1 A 92 92 SER CB C 92 63.100 63.563 -0.463 1
1 1158 . 3 1 1 A 92 92 SER N N 92 119.800 122.817 -3.017 1
1 1159 . 3 1 1 A 93 93 VAL H H 93 8.350 8.553 -0.203 1
1 1160 . 3 1 1 A 93 93 VAL HA H 93 4.290 4.079 0.211 1
1 1168 . 3 1 1 A 93 93 VAL C C 93 175.100 175.617 -0.517 1
1 1169 . 3 1 1 A 93 93 VAL CA C 93 61.300 64.225 -2.925 1
1 1170 . 3 1 1 A 93 93 VAL CB C 93 33.900 32.653 1.247 1
1 1173 . 3 1 1 A 93 93 VAL N N 93 121.800 126.584 -4.784 1
1 1174 . 3 1 1 A 94 94 ASN H H 94 8.510 7.758 0.752 1
1 1175 . 3 1 1 A 94 94 ASN HA H 94 4.770 4.448 0.322 1
1 1180 . 3 1 1 A 94 94 ASN C C 94 175.000 174.608 0.392 1
1 1181 . 3 1 1 A 94 94 ASN CA C 94 52.700 53.714 -1.014 1
1 1182 . 3 1 1 A 94 94 ASN CB C 94 38.500 37.201 1.299 1
1 1184 . 3 1 1 A 94 94 ASN N N 94 121.800 117.505 4.295 1
1 1186 . 3 1 1 A 95 95 VAL H H 95 7.860 8.427 -0.567 1
1 1187 . 3 1 1 A 95 95 VAL HA H 95 4.100 4.162 -0.062 1
1 1195 . 3 1 1 A 95 95 VAL C C 95 175.100 176.155 -1.055 1
1 1196 . 3 1 1 A 95 95 VAL CA C 95 61.700 62.910 -1.210 1
1 1197 . 3 1 1 A 95 95 VAL CB C 95 33.100 30.994 2.106 1
1 1200 . 3 1 1 A 95 95 VAL N N 95 119.700 123.317 -3.617 1
1 1201 . 3 1 1 A 96 96 ASN H H 96 8.490 8.481 0.009 1
1 1202 . 3 1 1 A 96 96 ASN HA H 96 4.700 5.474 -0.774 1
1 1207 . 3 1 1 A 96 96 ASN C C 96 174.600 173.514 1.086 1
1 1208 . 3 1 1 A 96 96 ASN CA C 96 53.000 52.659 0.341 1
1 1209 . 3 1 1 A 96 96 ASN CB C 96 39.000 41.179 -2.179 1
1 1211 . 3 1 1 A 96 96 ASN N N 96 122.200 124.810 -2.610 1
1 1213 . 3 1 1 A 97 97 ILE H H 97 8.080 8.726 -0.646 1
1 1214 . 3 1 1 A 97 97 ILE HA H 97 4.370 4.738 -0.368 1
1 1224 . 3 1 1 A 97 97 ILE CA C 97 58.600 58.019 0.581 1
1 1225 . 3 1 1 A 97 97 ILE CB C 97 38.600 38.183 0.417 1
1 1229 . 3 1 1 A 97 97 ILE N N 97 123.500 119.438 4.062 1
1 1230 . 3 1 1 A 98 98 PRO HA H 98 4.360 4.373 -0.013 1
1 1237 . 3 1 1 A 98 98 PRO C C 98 176.600 176.736 -0.136 1
1 1238 . 3 1 1 A 98 98 PRO CA C 98 63.100 63.727 -0.627 1
1 1239 . 3 1 1 A 98 98 PRO CB C 98 31.800 32.060 -0.260 1
1 1242 . 3 1 1 A 99 99 LEU H H 99 8.200 8.487 -0.287 1
1 1243 . 3 1 1 A 99 99 LEU HA H 99 4.200 3.903 0.297 1
1 1253 . 3 1 1 A 99 99 LEU C C 99 177.300 175.885 1.415 1
1 1254 . 3 1 1 A 99 99 LEU CA C 99 55.000 55.465 -0.465 1
1 1255 . 3 1 1 A 99 99 LEU CB C 99 42.400 40.970 1.430 1
1 1259 . 3 1 1 A 99 99 LEU N N 99 122.500 118.006 4.494 1
1 1260 . 3 1 1 A 100 100 GLU H H 100 8.250 8.090 0.160 1
1 1261 . 3 1 1 A 100 100 GLU HA H 100 4.140 4.141 -0.001 1
1 1266 . 3 1 1 A 100 100 GLU C C 100 176.100 176.148 -0.048 1
1 1267 . 3 1 1 A 100 100 GLU CA C 100 56.100 56.764 -0.664 1
1 1268 . 3 1 1 A 100 100 GLU CB C 100 29.900 29.939 -0.039 1
1 1270 . 3 1 1 A 100 100 GLU N N 100 121.000 123.864 -2.864 1
1 1271 . 3 1 1 A 101 101 HIS H H 101 8.540 8.698 -0.158 1
1 1272 . 3 1 1 A 101 101 HIS HA H 101 4.600 4.666 -0.066 1
1 1275 . 3 1 1 A 101 101 HIS C C 101 174.200 175.133 -0.933 1
1 1276 . 3 1 1 A 101 101 HIS CA C 101 55.200 54.635 0.565 1
1 1277 . 3 1 1 A 101 101 HIS CB C 101 29.000 27.230 1.770 1
1 1278 . 3 1 1 A 101 101 HIS N N 101 119.400 121.760 -2.360 1
1 1279 . 3 1 1 A 102 102 HIS H H 102 8.660 8.467 0.193 1
1 1280 . 3 1 1 A 102 102 HIS HA H 102 4.630 4.089 0.541 1
1 1283 . 3 1 1 A 102 102 HIS C C 102 174.200 176.267 -2.067 1
1 1284 . 3 1 1 A 102 102 HIS CA C 102 55.200 59.493 -4.293 1
1 1285 . 3 1 1 A 102 102 HIS CB C 102 29.100 29.819 -0.719 1
1 1286 . 3 1 1 A 102 102 HIS N N 102 119.700 121.883 -2.183 1
1 1287 . 3 1 1 A 103 103 HIS H H 103 8.680 7.827 0.853 1
1 1288 . 3 1 1 A 103 103 HIS HA H 103 4.640 4.451 0.189 1
1 1291 . 3 1 1 A 103 103 HIS C C 103 174.200 175.309 -1.109 1
1 1292 . 3 1 1 A 103 103 HIS CA C 103 55.200 54.316 0.884 1
1 1293 . 3 1 1 A 103 103 HIS CB C 103 29.200 28.024 1.176 1
1 1294 . 3 1 1 A 103 103 HIS N N 103 120.500 118.169 2.331 1
1 1295 . 3 1 1 A 104 104 HIS H H 104 8.580 8.396 0.184 1
1 1296 . 3 1 1 A 104 104 HIS HA H 104 4.590 3.946 0.644 1
1 1299 . 3 1 1 A 104 104 HIS C C 104 174.200 175.274 -1.074 1
1 1300 . 3 1 1 A 104 104 HIS CA C 104 55.200 59.229 -4.029 1
1 1301 . 3 1 1 A 104 104 HIS CB C 104 29.300 29.994 -0.694 1
1 1302 . 3 1 1 A 104 104 HIS N N 104 120.700 123.366 -2.666 1
1 1303 . 3 1 1 A 105 105 HIS H H 105 8.550 7.749 0.801 1
1 1304 . 3 1 1 A 105 105 HIS HA H 105 4.610 4.115 0.495 1
1 1307 . 3 1 1 A 105 105 HIS C C 105 173.500 175.014 -1.514 1
1 1308 . 3 1 1 A 105 105 HIS CA C 105 55.400 57.629 -2.229 1
1 1309 . 3 1 1 A 105 105 HIS CB C 105 28.800 29.011 -0.211 1
1 1310 . 3 1 1 A 105 105 HIS N N 105 119.000 117.489 1.511 1
1 7 . 4 1 1 A 2 2 ASP H H 2 8.890 8.736 0.154 1
1 8 . 4 1 1 A 2 2 ASP HA H 2 4.740 5.037 -0.297 1
1 11 . 4 1 1 A 2 2 ASP C C 2 174.600 173.640 0.960 1
1 12 . 4 1 1 A 2 2 ASP CA C 2 53.800 53.351 0.449 1
1 13 . 4 1 1 A 2 2 ASP CB C 2 41.500 43.898 -2.398 1
1 14 . 4 1 1 A 2 2 ASP N N 2 122.100 121.354 0.746 1
1 15 . 4 1 1 A 3 3 LEU H H 3 8.280 8.616 -0.336 1
1 16 . 4 1 1 A 3 3 LEU HA H 3 4.420 5.001 -0.581 1
1 26 . 4 1 1 A 3 3 LEU C C 3 176.900 176.071 0.829 1
1 27 . 4 1 1 A 3 3 LEU CA C 3 55.000 54.123 0.877 1
1 28 . 4 1 1 A 3 3 LEU CB C 3 42.700 43.732 -1.032 1
1 32 . 4 1 1 A 3 3 LEU N N 3 122.300 124.442 -2.142 1
1 33 . 4 1 1 A 4 4 VAL H H 4 8.640 8.634 0.006 1
1 34 . 4 1 1 A 4 4 VAL HA H 4 4.540 4.973 -0.433 1
1 42 . 4 1 1 A 4 4 VAL C C 4 175.800 175.197 0.603 1
1 43 . 4 1 1 A 4 4 VAL CA C 4 59.400 58.616 0.784 1
1 44 . 4 1 1 A 4 4 VAL CB C 4 35.400 35.545 -0.145 1
1 47 . 4 1 1 A 4 4 VAL N N 4 122.600 119.434 3.166 1
1 48 . 4 1 1 A 5 5 LYS H H 5 8.630 8.259 0.371 1
1 49 . 4 1 1 A 5 5 LYS HA H 5 4.450 4.427 0.023 1
1 58 . 4 1 1 A 5 5 LYS C C 5 179.400 178.482 0.918 1
1 59 . 4 1 1 A 5 5 LYS CA C 5 53.600 56.029 -2.429 1
1 60 . 4 1 1 A 5 5 LYS CB C 5 30.900 33.308 -2.408 1
1 64 . 4 1 1 A 5 5 LYS N N 5 121.100 121.741 -0.641 1
1 65 . 4 1 1 A 6 6 ILE H H 6 10.320 8.868 1.452 1
1 66 . 4 1 1 A 6 6 ILE HA H 6 3.440 3.714 -0.274 1
1 76 . 4 1 1 A 6 6 ILE C C 6 178.300 178.048 0.252 1
1 77 . 4 1 1 A 6 6 ILE CA C 6 65.700 65.104 0.596 1
1 78 . 4 1 1 A 6 6 ILE CB C 6 35.900 37.684 -1.784 1
1 82 . 4 1 1 A 6 6 ILE N N 6 125.400 122.647 2.753 1
1 83 . 4 1 1 A 7 7 ARG H H 7 8.210 7.999 0.211 1
1 84 . 4 1 1 A 7 7 ARG HA H 7 3.850 4.076 -0.226 1
1 92 . 4 1 1 A 7 7 ARG C C 7 175.600 177.375 -1.775 1
1 93 . 4 1 1 A 7 7 ARG CA C 7 57.800 58.887 -1.087 1
1 94 . 4 1 1 A 7 7 ARG CB C 7 30.300 29.772 0.528 1
1 98 . 4 1 1 A 7 7 ARG N N 7 118.800 121.392 -2.592 1
1 100 . 4 1 1 A 8 8 ASP H H 8 7.850 7.776 0.074 1
1 101 . 4 1 1 A 8 8 ASP HA H 8 4.700 4.696 0.004 1
1 104 . 4 1 1 A 8 8 ASP C C 8 176.100 176.473 -0.373 1
1 105 . 4 1 1 A 8 8 ASP CA C 8 54.100 54.594 -0.494 1
1 106 . 4 1 1 A 8 8 ASP CB C 8 41.200 41.361 -0.161 1
1 107 . 4 1 1 A 8 8 ASP N N 8 116.800 117.370 -0.570 1
1 108 . 4 1 1 A 9 9 VAL H H 9 7.240 7.293 -0.053 1
1 109 . 4 1 1 A 9 9 VAL HA H 9 3.710 3.958 -0.248 1
1 117 . 4 1 1 A 9 9 VAL C C 9 174.900 176.012 -1.112 1
1 118 . 4 1 1 A 9 9 VAL CA C 9 64.300 63.202 1.098 1
1 119 . 4 1 1 A 9 9 VAL CB C 9 31.500 31.608 -0.108 1
1 122 . 4 1 1 A 9 9 VAL N N 9 121.800 122.117 -0.317 1
1 123 . 4 1 1 A 10 10 SER H H 10 8.600 8.131 0.469 1
1 124 . 4 1 1 A 10 10 SER HA H 10 4.600 4.936 -0.336 1
1 127 . 4 1 1 A 10 10 SER CA C 10 56.700 57.336 -0.636 1
1 128 . 4 1 1 A 10 10 SER CB C 10 66.100 67.282 -1.182 1
1 129 . 4 1 1 A 10 10 SER N N 10 122.200 120.640 1.560 1
1 130 . 4 1 1 A 11 11 LEU H H 11 8.660 8.991 -0.331 1
1 131 . 4 1 1 A 11 11 LEU HA H 11 3.900 4.003 -0.103 1
1 141 . 4 1 1 A 11 11 LEU C C 11 178.100 179.149 -1.049 1
1 142 . 4 1 1 A 11 11 LEU CA C 11 56.700 57.670 -0.970 1
1 143 . 4 1 1 A 11 11 LEU CB C 11 41.400 41.366 0.034 1
1 147 . 4 1 1 A 11 11 LEU N N 11 120.300 126.495 -6.195 1
1 148 . 4 1 1 A 12 12 SER H H 12 8.160 8.037 0.123 1
1 149 . 4 1 1 A 12 12 SER HA H 12 4.270 4.279 -0.009 1
1 152 . 4 1 1 A 12 12 SER C C 12 174.200 174.943 -0.743 1
1 153 . 4 1 1 A 12 12 SER CA C 12 59.900 61.376 -1.476 1
1 154 . 4 1 1 A 12 12 SER CB C 12 63.100 62.957 0.143 1
1 155 . 4 1 1 A 12 12 SER N N 12 112.100 113.831 -1.731 1
1 156 . 4 1 1 A 13 13 THR H H 13 7.460 7.582 -0.122 1
1 157 . 4 1 1 A 13 13 THR HA H 13 4.760 4.705 0.055 1
1 162 . 4 1 1 A 13 13 THR CA C 13 56.600 58.996 -2.396 1
1 163 . 4 1 1 A 13 13 THR CB C 13 70.100 69.013 1.087 1
1 165 . 4 1 1 A 13 13 THR N N 13 114.700 111.319 3.381 1
1 166 . 4 1 1 A 14 14 PRO HA H 14 4.050 4.386 -0.336 1
1 173 . 4 1 1 A 14 14 PRO C C 14 175.800 175.749 0.051 1
1 174 . 4 1 1 A 14 14 PRO CA C 14 65.100 64.237 0.863 1
1 175 . 4 1 1 A 14 14 PRO CB C 14 32.100 31.451 0.649 1
1 178 . 4 1 1 A 15 15 TYR H H 15 7.380 7.468 -0.088 1
1 179 . 4 1 1 A 15 15 TYR HA H 15 5.570 5.544 0.026 1
1 186 . 4 1 1 A 15 15 TYR C C 15 176.100 174.999 1.101 1
1 187 . 4 1 1 A 15 15 TYR CA C 15 56.400 56.857 -0.457 1
1 188 . 4 1 1 A 15 15 TYR CB C 15 41.500 40.312 1.188 1
1 193 . 4 1 1 A 15 15 TYR N N 15 113.800 117.768 -3.968 1
1 194 . 4 1 1 A 16 16 VAL H H 16 9.010 8.693 0.317 1
1 195 . 4 1 1 A 16 16 VAL HA H 16 4.920 5.055 -0.135 1
1 203 . 4 1 1 A 16 16 VAL C C 16 174.300 173.449 0.851 1
1 204 . 4 1 1 A 16 16 VAL CA C 16 59.600 59.477 0.123 1
1 205 . 4 1 1 A 16 16 VAL CB C 16 36.800 36.368 0.432 1
1 208 . 4 1 1 A 16 16 VAL N N 16 113.800 118.365 -4.565 1
1 209 . 4 1 1 A 17 17 SER H H 17 7.960 9.350 -1.390 1
1 210 . 4 1 1 A 17 17 SER HA H 17 5.860 5.523 0.337 1
1 213 . 4 1 1 A 17 17 SER C C 17 172.700 173.661 -0.961 1
1 214 . 4 1 1 A 17 17 SER CA C 17 57.300 56.722 0.578 1
1 215 . 4 1 1 A 17 17 SER CB C 17 64.000 65.157 -1.157 1
1 216 . 4 1 1 A 17 17 SER N N 17 117.100 117.438 -0.338 1
1 217 . 4 1 1 A 18 18 VAL H H 18 8.570 8.955 -0.385 1
1 218 . 4 1 1 A 18 18 VAL HA H 18 4.900 5.154 -0.254 1
1 226 . 4 1 1 A 18 18 VAL C C 18 173.700 173.683 0.017 1
1 227 . 4 1 1 A 18 18 VAL CA C 18 58.800 59.185 -0.385 1
1 228 . 4 1 1 A 18 18 VAL CB C 18 36.700 35.917 0.783 1
1 231 . 4 1 1 A 18 18 VAL N N 18 113.500 118.739 -5.239 1
1 232 . 4 1 1 A 19 19 ILE H H 19 8.490 8.615 -0.125 1
1 233 . 4 1 1 A 19 19 ILE HA H 19 5.300 4.956 0.344 1
1 243 . 4 1 1 A 19 19 ILE C C 19 175.800 174.798 1.002 1
1 244 . 4 1 1 A 19 19 ILE CA C 19 59.700 59.409 0.291 1
1 245 . 4 1 1 A 19 19 ILE CB C 19 41.700 42.686 -0.986 1
1 249 . 4 1 1 A 19 19 ILE N N 19 120.600 122.115 -1.515 1
1 250 . 4 1 1 A 20 20 GLY H H 20 8.670 7.949 0.721 1
1 251 . 4 1 1 A 20 20 GLY HA2 H 20 3.760 4.155 -0.395 1
1 252 . 4 1 1 A 20 20 GLY HA3 H 20 4.190 4.160 0.030 1
1 253 . 4 1 1 A 20 20 GLY C C 20 169.900 171.498 -1.598 1
1 254 . 4 1 1 A 20 20 GLY CA C 20 46.000 45.973 0.027 1
1 255 . 4 1 1 A 20 20 GLY N N 20 110.200 113.466 -3.266 1
1 256 . 4 1 1 A 21 21 LYS H H 21 8.920 8.277 0.643 1
1 257 . 4 1 1 A 21 21 LYS HA H 21 5.210 5.031 0.179 1
1 266 . 4 1 1 A 21 21 LYS C C 21 176.400 175.380 1.020 1
1 267 . 4 1 1 A 21 21 LYS CA C 21 54.400 54.674 -0.274 1
1 268 . 4 1 1 A 21 21 LYS CB C 21 35.400 35.042 0.358 1
1 272 . 4 1 1 A 21 21 LYS N N 21 119.100 120.882 -1.782 1
1 273 . 4 1 1 A 22 22 ILE H H 22 8.900 8.384 0.516 1
1 274 . 4 1 1 A 22 22 ILE HA H 22 5.050 4.679 0.371 1
1 284 . 4 1 1 A 22 22 ILE C C 22 176.900 175.388 1.512 1
1 285 . 4 1 1 A 22 22 ILE CA C 22 57.800 60.878 -3.078 1
1 286 . 4 1 1 A 22 22 ILE CB C 22 36.200 38.373 -2.173 1
1 290 . 4 1 1 A 22 22 ILE N N 22 130.000 127.574 2.426 1
1 291 . 4 1 1 A 23 23 THR H H 23 9.020 8.755 0.265 1
1 292 . 4 1 1 A 23 23 THR HA H 23 4.660 4.931 -0.271 1
1 297 . 4 1 1 A 23 23 THR C C 23 174.000 173.962 0.038 1
1 298 . 4 1 1 A 23 23 THR CA C 23 60.800 59.975 0.825 1
1 299 . 4 1 1 A 23 23 THR CB C 23 73.400 71.934 1.466 1
1 301 . 4 1 1 A 23 23 THR N N 23 118.200 117.926 0.274 1
1 302 . 4 1 1 A 24 24 GLY H H 24 8.430 8.737 -0.307 1
1 303 . 4 1 1 A 24 24 GLY HA2 H 24 3.910 3.823 0.087 1
1 304 . 4 1 1 A 24 24 GLY HA3 H 24 3.910 4.007 -0.097 1
1 305 . 4 1 1 A 24 24 GLY C C 24 175.400 174.761 0.639 1
1 306 . 4 1 1 A 24 24 GLY CA C 24 47.100 47.008 0.092 1
1 307 . 4 1 1 A 24 24 GLY N N 24 107.200 111.623 -4.423 1
1 308 . 4 1 1 A 25 25 ILE H H 25 9.370 8.003 1.367 1
1 309 . 4 1 1 A 25 25 ILE HA H 25 4.480 4.123 0.357 1
1 319 . 4 1 1 A 25 25 ILE C C 25 178.200 175.612 2.588 1
1 320 . 4 1 1 A 25 25 ILE CA C 25 59.200 61.242 -2.042 1
1 321 . 4 1 1 A 25 25 ILE CB C 25 35.400 38.152 -2.752 1
1 325 . 4 1 1 A 25 25 ILE N N 25 120.600 120.749 -0.149 1
1 326 . 4 1 1 A 26 26 HIS H H 26 9.000 9.440 -0.440 1
1 327 . 4 1 1 A 26 26 HIS HA H 26 4.770 5.313 -0.543 1
1 330 . 4 1 1 A 26 26 HIS C C 26 172.700 173.994 -1.294 1
1 331 . 4 1 1 A 26 26 HIS CA C 26 55.000 54.249 0.751 1
1 332 . 4 1 1 A 26 26 HIS CB C 26 31.100 32.768 -1.668 1
1 333 . 4 1 1 A 26 26 HIS N N 26 123.800 125.730 -1.930 1
1 334 . 4 1 1 A 27 27 LYS H H 27 8.930 9.063 -0.133 1
1 335 . 4 1 1 A 27 27 LYS HA H 27 4.770 4.427 0.343 1
1 344 . 4 1 1 A 27 27 LYS C C 27 175.300 175.340 -0.040 1
1 345 . 4 1 1 A 27 27 LYS CA C 27 55.100 55.600 -0.500 1
1 346 . 4 1 1 A 27 27 LYS CB C 27 34.400 33.562 0.838 1
1 350 . 4 1 1 A 27 27 LYS N N 27 125.900 124.662 1.238 1
1 351 . 4 1 1 A 28 28 LYS H H 28 8.880 8.111 0.769 1
1 352 . 4 1 1 A 28 28 LYS HA H 28 4.570 4.924 -0.354 1
1 361 . 4 1 1 A 28 28 LYS C C 28 174.500 174.256 0.244 1
1 362 . 4 1 1 A 28 28 LYS CA C 28 54.600 55.275 -0.675 1
1 363 . 4 1 1 A 28 28 LYS CB C 28 35.300 36.352 -1.052 1
1 367 . 4 1 1 A 28 28 LYS N N 28 127.400 126.364 1.036 1
1 368 . 4 1 1 A 29 29 GLU H H 29 8.440 8.760 -0.320 1
1 369 . 4 1 1 A 29 29 GLU HA H 29 5.260 5.463 -0.203 1
1 374 . 4 1 1 A 29 29 GLU C C 29 175.800 175.013 0.787 1
1 375 . 4 1 1 A 29 29 GLU CA C 29 54.800 54.724 0.076 1
1 376 . 4 1 1 A 29 29 GLU CB C 29 31.500 33.565 -2.065 1
1 378 . 4 1 1 A 29 29 GLU N N 29 122.200 124.041 -1.841 1
1 379 . 4 1 1 A 30 30 TYR H H 30 8.960 8.571 0.389 1
1 380 . 4 1 1 A 30 30 TYR HA H 30 4.820 5.314 -0.494 1
1 387 . 4 1 1 A 30 30 TYR C C 30 172.600 172.434 0.166 1
1 388 . 4 1 1 A 30 30 TYR CA C 30 56.300 55.526 0.774 1
1 389 . 4 1 1 A 30 30 TYR CB C 30 40.500 41.449 -0.949 1
1 394 . 4 1 1 A 30 30 TYR N N 30 121.100 117.549 3.551 1
1 395 . 4 1 1 A 31 31 GLU H H 31 8.610 8.603 0.007 1
1 396 . 4 1 1 A 31 31 GLU HA H 31 4.810 4.384 0.426 1
1 401 . 4 1 1 A 31 31 GLU C C 31 176.100 175.303 0.797 1
1 402 . 4 1 1 A 31 31 GLU CA C 31 55.100 56.330 -1.230 1
1 403 . 4 1 1 A 31 31 GLU CB C 31 30.300 30.258 0.042 1
1 405 . 4 1 1 A 31 31 GLU N N 31 121.800 121.354 0.446 1
1 406 . 4 1 1 A 32 32 SER H H 32 8.570 8.976 -0.406 1
1 407 . 4 1 1 A 32 32 SER HA H 32 4.520 4.988 -0.468 1
1 410 . 4 1 1 A 32 32 SER C C 32 174.300 173.960 0.340 1
1 411 . 4 1 1 A 32 32 SER CA C 32 57.300 57.621 -0.321 1
1 412 . 4 1 1 A 32 32 SER CB C 32 64.100 63.952 0.148 1
1 413 . 4 1 1 A 32 32 SER N N 32 118.500 123.592 -5.092 1
1 414 . 4 1 1 A 33 33 ASP H H 33 9.290 9.561 -0.271 1
1 415 . 4 1 1 A 33 33 ASP HA H 33 4.340 4.364 -0.024 1
1 418 . 4 1 1 A 33 33 ASP C C 33 175.900 176.158 -0.258 1
1 419 . 4 1 1 A 33 33 ASP CA C 33 55.000 55.375 -0.375 1
1 420 . 4 1 1 A 33 33 ASP CB C 33 39.300 39.476 -0.176 1
1 421 . 4 1 1 A 33 33 ASP N N 33 125.700 127.734 -2.034 1
1 422 . 4 1 1 A 34 34 GLY H H 34 8.690 8.467 0.223 1
1 423 . 4 1 1 A 34 34 GLY HA2 H 34 3.660 3.711 -0.051 1
1 424 . 4 1 1 A 34 34 GLY HA3 H 34 4.140 3.711 0.429 1
1 425 . 4 1 1 A 34 34 GLY C C 34 174.200 173.719 0.481 1
1 426 . 4 1 1 A 34 34 GLY CA C 34 45.600 45.595 0.005 1
1 427 . 4 1 1 A 34 34 GLY N N 34 104.800 104.877 -0.077 1
1 428 . 4 1 1 A 35 35 THR H H 35 7.840 8.182 -0.342 1
1 429 . 4 1 1 A 35 35 THR HA H 35 4.660 4.805 -0.145 1
1 434 . 4 1 1 A 35 35 THR C C 35 173.000 173.464 -0.464 1
1 435 . 4 1 1 A 35 35 THR CA C 35 60.200 59.889 0.311 1
1 436 . 4 1 1 A 35 35 THR CB C 35 71.200 71.103 0.097 1
1 438 . 4 1 1 A 35 35 THR N N 35 114.800 111.431 3.369 1
1 439 . 4 1 1 A 36 36 THR H H 36 8.480 8.638 -0.158 1
1 440 . 4 1 1 A 36 36 THR HA H 36 4.620 4.540 0.080 1
1 445 . 4 1 1 A 36 36 THR C C 36 173.800 174.268 -0.468 1
1 446 . 4 1 1 A 36 36 THR CA C 36 62.300 62.869 -0.569 1
1 447 . 4 1 1 A 36 36 THR CB C 36 69.500 69.465 0.035 1
1 449 . 4 1 1 A 36 36 THR N N 36 119.400 121.777 -2.377 1
1 450 . 4 1 1 A 37 37 LYS H H 37 8.880 8.626 0.254 1
1 451 . 4 1 1 A 37 37 LYS HA H 37 4.570 4.888 -0.318 1
1 460 . 4 1 1 A 37 37 LYS C C 37 174.500 174.510 -0.010 1
1 461 . 4 1 1 A 37 37 LYS CA C 37 54.600 54.168 0.432 1
1 462 . 4 1 1 A 37 37 LYS CB C 37 35.500 35.725 -0.225 1
1 466 . 4 1 1 A 37 37 LYS N N 37 128.000 125.203 2.797 1
1 467 . 4 1 1 A 38 38 SER H H 38 8.370 8.682 -0.312 1
1 468 . 4 1 1 A 38 38 SER HA H 38 5.250 5.000 0.250 1
1 471 . 4 1 1 A 38 38 SER C C 38 173.200 173.198 0.002 1
1 472 . 4 1 1 A 38 38 SER CA C 38 57.900 57.159 0.741 1
1 473 . 4 1 1 A 38 38 SER CB C 38 65.500 63.903 1.597 1
1 474 . 4 1 1 A 38 38 SER N N 38 114.300 117.923 -3.623 1
1 475 . 4 1 1 A 39 39 VAL H H 39 9.020 8.948 0.072 1
1 476 . 4 1 1 A 39 39 VAL HA H 39 4.900 5.037 -0.137 1
1 484 . 4 1 1 A 39 39 VAL C C 39 173.200 172.732 0.468 1
1 485 . 4 1 1 A 39 39 VAL CA C 39 59.200 59.514 -0.314 1
1 486 . 4 1 1 A 39 39 VAL CB C 39 34.600 34.989 -0.389 1
1 489 . 4 1 1 A 39 39 VAL N N 39 123.600 125.284 -1.684 1
1 490 . 4 1 1 A 40 40 TYR H H 40 8.900 8.690 0.210 1
1 491 . 4 1 1 A 40 40 TYR HA H 40 4.730 5.314 -0.584 1
1 498 . 4 1 1 A 40 40 TYR CA C 40 56.500 56.776 -0.276 1
1 499 . 4 1 1 A 40 40 TYR CB C 40 39.000 40.753 -1.753 1
1 504 . 4 1 1 A 40 40 TYR N N 40 126.300 127.666 -1.366 1
1 505 . 4 1 1 A 41 41 GLN H H 41 8.630 8.868 -0.238 1
1 506 . 4 1 1 A 41 41 GLN HA H 41 5.330 5.418 -0.088 1
1 513 . 4 1 1 A 41 41 GLN C C 41 175.500 175.707 -0.207 1
1 514 . 4 1 1 A 41 41 GLN CA C 41 53.800 54.204 -0.404 1
1 515 . 4 1 1 A 41 41 GLN CB C 41 32.100 32.121 -0.021 1
1 518 . 4 1 1 A 41 41 GLN N N 41 122.000 121.645 0.355 1
1 520 . 4 1 1 A 42 42 GLY H H 42 8.560 7.944 0.616 1
1 521 . 4 1 1 A 42 42 GLY HA2 H 42 3.680 4.428 -0.748 1
1 522 . 4 1 1 A 42 42 GLY HA3 H 42 4.020 4.523 -0.503 1
1 523 . 4 1 1 A 42 42 GLY C C 42 171.600 171.120 0.480 1
1 524 . 4 1 1 A 42 42 GLY CA C 42 47.300 46.203 1.097 1
1 525 . 4 1 1 A 42 42 GLY N N 42 113.000 108.930 4.070 1
1 526 . 4 1 1 A 43 43 TYR H H 43 9.320 8.725 0.595 1
1 527 . 4 1 1 A 43 43 TYR HA H 43 5.280 5.511 -0.231 1
1 534 . 4 1 1 A 43 43 TYR C C 43 173.200 174.145 -0.945 1
1 535 . 4 1 1 A 43 43 TYR CA C 43 57.600 56.573 1.027 1
1 536 . 4 1 1 A 43 43 TYR CB C 43 42.400 43.254 -0.854 1
1 541 . 4 1 1 A 43 43 TYR N N 43 126.300 118.806 7.494 1
1 542 . 4 1 1 A 44 44 ILE H H 44 9.160 8.878 0.282 1
1 543 . 4 1 1 A 44 44 ILE HA H 44 5.270 5.423 -0.153 1
1 553 . 4 1 1 A 44 44 ILE C C 44 172.900 173.218 -0.318 1
1 554 . 4 1 1 A 44 44 ILE CA C 44 59.000 59.618 -0.618 1
1 555 . 4 1 1 A 44 44 ILE CB C 44 42.200 42.113 0.087 1
1 559 . 4 1 1 A 44 44 ILE N N 44 117.700 122.070 -4.370 1
1 560 . 4 1 1 A 45 45 GLU H H 45 8.420 8.769 -0.349 1
1 561 . 4 1 1 A 45 45 GLU HA H 45 5.600 5.451 0.149 1
1 566 . 4 1 1 A 45 45 GLU C C 45 174.300 174.449 -0.149 1
1 567 . 4 1 1 A 45 45 GLU CA C 45 54.000 54.608 -0.608 1
1 568 . 4 1 1 A 45 45 GLU CB C 45 34.400 33.683 0.717 1
1 570 . 4 1 1 A 45 45 GLU N N 45 123.600 128.428 -4.828 1
1 571 . 4 1 1 A 46 46 ASP H H 46 8.530 8.525 0.005 1
1 572 . 4 1 1 A 46 46 ASP HA H 46 5.070 4.920 0.150 1
1 575 . 4 1 1 A 46 46 ASP C C 46 175.000 174.861 0.139 1
1 576 . 4 1 1 A 46 46 ASP CA C 46 51.800 52.914 -1.114 1
1 577 . 4 1 1 A 46 46 ASP CB C 46 41.300 43.712 -2.412 1
1 578 . 4 1 1 A 46 46 ASP N N 46 125.500 124.610 0.890 1
1 579 . 4 1 1 A 47 47 ASP H H 47 9.160 8.796 0.364 1
1 580 . 4 1 1 A 47 47 ASP HA H 47 4.430 4.636 -0.206 1
1 583 . 4 1 1 A 47 47 ASP C C 47 176.000 177.220 -1.220 1
1 584 . 4 1 1 A 47 47 ASP CA C 47 55.000 55.850 -0.850 1
1 585 . 4 1 1 A 47 47 ASP CB C 47 38.900 40.716 -1.816 1
1 586 . 4 1 1 A 47 47 ASP N N 47 114.200 120.958 -6.758 1
1 587 . 4 1 1 A 48 48 THR H H 48 9.470 7.799 1.671 1
1 588 . 4 1 1 A 48 48 THR HA H 48 4.520 4.567 -0.047 1
1 593 . 4 1 1 A 48 48 THR C C 48 174.500 174.078 0.422 1
1 594 . 4 1 1 A 48 48 THR CA C 48 62.600 61.948 0.652 1
1 595 . 4 1 1 A 48 48 THR CB C 48 70.400 69.365 1.035 1
1 597 . 4 1 1 A 48 48 THR N N 48 111.800 108.354 3.446 1
1 598 . 4 1 1 A 49 49 ALA H H 49 7.850 7.822 0.028 1
1 599 . 4 1 1 A 49 49 ALA HA H 49 4.440 4.541 -0.101 1
1 603 . 4 1 1 A 49 49 ALA C C 49 173.200 175.641 -2.441 1
1 604 . 4 1 1 A 49 49 ALA CA C 49 52.700 50.795 1.905 1
1 605 . 4 1 1 A 49 49 ALA CB C 49 21.300 20.947 0.353 1
1 606 . 4 1 1 A 49 49 ALA N N 49 123.400 121.437 1.963 1
1 607 . 4 1 1 A 50 50 ARG H H 50 8.160 8.982 -0.822 1
1 608 . 4 1 1 A 50 50 ARG HA H 50 5.350 5.634 -0.284 1
1 616 . 4 1 1 A 50 50 ARG C C 50 174.700 174.362 0.338 1
1 617 . 4 1 1 A 50 50 ARG CA C 50 54.000 54.467 -0.467 1
1 618 . 4 1 1 A 50 50 ARG CB C 50 34.500 34.461 0.039 1
1 622 . 4 1 1 A 50 50 ARG N N 50 117.400 114.864 2.536 1
1 624 . 4 1 1 A 51 51 ILE H H 51 9.390 8.631 0.759 1
1 625 . 4 1 1 A 51 51 ILE HA H 51 4.790 5.020 -0.230 1
1 635 . 4 1 1 A 51 51 ILE C C 51 172.600 174.541 -1.941 1
1 636 . 4 1 1 A 51 51 ILE CA C 51 60.000 58.929 1.071 1
1 637 . 4 1 1 A 51 51 ILE CB C 51 42.800 41.792 1.008 1
1 641 . 4 1 1 A 51 51 ILE N N 51 124.600 120.862 3.738 1
1 642 . 4 1 1 A 52 52 ARG H H 52 7.980 8.243 -0.263 1
1 643 . 4 1 1 A 52 52 ARG HA H 52 4.170 4.409 -0.239 1
1 651 . 4 1 1 A 52 52 ARG C C 52 174.600 176.324 -1.724 1
1 652 . 4 1 1 A 52 52 ARG CA C 52 57.100 56.008 1.092 1
1 653 . 4 1 1 A 52 52 ARG CB C 52 31.300 30.686 0.614 1
1 657 . 4 1 1 A 52 52 ARG N N 52 125.900 124.888 1.012 1
1 659 . 4 1 1 A 53 53 ILE H H 53 8.290 8.478 -0.188 1
1 660 . 4 1 1 A 53 53 ILE HA H 53 5.160 5.301 -0.141 1
1 670 . 4 1 1 A 53 53 ILE C C 53 172.400 174.646 -2.246 1
1 671 . 4 1 1 A 53 53 ILE CA C 53 58.600 59.076 -0.476 1
1 672 . 4 1 1 A 53 53 ILE CB C 53 41.900 42.504 -0.604 1
1 676 . 4 1 1 A 53 53 ILE N N 53 118.500 119.454 -0.954 1
1 677 . 4 1 1 A 54 54 SER H H 54 8.350 9.031 -0.681 1
1 678 . 4 1 1 A 54 54 SER HA H 54 5.070 5.406 -0.336 1
1 681 . 4 1 1 A 54 54 SER C C 54 172.400 172.965 -0.565 1
1 682 . 4 1 1 A 54 54 SER CA C 54 57.000 57.035 -0.035 1
1 683 . 4 1 1 A 54 54 SER CB C 54 65.900 65.995 -0.095 1
1 684 . 4 1 1 A 54 54 SER N N 54 120.700 118.951 1.749 1
1 685 . 4 1 1 A 55 55 SER H H 55 9.130 9.372 -0.242 1
1 686 . 4 1 1 A 55 55 SER HA H 55 5.270 5.475 -0.205 1
1 690 . 4 1 1 A 55 55 SER C C 55 174.400 172.790 1.610 1
1 691 . 4 1 1 A 55 55 SER CA C 55 55.500 56.682 -1.182 1
1 692 . 4 1 1 A 55 55 SER CB C 55 64.500 65.005 -0.505 1
1 693 . 4 1 1 A 55 55 SER N N 55 117.200 118.960 -1.760 1
1 694 . 4 1 1 A 56 56 PHE H H 56 8.970 8.895 0.075 1
1 695 . 4 1 1 A 56 56 PHE HA H 56 4.600 4.957 -0.357 1
1 703 . 4 1 1 A 56 56 PHE C C 56 176.500 177.341 -0.841 1
1 704 . 4 1 1 A 56 56 PHE CA C 56 58.300 57.354 0.946 1
1 705 . 4 1 1 A 56 56 PHE CB C 56 37.900 40.246 -2.346 1
1 711 . 4 1 1 A 56 56 PHE N N 56 129.400 124.589 4.811 1
1 712 . 4 1 1 A 57 57 GLY H H 57 8.570 8.730 -0.160 1
1 713 . 4 1 1 A 57 57 GLY HA2 H 57 4.020 4.043 -0.023 1
1 714 . 4 1 1 A 57 57 GLY HA3 H 57 4.380 4.047 0.333 1
1 715 . 4 1 1 A 57 57 GLY C C 57 173.700 173.636 0.064 1
1 716 . 4 1 1 A 57 57 GLY CA C 57 46.300 45.651 0.649 1
1 717 . 4 1 1 A 57 57 GLY N N 57 112.500 112.274 0.226 1
1 718 . 4 1 1 A 58 58 LYS H H 58 6.800 7.951 -1.151 1
1 719 . 4 1 1 A 58 58 LYS HA H 58 4.410 4.410 0.000 1
1 728 . 4 1 1 A 58 58 LYS C C 58 174.800 175.367 -0.567 1
1 729 . 4 1 1 A 58 58 LYS CA C 58 55.200 55.209 -0.009 1
1 730 . 4 1 1 A 58 58 LYS CB C 58 33.300 32.683 0.617 1
1 734 . 4 1 1 A 58 58 LYS N N 58 118.700 121.509 -2.809 1
1 735 . 4 1 1 A 59 59 GLN H H 59 8.390 8.736 -0.346 1
1 736 . 4 1 1 A 59 59 GLN HA H 59 1.830 4.062 -2.232 1
1 743 . 4 1 1 A 59 59 GLN C C 59 174.100 174.773 -0.673 1
1 744 . 4 1 1 A 59 59 GLN CA C 59 57.100 56.100 1.000 1
1 745 . 4 1 1 A 59 59 GLN CB C 59 28.900 29.477 -0.577 1
1 748 . 4 1 1 A 59 59 GLN N N 59 124.000 125.827 -1.827 1
1 750 . 4 1 1 A 60 60 LEU H H 60 5.320 8.265 -2.945 1
1 751 . 4 1 1 A 60 60 LEU HA H 60 4.370 4.920 -0.550 1
1 761 . 4 1 1 A 60 60 LEU CA C 60 52.800 53.461 -0.661 1
1 762 . 4 1 1 A 60 60 LEU CB C 60 46.700 45.194 1.506 1
1 766 . 4 1 1 A 60 60 LEU N N 60 121.800 124.999 -3.199 1
1 767 . 4 1 1 A 61 61 GLN H H 61 8.660 8.690 -0.030 1
1 768 . 4 1 1 A 61 61 GLN HA H 61 4.440 4.615 -0.175 1
1 775 . 4 1 1 A 61 61 GLN C C 61 174.000 175.026 -1.026 1
1 776 . 4 1 1 A 61 61 GLN CA C 61 53.800 53.916 -0.116 1
1 777 . 4 1 1 A 61 61 GLN CB C 61 31.800 31.001 0.799 1
1 780 . 4 1 1 A 61 61 GLN N N 61 120.300 120.495 -0.195 1
1 782 . 4 1 1 A 62 62 ASP H H 62 8.450 8.666 -0.216 1
1 783 . 4 1 1 A 62 62 ASP HA H 62 4.130 4.332 -0.202 1
1 786 . 4 1 1 A 62 62 ASP C C 62 177.200 176.832 0.368 1
1 787 . 4 1 1 A 62 62 ASP CA C 62 55.700 55.283 0.417 1
1 788 . 4 1 1 A 62 62 ASP CB C 62 39.400 40.817 -1.417 1
1 789 . 4 1 1 A 62 62 ASP N N 62 122.400 123.492 -1.092 1
1 790 . 4 1 1 A 63 63 SER H H 63 9.210 8.710 0.500 1
1 791 . 4 1 1 A 63 63 SER HA H 63 3.850 4.051 -0.201 1
1 794 . 4 1 1 A 63 63 SER C C 63 173.200 172.699 0.501 1
1 795 . 4 1 1 A 63 63 SER CA C 63 61.700 58.975 2.725 1
1 796 . 4 1 1 A 63 63 SER CB C 63 61.800 61.702 0.098 1
1 797 . 4 1 1 A 63 63 SER N N 63 114.300 116.728 -2.428 1
1 798 . 4 1 1 A 64 64 ASP H H 64 7.960 7.852 0.108 1
1 799 . 4 1 1 A 64 64 ASP HA H 64 4.540 5.124 -0.584 1
1 802 . 4 1 1 A 64 64 ASP C C 64 174.900 175.026 -0.126 1
1 803 . 4 1 1 A 64 64 ASP CA C 64 54.900 53.291 1.609 1
1 804 . 4 1 1 A 64 64 ASP CB C 64 40.900 44.649 -3.749 1
1 805 . 4 1 1 A 64 64 ASP N N 64 122.600 119.577 3.023 1
1 806 . 4 1 1 A 65 65 VAL H H 65 8.180 8.770 -0.590 1
1 807 . 4 1 1 A 65 65 VAL HA H 65 4.670 4.596 0.074 1
1 815 . 4 1 1 A 65 65 VAL C C 65 175.900 175.691 0.209 1
1 816 . 4 1 1 A 65 65 VAL CA C 65 62.300 62.717 -0.417 1
1 817 . 4 1 1 A 65 65 VAL CB C 65 31.700 31.213 0.487 1
1 820 . 4 1 1 A 65 65 VAL N N 65 123.100 124.711 -1.611 1
1 821 . 4 1 1 A 66 66 VAL H H 66 8.770 8.828 -0.058 1
1 822 . 4 1 1 A 66 66 VAL HA H 66 5.160 5.095 0.065 1
1 830 . 4 1 1 A 66 66 VAL C C 66 173.600 173.340 0.260 1
1 831 . 4 1 1 A 66 66 VAL CA C 66 58.100 58.793 -0.693 1
1 832 . 4 1 1 A 66 66 VAL CB C 66 35.700 35.863 -0.163 1
1 835 . 4 1 1 A 66 66 VAL N N 66 118.100 121.181 -3.081 1
1 836 . 4 1 1 A 67 67 ARG H H 67 8.880 8.944 -0.064 1
1 837 . 4 1 1 A 67 67 ARG HA H 67 5.110 5.104 0.006 1
1 845 . 4 1 1 A 67 67 ARG C C 67 175.300 174.588 0.712 1
1 846 . 4 1 1 A 67 67 ARG CA C 67 54.200 54.342 -0.142 1
1 847 . 4 1 1 A 67 67 ARG CB C 67 32.200 33.618 -1.418 1
1 851 . 4 1 1 A 67 67 ARG N N 67 120.200 121.891 -1.691 1
1 853 . 4 1 1 A 68 68 ILE H H 68 9.220 9.152 0.068 1
1 854 . 4 1 1 A 68 68 ILE HA H 68 4.990 4.629 0.361 1
1 864 . 4 1 1 A 68 68 ILE C C 68 174.900 174.660 0.240 1
1 865 . 4 1 1 A 68 68 ILE CA C 68 58.600 59.727 -1.127 1
1 866 . 4 1 1 A 68 68 ILE CB C 68 39.300 38.887 0.413 1
1 870 . 4 1 1 A 68 68 ILE N N 68 127.200 128.217 -1.017 1
1 871 . 4 1 1 A 69 69 ASP H H 69 9.110 9.007 0.103 1
1 872 . 4 1 1 A 69 69 ASP HA H 69 5.370 5.051 0.319 1
1 875 . 4 1 1 A 69 69 ASP C C 69 175.800 176.546 -0.746 1
1 876 . 4 1 1 A 69 69 ASP CA C 69 52.400 52.693 -0.293 1
1 877 . 4 1 1 A 69 69 ASP CB C 69 43.700 42.878 0.822 1
1 878 . 4 1 1 A 69 69 ASP N N 69 123.400 125.937 -2.537 1
1 879 . 4 1 1 A 70 70 ASN H H 70 8.300 9.116 -0.816 1
1 880 . 4 1 1 A 70 70 ASN HA H 70 4.160 4.405 -0.245 1
1 885 . 4 1 1 A 70 70 ASN C C 70 176.300 174.638 1.662 1
1 886 . 4 1 1 A 70 70 ASN CA C 70 54.300 54.170 0.130 1
1 887 . 4 1 1 A 70 70 ASN CB C 70 37.500 37.398 0.102 1
1 889 . 4 1 1 A 70 70 ASN N N 70 119.800 121.197 -1.397 1
1 891 . 4 1 1 A 71 71 ALA H H 71 9.100 7.852 1.248 1
1 892 . 4 1 1 A 71 71 ALA HA H 71 4.500 4.477 0.023 1
1 896 . 4 1 1 A 71 71 ALA C C 71 175.700 176.435 -0.735 1
1 897 . 4 1 1 A 71 71 ALA CA C 71 51.900 53.024 -1.124 1
1 898 . 4 1 1 A 71 71 ALA CB C 71 19.600 19.954 -0.354 1
1 899 . 4 1 1 A 71 71 ALA N N 71 123.000 121.066 1.934 1
1 900 . 4 1 1 A 72 72 ARG H H 72 8.490 8.608 -0.118 1
1 901 . 4 1 1 A 72 72 ARG HA H 72 4.720 4.918 -0.198 1
1 909 . 4 1 1 A 72 72 ARG C C 72 175.800 174.842 0.958 1
1 910 . 4 1 1 A 72 72 ARG CA C 72 54.400 54.840 -0.440 1
1 911 . 4 1 1 A 72 72 ARG CB C 72 32.700 32.348 0.352 1
1 915 . 4 1 1 A 72 72 ARG N N 72 122.500 122.851 -0.351 1
1 917 . 4 1 1 A 73 73 VAL H H 73 8.310 8.198 0.112 1
1 918 . 4 1 1 A 73 73 VAL HA H 73 4.250 4.536 -0.286 1
1 926 . 4 1 1 A 73 73 VAL C C 73 174.600 175.591 -0.991 1
1 927 . 4 1 1 A 73 73 VAL CA C 73 62.800 62.002 0.798 1
1 928 . 4 1 1 A 73 73 VAL CB C 73 32.100 31.970 0.130 1
1 931 . 4 1 1 A 73 73 VAL N N 73 127.100 127.159 -0.059 1
1 932 . 4 1 1 A 74 74 ALA H H 74 8.880 8.794 0.086 1
1 933 . 4 1 1 A 74 74 ALA HA H 74 4.500 4.937 -0.437 1
1 937 . 4 1 1 A 74 74 ALA C C 74 174.800 174.661 0.139 1
1 938 . 4 1 1 A 74 74 ALA CA C 74 50.500 50.572 -0.072 1
1 939 . 4 1 1 A 74 74 ALA CB C 74 22.500 23.419 -0.919 1
1 940 . 4 1 1 A 74 74 ALA N N 74 131.000 128.334 2.666 1
1 941 . 4 1 1 A 75 75 GLN H H 75 8.280 8.379 -0.099 1
1 942 . 4 1 1 A 75 75 GLN HA H 75 4.910 5.031 -0.121 1
1 949 . 4 1 1 A 75 75 GLN C C 75 175.100 174.327 0.773 1
1 950 . 4 1 1 A 75 75 GLN CA C 75 54.600 54.139 0.461 1
1 951 . 4 1 1 A 75 75 GLN CB C 75 31.400 31.578 -0.178 1
1 954 . 4 1 1 A 75 75 GLN N N 75 118.800 120.238 -1.438 1
1 956 . 4 1 1 A 76 76 PHE H H 76 8.710 9.184 -0.474 1
1 957 . 4 1 1 A 76 76 PHE HA H 76 4.660 4.978 -0.318 1
1 965 . 4 1 1 A 76 76 PHE C C 76 174.900 176.087 -1.187 1
1 966 . 4 1 1 A 76 76 PHE CA C 76 57.000 56.615 0.385 1
1 967 . 4 1 1 A 76 76 PHE CB C 76 41.000 42.131 -1.131 1
1 973 . 4 1 1 A 76 76 PHE N N 76 125.000 125.217 -0.217 1
1 974 . 4 1 1 A 77 77 ASN H H 77 9.040 9.577 -0.537 1
1 975 . 4 1 1 A 77 77 ASN HA H 77 4.170 4.499 -0.329 1
1 980 . 4 1 1 A 77 77 ASN C C 77 174.200 174.830 -0.630 1
1 981 . 4 1 1 A 77 77 ASN CA C 77 53.800 54.171 -0.371 1
1 982 . 4 1 1 A 77 77 ASN CB C 77 37.400 37.616 -0.216 1
1 984 . 4 1 1 A 77 77 ASN N N 77 123.200 122.843 0.357 1
1 986 . 4 1 1 A 78 78 GLY H H 78 8.370 8.600 -0.230 1
1 987 . 4 1 1 A 78 78 GLY HA2 H 78 3.410 3.586 -0.176 1
1 988 . 4 1 1 A 78 78 GLY HA3 H 78 3.980 3.691 0.289 1
1 989 . 4 1 1 A 78 78 GLY C C 78 173.800 173.056 0.744 1
1 990 . 4 1 1 A 78 78 GLY CA C 78 45.000 45.256 -0.256 1
1 991 . 4 1 1 A 78 78 GLY N N 78 103.300 104.197 -0.897 1
1 992 . 4 1 1 A 79 79 TYR H H 79 7.670 8.253 -0.583 1
1 993 . 4 1 1 A 79 79 TYR HA H 79 4.860 4.949 -0.089 1
1 1000 . 4 1 1 A 79 79 TYR C C 79 174.800 175.653 -0.853 1
1 1001 . 4 1 1 A 79 79 TYR CA C 79 56.300 57.185 -0.885 1
1 1002 . 4 1 1 A 79 79 TYR CB C 79 40.800 41.246 -0.446 1
1 1007 . 4 1 1 A 79 79 TYR N N 79 118.700 118.972 -0.272 1
1 1008 . 4 1 1 A 80 80 LEU H H 80 8.760 8.690 0.070 1
1 1009 . 4 1 1 A 80 80 LEU HA H 80 4.830 4.393 0.437 1
1 1019 . 4 1 1 A 80 80 LEU C C 80 176.200 176.283 -0.083 1
1 1020 . 4 1 1 A 80 80 LEU CA C 80 54.700 55.113 -0.413 1
1 1021 . 4 1 1 A 80 80 LEU CB C 80 43.500 42.553 0.947 1
1 1025 . 4 1 1 A 80 80 LEU N N 80 122.600 125.521 -2.921 1
1 1026 . 4 1 1 A 81 81 SER H H 81 8.650 8.802 -0.152 1
1 1027 . 4 1 1 A 81 81 SER HA H 81 4.860 5.326 -0.466 1
1 1030 . 4 1 1 A 81 81 SER C C 81 172.600 172.386 0.214 1
1 1031 . 4 1 1 A 81 81 SER CA C 81 56.600 57.288 -0.688 1
1 1032 . 4 1 1 A 81 81 SER CB C 81 66.300 66.503 -0.203 1
1 1033 . 4 1 1 A 81 81 SER N N 81 114.700 117.227 -2.527 1
1 1034 . 4 1 1 A 82 82 LEU H H 82 8.680 8.709 -0.029 1
1 1035 . 4 1 1 A 82 82 LEU HA H 82 5.190 5.101 0.089 1
1 1045 . 4 1 1 A 82 82 LEU C C 82 177.100 175.800 1.300 1
1 1046 . 4 1 1 A 82 82 LEU CA C 82 53.300 53.794 -0.494 1
1 1047 . 4 1 1 A 82 82 LEU CB C 82 43.800 43.422 0.378 1
1 1051 . 4 1 1 A 82 82 LEU N N 82 119.800 122.452 -2.652 1
1 1052 . 4 1 1 A 83 83 SER H H 83 9.560 9.580 -0.020 1
1 1053 . 4 1 1 A 83 83 SER HA H 83 5.390 5.819 -0.429 1
1 1056 . 4 1 1 A 83 83 SER C C 83 174.200 173.544 0.656 1
1 1057 . 4 1 1 A 83 83 SER CA C 83 57.100 56.596 0.504 1
1 1058 . 4 1 1 A 83 83 SER CB C 83 64.400 65.376 -0.976 1
1 1059 . 4 1 1 A 83 83 SER N N 83 119.000 119.038 -0.038 1
1 1060 . 4 1 1 A 84 84 VAL H H 84 9.150 9.159 -0.009 1
1 1061 . 4 1 1 A 84 84 VAL HA H 84 4.490 4.742 -0.252 1
1 1069 . 4 1 1 A 84 84 VAL C C 84 174.700 176.268 -1.568 1
1 1070 . 4 1 1 A 84 84 VAL CA C 84 61.300 61.276 0.024 1
1 1071 . 4 1 1 A 84 84 VAL CB C 84 33.000 32.591 0.409 1
1 1074 . 4 1 1 A 84 84 VAL N N 84 128.300 125.209 3.091 1
1 1075 . 4 1 1 A 85 85 GLY H H 85 7.970 8.764 -0.794 1
1 1076 . 4 1 1 A 85 85 GLY HA2 H 85 4.030 4.182 -0.152 1
1 1077 . 4 1 1 A 85 85 GLY HA3 H 85 4.840 4.218 0.622 1
1 1078 . 4 1 1 A 85 85 GLY C C 85 175.800 174.609 1.191 1
1 1079 . 4 1 1 A 85 85 GLY CA C 85 44.800 44.436 0.364 1
1 1080 . 4 1 1 A 85 85 GLY N N 85 114.300 115.122 -0.822 1
1 1081 . 4 1 1 A 86 86 ASP H H 86 8.860 8.921 -0.061 1
1 1082 . 4 1 1 A 86 86 ASP HA H 86 4.370 4.489 -0.119 1
1 1085 . 4 1 1 A 86 86 ASP C C 86 177.400 177.210 0.190 1
1 1086 . 4 1 1 A 86 86 ASP CA C 86 57.400 56.377 1.023 1
1 1087 . 4 1 1 A 86 86 ASP CB C 86 40.600 40.251 0.349 1
1 1088 . 4 1 1 A 86 86 ASP N N 86 122.500 120.255 2.245 1
1 1089 . 4 1 1 A 87 87 SER H H 87 8.540 7.773 0.767 1
1 1090 . 4 1 1 A 87 87 SER HA H 87 4.620 4.487 0.133 1
1 1093 . 4 1 1 A 87 87 SER C C 87 174.700 174.223 0.477 1
1 1094 . 4 1 1 A 87 87 SER CA C 87 58.200 58.875 -0.675 1
1 1095 . 4 1 1 A 87 87 SER CB C 87 63.300 63.761 -0.461 1
1 1096 . 4 1 1 A 87 87 SER N N 87 112.100 113.426 -1.326 1
1 1097 . 4 1 1 A 88 88 SER H H 88 7.880 7.457 0.423 1
1 1098 . 4 1 1 A 88 88 SER HA H 88 5.050 4.530 0.520 1
1 1101 . 4 1 1 A 88 88 SER C C 88 172.700 173.723 -1.023 1
1 1102 . 4 1 1 A 88 88 SER CA C 88 57.600 58.031 -0.431 1
1 1103 . 4 1 1 A 88 88 SER CB C 88 64.300 64.566 -0.266 1
1 1104 . 4 1 1 A 88 88 SER N N 88 119.200 117.572 1.628 1
1 1105 . 4 1 1 A 89 89 ARG H H 89 8.350 8.315 0.035 1
1 1106 . 4 1 1 A 89 89 ARG HA H 89 4.720 5.287 -0.567 1
1 1114 . 4 1 1 A 89 89 ARG C C 89 174.200 174.750 -0.550 1
1 1115 . 4 1 1 A 89 89 ARG CA C 89 55.000 54.402 0.598 1
1 1116 . 4 1 1 A 89 89 ARG CB C 89 33.500 34.396 -0.896 1
1 1120 . 4 1 1 A 89 89 ARG N N 89 122.800 122.321 0.479 1
1 1122 . 4 1 1 A 90 90 ILE H H 90 8.530 9.055 -0.525 1
1 1123 . 4 1 1 A 90 90 ILE HA H 90 4.790 4.975 -0.185 1
1 1133 . 4 1 1 A 90 90 ILE C C 90 175.400 175.144 0.256 1
1 1134 . 4 1 1 A 90 90 ILE CA C 90 60.600 60.164 0.436 1
1 1135 . 4 1 1 A 90 90 ILE CB C 90 40.600 40.675 -0.075 1
1 1139 . 4 1 1 A 90 90 ILE N N 90 123.100 123.054 0.046 1
1 1140 . 4 1 1 A 91 91 GLU H H 91 9.000 9.151 -0.151 1
1 1141 . 4 1 1 A 91 91 GLU HA H 91 4.730 4.912 -0.182 1
1 1146 . 4 1 1 A 91 91 GLU C C 91 175.100 175.731 -0.631 1
1 1147 . 4 1 1 A 91 91 GLU CA C 91 54.300 54.578 -0.278 1
1 1148 . 4 1 1 A 91 91 GLU CB C 91 32.400 32.036 0.364 1
1 1150 . 4 1 1 A 91 91 GLU N N 91 126.400 127.072 -0.672 1
1 1151 . 4 1 1 A 92 92 SER H H 92 8.830 8.891 -0.061 1
1 1152 . 4 1 1 A 92 92 SER HA H 92 4.700 4.670 0.030 1
1 1155 . 4 1 1 A 92 92 SER C C 92 174.600 173.867 0.733 1
1 1156 . 4 1 1 A 92 92 SER CA C 92 59.300 58.809 0.491 1
1 1157 . 4 1 1 A 92 92 SER CB C 92 63.100 63.790 -0.690 1
1 1158 . 4 1 1 A 92 92 SER N N 92 119.800 121.567 -1.767 1
1 1159 . 4 1 1 A 93 93 VAL H H 93 8.350 8.416 -0.066 1
1 1160 . 4 1 1 A 93 93 VAL HA H 93 4.290 4.582 -0.292 1
1 1168 . 4 1 1 A 93 93 VAL C C 93 175.100 175.800 -0.700 1
1 1169 . 4 1 1 A 93 93 VAL CA C 93 61.300 61.272 0.028 1
1 1170 . 4 1 1 A 93 93 VAL CB C 93 33.900 32.043 1.857 1
1 1173 . 4 1 1 A 93 93 VAL N N 93 121.800 124.357 -2.557 1
1 1174 . 4 1 1 A 94 94 ASN H H 94 8.510 8.544 -0.034 1
1 1175 . 4 1 1 A 94 94 ASN HA H 94 4.770 4.821 -0.051 1
1 1180 . 4 1 1 A 94 94 ASN C C 94 175.000 173.711 1.289 1
1 1181 . 4 1 1 A 94 94 ASN CA C 94 52.700 53.640 -0.940 1
1 1182 . 4 1 1 A 94 94 ASN CB C 94 38.500 39.069 -0.569 1
1 1184 . 4 1 1 A 94 94 ASN N N 94 121.800 123.372 -1.572 1
1 1186 . 4 1 1 A 95 95 VAL H H 95 7.860 7.570 0.290 1
1 1187 . 4 1 1 A 95 95 VAL HA H 95 4.100 4.517 -0.417 1
1 1195 . 4 1 1 A 95 95 VAL C C 95 175.100 175.565 -0.465 1
1 1196 . 4 1 1 A 95 95 VAL CA C 95 61.700 61.051 0.649 1
1 1197 . 4 1 1 A 95 95 VAL CB C 95 33.100 34.691 -1.591 1
1 1200 . 4 1 1 A 95 95 VAL N N 95 119.700 119.954 -0.254 1
1 1201 . 4 1 1 A 96 96 ASN H H 96 8.490 8.665 -0.175 1
1 1202 . 4 1 1 A 96 96 ASN HA H 96 4.700 4.905 -0.205 1
1 1207 . 4 1 1 A 96 96 ASN C C 96 174.600 174.731 -0.131 1
1 1208 . 4 1 1 A 96 96 ASN CA C 96 53.000 52.899 0.101 1
1 1209 . 4 1 1 A 96 96 ASN CB C 96 39.000 38.032 0.968 1
1 1211 . 4 1 1 A 96 96 ASN N N 96 122.200 122.282 -0.082 1
1 1213 . 4 1 1 A 97 97 ILE H H 97 8.080 7.763 0.317 1
1 1214 . 4 1 1 A 97 97 ILE HA H 97 4.370 4.667 -0.297 1
1 1224 . 4 1 1 A 97 97 ILE CA C 97 58.600 58.481 0.119 1
1 1225 . 4 1 1 A 97 97 ILE CB C 97 38.600 39.001 -0.401 1
1 1229 . 4 1 1 A 97 97 ILE N N 97 123.500 119.678 3.822 1
1 1230 . 4 1 1 A 98 98 PRO HA H 98 4.360 4.498 -0.138 1
1 1237 . 4 1 1 A 98 98 PRO C C 98 176.600 176.205 0.395 1
1 1238 . 4 1 1 A 98 98 PRO CA C 98 63.100 63.602 -0.502 1
1 1239 . 4 1 1 A 98 98 PRO CB C 98 31.800 32.283 -0.483 1
1 1242 . 4 1 1 A 99 99 LEU H H 99 8.200 7.448 0.752 1
1 1243 . 4 1 1 A 99 99 LEU HA H 99 4.200 4.218 -0.018 1
1 1253 . 4 1 1 A 99 99 LEU C C 99 177.300 176.957 0.343 1
1 1254 . 4 1 1 A 99 99 LEU CA C 99 55.000 54.860 0.140 1
1 1255 . 4 1 1 A 99 99 LEU CB C 99 42.400 42.408 -0.008 1
1 1259 . 4 1 1 A 99 99 LEU N N 99 122.500 121.644 0.856 1
1 1260 . 4 1 1 A 100 100 GLU H H 100 8.250 9.049 -0.799 1
1 1261 . 4 1 1 A 100 100 GLU HA H 100 4.140 4.193 -0.053 1
1 1266 . 4 1 1 A 100 100 GLU C C 100 176.100 176.170 -0.070 1
1 1267 . 4 1 1 A 100 100 GLU CA C 100 56.100 58.259 -2.159 1
1 1268 . 4 1 1 A 100 100 GLU CB C 100 29.900 29.223 0.677 1
1 1270 . 4 1 1 A 100 100 GLU N N 100 121.000 123.213 -2.213 1
1 1271 . 4 1 1 A 101 101 HIS H H 101 8.540 8.812 -0.272 1
1 1272 . 4 1 1 A 101 101 HIS HA H 101 4.600 4.247 0.353 1
1 1275 . 4 1 1 A 101 101 HIS C C 101 174.200 173.990 0.210 1
1 1276 . 4 1 1 A 101 101 HIS CA C 101 55.200 58.731 -3.531 1
1 1277 . 4 1 1 A 101 101 HIS CB C 101 29.000 28.377 0.623 1
1 1278 . 4 1 1 A 101 101 HIS N N 101 119.400 120.088 -0.688 1
1 1279 . 4 1 1 A 102 102 HIS H H 102 8.660 7.651 1.009 1
1 1280 . 4 1 1 A 102 102 HIS HA H 102 4.630 4.867 -0.237 1
1 1283 . 4 1 1 A 102 102 HIS C C 102 174.200 172.691 1.509 1
1 1284 . 4 1 1 A 102 102 HIS CA C 102 55.200 54.461 0.739 1
1 1285 . 4 1 1 A 102 102 HIS CB C 102 29.100 31.832 -2.732 1
1 1286 . 4 1 1 A 102 102 HIS N N 102 119.700 112.691 7.009 1
1 1287 . 4 1 1 A 103 103 HIS H H 103 8.680 8.376 0.304 1
1 1288 . 4 1 1 A 103 103 HIS HA H 103 4.640 4.835 -0.195 1
1 1291 . 4 1 1 A 103 103 HIS C C 103 174.200 175.875 -1.675 1
1 1292 . 4 1 1 A 103 103 HIS CA C 103 55.200 54.662 0.538 1
1 1293 . 4 1 1 A 103 103 HIS CB C 103 29.200 31.078 -1.878 1
1 1294 . 4 1 1 A 103 103 HIS N N 103 120.500 118.535 1.965 1
1 1295 . 4 1 1 A 104 104 HIS H H 104 8.580 8.754 -0.174 1
1 1296 . 4 1 1 A 104 104 HIS HA H 104 4.590 4.054 0.536 1
1 1299 . 4 1 1 A 104 104 HIS C C 104 174.200 175.297 -1.097 1
1 1300 . 4 1 1 A 104 104 HIS CA C 104 55.200 59.656 -4.456 1
1 1301 . 4 1 1 A 104 104 HIS CB C 104 29.300 29.976 -0.676 1
1 1302 . 4 1 1 A 104 104 HIS N N 104 120.700 120.487 0.213 1
1 1303 . 4 1 1 A 105 105 HIS H H 105 8.550 7.702 0.848 1
1 1304 . 4 1 1 A 105 105 HIS HA H 105 4.610 4.261 0.349 1
1 1307 . 4 1 1 A 105 105 HIS C C 105 173.500 176.389 -2.889 1
1 1308 . 4 1 1 A 105 105 HIS CA C 105 55.400 56.636 -1.236 1
1 1309 . 4 1 1 A 105 105 HIS CB C 105 28.800 30.286 -1.486 1
1 1310 . 4 1 1 A 105 105 HIS N N 105 119.000 116.561 2.439 1
1 7 . 5 1 1 A 2 2 ASP H H 2 8.890 8.932 -0.042 1
1 8 . 5 1 1 A 2 2 ASP HA H 2 4.740 5.256 -0.516 1
1 11 . 5 1 1 A 2 2 ASP C C 2 174.600 174.280 0.320 1
1 12 . 5 1 1 A 2 2 ASP CA C 2 53.800 53.302 0.498 1
1 13 . 5 1 1 A 2 2 ASP CB C 2 41.500 44.295 -2.795 1
1 14 . 5 1 1 A 2 2 ASP N N 2 122.100 118.178 3.922 1
1 15 . 5 1 1 A 3 3 LEU H H 3 8.280 8.483 -0.203 1
1 16 . 5 1 1 A 3 3 LEU HA H 3 4.420 4.835 -0.415 1
1 26 . 5 1 1 A 3 3 LEU C C 3 176.900 176.189 0.711 1
1 27 . 5 1 1 A 3 3 LEU CA C 3 55.000 54.159 0.841 1
1 28 . 5 1 1 A 3 3 LEU CB C 3 42.700 42.740 -0.040 1
1 32 . 5 1 1 A 3 3 LEU N N 3 122.300 122.512 -0.212 1
1 33 . 5 1 1 A 4 4 VAL H H 4 8.640 8.674 -0.034 1
1 34 . 5 1 1 A 4 4 VAL HA H 4 4.540 4.993 -0.453 1
1 42 . 5 1 1 A 4 4 VAL C C 4 175.800 174.985 0.815 1
1 43 . 5 1 1 A 4 4 VAL CA C 4 59.400 58.648 0.752 1
1 44 . 5 1 1 A 4 4 VAL CB C 4 35.400 35.828 -0.428 1
1 47 . 5 1 1 A 4 4 VAL N N 4 122.600 117.698 4.902 1
1 48 . 5 1 1 A 5 5 LYS H H 5 8.630 8.755 -0.125 1
1 49 . 5 1 1 A 5 5 LYS HA H 5 4.450 4.494 -0.044 1
1 58 . 5 1 1 A 5 5 LYS C C 5 179.400 178.532 0.868 1
1 59 . 5 1 1 A 5 5 LYS CA C 5 53.600 55.412 -1.812 1
1 60 . 5 1 1 A 5 5 LYS CB C 5 30.900 33.301 -2.401 1
1 64 . 5 1 1 A 5 5 LYS N N 5 121.100 121.619 -0.519 1
1 65 . 5 1 1 A 6 6 ILE H H 6 10.320 8.869 1.451 1
1 66 . 5 1 1 A 6 6 ILE HA H 6 3.440 3.712 -0.272 1
1 76 . 5 1 1 A 6 6 ILE C C 6 178.300 177.981 0.319 1
1 77 . 5 1 1 A 6 6 ILE CA C 6 65.700 65.078 0.622 1
1 78 . 5 1 1 A 6 6 ILE CB C 6 35.900 37.676 -1.776 1
1 82 . 5 1 1 A 6 6 ILE N N 6 125.400 122.853 2.547 1
1 83 . 5 1 1 A 7 7 ARG H H 7 8.210 7.525 0.685 1
1 84 . 5 1 1 A 7 7 ARG HA H 7 3.850 4.071 -0.221 1
1 92 . 5 1 1 A 7 7 ARG C C 7 175.600 177.607 -2.007 1
1 93 . 5 1 1 A 7 7 ARG CA C 7 57.800 58.943 -1.143 1
1 94 . 5 1 1 A 7 7 ARG CB C 7 30.300 29.829 0.471 1
1 98 . 5 1 1 A 7 7 ARG N N 7 118.800 121.358 -2.558 1
1 100 . 5 1 1 A 8 8 ASP H H 8 7.850 7.748 0.102 1
1 101 . 5 1 1 A 8 8 ASP HA H 8 4.700 4.683 0.017 1
1 104 . 5 1 1 A 8 8 ASP C C 8 176.100 176.454 -0.354 1
1 105 . 5 1 1 A 8 8 ASP CA C 8 54.100 54.577 -0.477 1
1 106 . 5 1 1 A 8 8 ASP CB C 8 41.200 41.289 -0.089 1
1 107 . 5 1 1 A 8 8 ASP N N 8 116.800 117.425 -0.625 1
1 108 . 5 1 1 A 9 9 VAL H H 9 7.240 7.414 -0.174 1
1 109 . 5 1 1 A 9 9 VAL HA H 9 3.710 3.966 -0.256 1
1 117 . 5 1 1 A 9 9 VAL C C 9 174.900 176.217 -1.317 1
1 118 . 5 1 1 A 9 9 VAL CA C 9 64.300 63.323 0.977 1
1 119 . 5 1 1 A 9 9 VAL CB C 9 31.500 31.629 -0.129 1
1 122 . 5 1 1 A 9 9 VAL N N 9 121.800 121.937 -0.137 1
1 123 . 5 1 1 A 10 10 SER H H 10 8.600 8.562 0.038 1
1 124 . 5 1 1 A 10 10 SER HA H 10 4.600 5.013 -0.413 1
1 127 . 5 1 1 A 10 10 SER CA C 10 56.700 56.657 0.043 1
1 128 . 5 1 1 A 10 10 SER CB C 10 66.100 64.496 1.604 1
1 129 . 5 1 1 A 10 10 SER N N 10 122.200 119.842 2.358 1
1 130 . 5 1 1 A 11 11 LEU H H 11 8.660 8.945 -0.285 1
1 131 . 5 1 1 A 11 11 LEU HA H 11 3.900 4.119 -0.219 1
1 141 . 5 1 1 A 11 11 LEU C C 11 178.100 178.528 -0.428 1
1 142 . 5 1 1 A 11 11 LEU CA C 11 56.700 56.632 0.068 1
1 143 . 5 1 1 A 11 11 LEU CB C 11 41.400 41.481 -0.081 1
1 147 . 5 1 1 A 11 11 LEU N N 11 120.300 127.031 -6.731 1
1 148 . 5 1 1 A 12 12 SER H H 12 8.160 8.069 0.091 1
1 149 . 5 1 1 A 12 12 SER HA H 12 4.270 4.288 -0.018 1
1 152 . 5 1 1 A 12 12 SER C C 12 174.200 174.715 -0.515 1
1 153 . 5 1 1 A 12 12 SER CA C 12 59.900 62.095 -2.195 1
1 154 . 5 1 1 A 12 12 SER CB C 12 63.100 63.376 -0.276 1
1 155 . 5 1 1 A 12 12 SER N N 12 112.100 113.956 -1.856 1
1 156 . 5 1 1 A 13 13 THR H H 13 7.460 7.385 0.075 1
1 157 . 5 1 1 A 13 13 THR HA H 13 4.760 4.722 0.038 1
1 162 . 5 1 1 A 13 13 THR CA C 13 56.600 58.331 -1.731 1
1 163 . 5 1 1 A 13 13 THR CB C 13 70.100 70.537 -0.437 1
1 165 . 5 1 1 A 13 13 THR N N 13 114.700 112.802 1.898 1
1 166 . 5 1 1 A 14 14 PRO HA H 14 4.050 4.290 -0.240 1
1 173 . 5 1 1 A 14 14 PRO C C 14 175.800 175.948 -0.148 1
1 174 . 5 1 1 A 14 14 PRO CA C 14 65.100 64.978 0.122 1
1 175 . 5 1 1 A 14 14 PRO CB C 14 32.100 31.923 0.177 1
1 178 . 5 1 1 A 15 15 TYR H H 15 7.380 7.791 -0.411 1
1 179 . 5 1 1 A 15 15 TYR HA H 15 5.570 5.674 -0.104 1
1 186 . 5 1 1 A 15 15 TYR C C 15 176.100 175.142 0.958 1
1 187 . 5 1 1 A 15 15 TYR CA C 15 56.400 56.632 -0.232 1
1 188 . 5 1 1 A 15 15 TYR CB C 15 41.500 41.647 -0.147 1
1 193 . 5 1 1 A 15 15 TYR N N 15 113.800 117.383 -3.583 1
1 194 . 5 1 1 A 16 16 VAL H H 16 9.010 8.738 0.272 1
1 195 . 5 1 1 A 16 16 VAL HA H 16 4.920 5.033 -0.113 1
1 203 . 5 1 1 A 16 16 VAL C C 16 174.300 173.476 0.824 1
1 204 . 5 1 1 A 16 16 VAL CA C 16 59.600 59.564 0.036 1
1 205 . 5 1 1 A 16 16 VAL CB C 16 36.800 36.424 0.376 1
1 208 . 5 1 1 A 16 16 VAL N N 16 113.800 117.282 -3.482 1
1 209 . 5 1 1 A 17 17 SER H H 17 7.960 8.876 -0.916 1
1 210 . 5 1 1 A 17 17 SER HA H 17 5.860 5.510 0.350 1
1 213 . 5 1 1 A 17 17 SER C C 17 172.700 173.584 -0.884 1
1 214 . 5 1 1 A 17 17 SER CA C 17 57.300 56.769 0.531 1
1 215 . 5 1 1 A 17 17 SER CB C 17 64.000 64.831 -0.831 1
1 216 . 5 1 1 A 17 17 SER N N 17 117.100 117.482 -0.382 1
1 217 . 5 1 1 A 18 18 VAL H H 18 8.570 8.923 -0.353 1
1 218 . 5 1 1 A 18 18 VAL HA H 18 4.900 5.183 -0.283 1
1 226 . 5 1 1 A 18 18 VAL C C 18 173.700 173.688 0.012 1
1 227 . 5 1 1 A 18 18 VAL CA C 18 58.800 59.181 -0.381 1
1 228 . 5 1 1 A 18 18 VAL CB C 18 36.700 35.952 0.748 1
1 231 . 5 1 1 A 18 18 VAL N N 18 113.500 118.805 -5.305 1
1 232 . 5 1 1 A 19 19 ILE H H 19 8.490 8.606 -0.116 1
1 233 . 5 1 1 A 19 19 ILE HA H 19 5.300 4.895 0.405 1
1 243 . 5 1 1 A 19 19 ILE C C 19 175.800 174.792 1.008 1
1 244 . 5 1 1 A 19 19 ILE CA C 19 59.700 59.408 0.292 1
1 245 . 5 1 1 A 19 19 ILE CB C 19 41.700 42.683 -0.983 1
1 249 . 5 1 1 A 19 19 ILE N N 19 120.600 122.027 -1.427 1
1 250 . 5 1 1 A 20 20 GLY H H 20 8.670 7.907 0.763 1
1 251 . 5 1 1 A 20 20 GLY HA2 H 20 3.760 4.186 -0.426 1
1 252 . 5 1 1 A 20 20 GLY HA3 H 20 4.190 4.190 0.000 1
1 253 . 5 1 1 A 20 20 GLY C C 20 169.900 171.334 -1.434 1
1 254 . 5 1 1 A 20 20 GLY CA C 20 46.000 46.073 -0.073 1
1 255 . 5 1 1 A 20 20 GLY N N 20 110.200 113.575 -3.375 1
1 256 . 5 1 1 A 21 21 LYS H H 21 8.920 8.279 0.641 1
1 257 . 5 1 1 A 21 21 LYS HA H 21 5.210 5.072 0.138 1
1 266 . 5 1 1 A 21 21 LYS C C 21 176.400 175.160 1.240 1
1 267 . 5 1 1 A 21 21 LYS CA C 21 54.400 54.734 -0.334 1
1 268 . 5 1 1 A 21 21 LYS CB C 21 35.400 35.484 -0.084 1
1 272 . 5 1 1 A 21 21 LYS N N 21 119.100 120.988 -1.888 1
1 273 . 5 1 1 A 22 22 ILE H H 22 8.900 8.620 0.280 1
1 274 . 5 1 1 A 22 22 ILE HA H 22 5.050 5.222 -0.172 1
1 284 . 5 1 1 A 22 22 ILE C C 22 176.900 175.181 1.719 1
1 285 . 5 1 1 A 22 22 ILE CA C 22 57.800 60.273 -2.473 1
1 286 . 5 1 1 A 22 22 ILE CB C 22 36.200 39.334 -3.134 1
1 290 . 5 1 1 A 22 22 ILE N N 22 130.000 128.326 1.674 1
1 291 . 5 1 1 A 23 23 THR H H 23 9.020 8.744 0.276 1
1 292 . 5 1 1 A 23 23 THR HA H 23 4.660 4.838 -0.178 1
1 297 . 5 1 1 A 23 23 THR C C 23 174.000 174.512 -0.512 1
1 298 . 5 1 1 A 23 23 THR CA C 23 60.800 60.913 -0.113 1
1 299 . 5 1 1 A 23 23 THR CB C 23 73.400 72.877 0.523 1
1 301 . 5 1 1 A 23 23 THR N N 23 118.200 120.896 -2.696 1
1 302 . 5 1 1 A 24 24 GLY H H 24 8.430 8.852 -0.422 1
1 303 . 5 1 1 A 24 24 GLY HA2 H 24 3.910 3.866 0.044 1
1 304 . 5 1 1 A 24 24 GLY HA3 H 24 3.910 4.047 -0.137 1
1 305 . 5 1 1 A 24 24 GLY C C 24 175.400 175.006 0.394 1
1 306 . 5 1 1 A 24 24 GLY CA C 24 47.100 46.895 0.205 1
1 307 . 5 1 1 A 24 24 GLY N N 24 107.200 113.326 -6.126 1
1 308 . 5 1 1 A 25 25 ILE H H 25 9.370 8.151 1.219 1
1 309 . 5 1 1 A 25 25 ILE HA H 25 4.480 4.247 0.233 1
1 319 . 5 1 1 A 25 25 ILE C C 25 178.200 175.508 2.692 1
1 320 . 5 1 1 A 25 25 ILE CA C 25 59.200 61.117 -1.917 1
1 321 . 5 1 1 A 25 25 ILE CB C 25 35.400 37.881 -2.481 1
1 325 . 5 1 1 A 25 25 ILE N N 25 120.600 120.692 -0.092 1
1 326 . 5 1 1 A 26 26 HIS H H 26 9.000 9.607 -0.607 1
1 327 . 5 1 1 A 26 26 HIS HA H 26 4.770 5.153 -0.383 1
1 330 . 5 1 1 A 26 26 HIS C C 26 172.700 173.895 -1.195 1
1 331 . 5 1 1 A 26 26 HIS CA C 26 55.000 54.471 0.529 1
1 332 . 5 1 1 A 26 26 HIS CB C 26 31.100 33.528 -2.428 1
1 333 . 5 1 1 A 26 26 HIS N N 26 123.800 126.262 -2.462 1
1 334 . 5 1 1 A 27 27 LYS H H 27 8.930 9.047 -0.117 1
1 335 . 5 1 1 A 27 27 LYS HA H 27 4.770 4.552 0.218 1
1 344 . 5 1 1 A 27 27 LYS C C 27 175.300 175.206 0.094 1
1 345 . 5 1 1 A 27 27 LYS CA C 27 55.100 55.639 -0.539 1
1 346 . 5 1 1 A 27 27 LYS CB C 27 34.400 33.612 0.788 1
1 350 . 5 1 1 A 27 27 LYS N N 27 125.900 124.323 1.577 1
1 351 . 5 1 1 A 28 28 LYS H H 28 8.880 8.170 0.710 1
1 352 . 5 1 1 A 28 28 LYS HA H 28 4.570 4.971 -0.401 1
1 361 . 5 1 1 A 28 28 LYS C C 28 174.500 173.886 0.614 1
1 362 . 5 1 1 A 28 28 LYS CA C 28 54.600 54.977 -0.377 1
1 363 . 5 1 1 A 28 28 LYS CB C 28 35.300 36.666 -1.366 1
1 367 . 5 1 1 A 28 28 LYS N N 28 127.400 126.466 0.934 1
1 368 . 5 1 1 A 29 29 GLU H H 29 8.440 8.505 -0.065 1
1 369 . 5 1 1 A 29 29 GLU HA H 29 5.260 5.155 0.105 1
1 374 . 5 1 1 A 29 29 GLU C C 29 175.800 175.603 0.197 1
1 375 . 5 1 1 A 29 29 GLU CA C 29 54.800 54.856 -0.056 1
1 376 . 5 1 1 A 29 29 GLU CB C 29 31.500 33.131 -1.631 1
1 378 . 5 1 1 A 29 29 GLU N N 29 122.200 123.943 -1.743 1
1 379 . 5 1 1 A 30 30 TYR H H 30 8.960 8.762 0.198 1
1 380 . 5 1 1 A 30 30 TYR HA H 30 4.820 5.310 -0.490 1
1 387 . 5 1 1 A 30 30 TYR C C 30 172.600 172.437 0.163 1
1 388 . 5 1 1 A 30 30 TYR CA C 30 56.300 55.578 0.722 1
1 389 . 5 1 1 A 30 30 TYR CB C 30 40.500 41.346 -0.846 1
1 394 . 5 1 1 A 30 30 TYR N N 30 121.100 119.096 2.004 1
1 395 . 5 1 1 A 31 31 GLU H H 31 8.610 8.707 -0.097 1
1 396 . 5 1 1 A 31 31 GLU HA H 31 4.810 4.579 0.231 1
1 401 . 5 1 1 A 31 31 GLU C C 31 176.100 175.670 0.430 1
1 402 . 5 1 1 A 31 31 GLU CA C 31 55.100 56.354 -1.254 1
1 403 . 5 1 1 A 31 31 GLU CB C 31 30.300 30.657 -0.357 1
1 405 . 5 1 1 A 31 31 GLU N N 31 121.800 121.892 -0.092 1
1 406 . 5 1 1 A 32 32 SER H H 32 8.570 8.608 -0.038 1
1 407 . 5 1 1 A 32 32 SER HA H 32 4.520 4.863 -0.343 1
1 410 . 5 1 1 A 32 32 SER C C 32 174.300 173.261 1.039 1
1 411 . 5 1 1 A 32 32 SER CA C 32 57.300 56.912 0.388 1
1 412 . 5 1 1 A 32 32 SER CB C 32 64.100 65.858 -1.758 1
1 413 . 5 1 1 A 32 32 SER N N 32 118.500 121.747 -3.247 1
1 414 . 5 1 1 A 33 33 ASP H H 33 9.290 8.645 0.645 1
1 415 . 5 1 1 A 33 33 ASP HA H 33 4.340 4.272 0.068 1
1 418 . 5 1 1 A 33 33 ASP C C 33 175.900 177.096 -1.196 1
1 419 . 5 1 1 A 33 33 ASP CA C 33 55.000 55.935 -0.935 1
1 420 . 5 1 1 A 33 33 ASP CB C 33 39.300 39.605 -0.305 1
1 421 . 5 1 1 A 33 33 ASP N N 33 125.700 122.251 3.449 1
1 422 . 5 1 1 A 34 34 GLY H H 34 8.690 8.803 -0.113 1
1 423 . 5 1 1 A 34 34 GLY HA2 H 34 3.660 3.859 -0.199 1
1 424 . 5 1 1 A 34 34 GLY HA3 H 34 4.140 3.862 0.278 1
1 425 . 5 1 1 A 34 34 GLY C C 34 174.200 173.424 0.776 1
1 426 . 5 1 1 A 34 34 GLY CA C 34 45.600 46.207 -0.607 1
1 427 . 5 1 1 A 34 34 GLY N N 34 104.800 109.660 -4.860 1
1 428 . 5 1 1 A 35 35 THR H H 35 7.840 7.767 0.073 1
1 429 . 5 1 1 A 35 35 THR HA H 35 4.660 4.834 -0.174 1
1 434 . 5 1 1 A 35 35 THR C C 35 173.000 172.184 0.816 1
1 435 . 5 1 1 A 35 35 THR CA C 35 60.200 60.179 0.021 1
1 436 . 5 1 1 A 35 35 THR CB C 35 71.200 71.084 0.116 1
1 438 . 5 1 1 A 35 35 THR N N 35 114.800 113.578 1.222 1
1 439 . 5 1 1 A 36 36 THR H H 36 8.480 8.761 -0.281 1
1 440 . 5 1 1 A 36 36 THR HA H 36 4.620 4.699 -0.079 1
1 445 . 5 1 1 A 36 36 THR C C 36 173.800 173.847 -0.047 1
1 446 . 5 1 1 A 36 36 THR CA C 36 62.300 62.093 0.207 1
1 447 . 5 1 1 A 36 36 THR CB C 36 69.500 69.711 -0.211 1
1 449 . 5 1 1 A 36 36 THR N N 36 119.400 121.599 -2.199 1
1 450 . 5 1 1 A 37 37 LYS H H 37 8.880 8.149 0.731 1
1 451 . 5 1 1 A 37 37 LYS HA H 37 4.570 4.781 -0.211 1
1 460 . 5 1 1 A 37 37 LYS C C 37 174.500 176.234 -1.734 1
1 461 . 5 1 1 A 37 37 LYS CA C 37 54.600 54.359 0.241 1
1 462 . 5 1 1 A 37 37 LYS CB C 37 35.500 35.428 0.072 1
1 466 . 5 1 1 A 37 37 LYS N N 37 128.000 125.998 2.002 1
1 467 . 5 1 1 A 38 38 SER H H 38 8.370 8.752 -0.382 1
1 468 . 5 1 1 A 38 38 SER HA H 38 5.250 4.934 0.316 1
1 471 . 5 1 1 A 38 38 SER C C 38 173.200 173.707 -0.507 1
1 472 . 5 1 1 A 38 38 SER CA C 38 57.900 57.172 0.728 1
1 473 . 5 1 1 A 38 38 SER CB C 38 65.500 64.522 0.978 1
1 474 . 5 1 1 A 38 38 SER N N 38 114.300 116.880 -2.580 1
1 475 . 5 1 1 A 39 39 VAL H H 39 9.020 8.751 0.269 1
1 476 . 5 1 1 A 39 39 VAL HA H 39 4.900 4.977 -0.077 1
1 484 . 5 1 1 A 39 39 VAL C C 39 173.200 172.772 0.428 1
1 485 . 5 1 1 A 39 39 VAL CA C 39 59.200 59.597 -0.397 1
1 486 . 5 1 1 A 39 39 VAL CB C 39 34.600 35.338 -0.738 1
1 489 . 5 1 1 A 39 39 VAL N N 39 123.600 121.156 2.444 1
1 490 . 5 1 1 A 40 40 TYR H H 40 8.900 8.802 0.098 1
1 491 . 5 1 1 A 40 40 TYR HA H 40 4.730 5.373 -0.643 1
1 498 . 5 1 1 A 40 40 TYR CA C 40 56.500 56.768 -0.268 1
1 499 . 5 1 1 A 40 40 TYR CB C 40 39.000 40.670 -1.670 1
1 504 . 5 1 1 A 40 40 TYR N N 40 126.300 127.364 -1.064 1
1 505 . 5 1 1 A 41 41 GLN H H 41 8.630 8.696 -0.066 1
1 506 . 5 1 1 A 41 41 GLN HA H 41 5.330 5.339 -0.009 1
1 513 . 5 1 1 A 41 41 GLN C C 41 175.500 175.940 -0.440 1
1 514 . 5 1 1 A 41 41 GLN CA C 41 53.800 54.174 -0.374 1
1 515 . 5 1 1 A 41 41 GLN CB C 41 32.100 31.810 0.290 1
1 518 . 5 1 1 A 41 41 GLN N N 41 122.000 122.306 -0.306 1
1 520 . 5 1 1 A 42 42 GLY H H 42 8.560 7.928 0.632 1
1 521 . 5 1 1 A 42 42 GLY HA2 H 42 3.680 4.290 -0.610 1
1 522 . 5 1 1 A 42 42 GLY HA3 H 42 4.020 4.369 -0.349 1
1 523 . 5 1 1 A 42 42 GLY C C 42 171.600 171.116 0.484 1
1 524 . 5 1 1 A 42 42 GLY CA C 42 47.300 46.157 1.143 1
1 525 . 5 1 1 A 42 42 GLY N N 42 113.000 108.712 4.288 1
1 526 . 5 1 1 A 43 43 TYR H H 43 9.320 8.331 0.989 1
1 527 . 5 1 1 A 43 43 TYR HA H 43 5.280 5.459 -0.179 1
1 534 . 5 1 1 A 43 43 TYR C C 43 173.200 174.403 -1.203 1
1 535 . 5 1 1 A 43 43 TYR CA C 43 57.600 56.543 1.057 1
1 536 . 5 1 1 A 43 43 TYR CB C 43 42.400 42.823 -0.423 1
1 541 . 5 1 1 A 43 43 TYR N N 43 126.300 118.778 7.522 1
1 542 . 5 1 1 A 44 44 ILE H H 44 9.160 8.758 0.402 1
1 543 . 5 1 1 A 44 44 ILE HA H 44 5.270 5.403 -0.133 1
1 553 . 5 1 1 A 44 44 ILE C C 44 172.900 173.162 -0.262 1
1 554 . 5 1 1 A 44 44 ILE CA C 44 59.000 59.589 -0.589 1
1 555 . 5 1 1 A 44 44 ILE CB C 44 42.200 42.017 0.183 1
1 559 . 5 1 1 A 44 44 ILE N N 44 117.700 121.766 -4.066 1
1 560 . 5 1 1 A 45 45 GLU H H 45 8.420 8.990 -0.570 1
1 561 . 5 1 1 A 45 45 GLU HA H 45 5.600 5.481 0.119 1
1 566 . 5 1 1 A 45 45 GLU C C 45 174.300 174.407 -0.107 1
1 567 . 5 1 1 A 45 45 GLU CA C 45 54.000 54.602 -0.602 1
1 568 . 5 1 1 A 45 45 GLU CB C 45 34.400 33.566 0.834 1
1 570 . 5 1 1 A 45 45 GLU N N 45 123.600 128.693 -5.093 1
1 571 . 5 1 1 A 46 46 ASP H H 46 8.530 8.968 -0.438 1
1 572 . 5 1 1 A 46 46 ASP HA H 46 5.070 5.003 0.067 1
1 575 . 5 1 1 A 46 46 ASP C C 46 175.000 176.286 -1.286 1
1 576 . 5 1 1 A 46 46 ASP CA C 46 51.800 52.719 -0.919 1
1 577 . 5 1 1 A 46 46 ASP CB C 46 41.300 43.828 -2.528 1
1 578 . 5 1 1 A 46 46 ASP N N 46 125.500 125.062 0.438 1
1 579 . 5 1 1 A 47 47 ASP H H 47 9.160 9.151 0.009 1
1 580 . 5 1 1 A 47 47 ASP HA H 47 4.430 4.543 -0.113 1
1 583 . 5 1 1 A 47 47 ASP C C 47 176.000 176.986 -0.986 1
1 584 . 5 1 1 A 47 47 ASP CA C 47 55.000 55.660 -0.660 1
1 585 . 5 1 1 A 47 47 ASP CB C 47 38.900 39.643 -0.743 1
1 586 . 5 1 1 A 47 47 ASP N N 47 114.200 121.247 -7.047 1
1 587 . 5 1 1 A 48 48 THR H H 48 9.470 7.812 1.658 1
1 588 . 5 1 1 A 48 48 THR HA H 48 4.520 4.538 -0.018 1
1 593 . 5 1 1 A 48 48 THR C C 48 174.500 175.041 -0.541 1
1 594 . 5 1 1 A 48 48 THR CA C 48 62.600 62.295 0.305 1
1 595 . 5 1 1 A 48 48 THR CB C 48 70.400 69.769 0.631 1
1 597 . 5 1 1 A 48 48 THR N N 48 111.800 108.646 3.154 1
1 598 . 5 1 1 A 49 49 ALA H H 49 7.850 7.520 0.330 1
1 599 . 5 1 1 A 49 49 ALA HA H 49 4.440 4.430 0.010 1
1 603 . 5 1 1 A 49 49 ALA C C 49 173.200 175.565 -2.365 1
1 604 . 5 1 1 A 49 49 ALA CA C 49 52.700 51.283 1.417 1
1 605 . 5 1 1 A 49 49 ALA CB C 49 21.300 20.545 0.755 1
1 606 . 5 1 1 A 49 49 ALA N N 49 123.400 120.950 2.450 1
1 607 . 5 1 1 A 50 50 ARG H H 50 8.160 8.817 -0.657 1
1 608 . 5 1 1 A 50 50 ARG HA H 50 5.350 5.564 -0.214 1
1 616 . 5 1 1 A 50 50 ARG C C 50 174.700 174.400 0.300 1
1 617 . 5 1 1 A 50 50 ARG CA C 50 54.000 54.383 -0.383 1
1 618 . 5 1 1 A 50 50 ARG CB C 50 34.500 34.539 -0.039 1
1 622 . 5 1 1 A 50 50 ARG N N 50 117.400 115.862 1.538 1
1 624 . 5 1 1 A 51 51 ILE H H 51 9.390 8.703 0.687 1
1 625 . 5 1 1 A 51 51 ILE HA H 51 4.790 5.083 -0.293 1
1 635 . 5 1 1 A 51 51 ILE C C 51 172.600 173.090 -0.490 1
1 636 . 5 1 1 A 51 51 ILE CA C 51 60.000 58.972 1.028 1
1 637 . 5 1 1 A 51 51 ILE CB C 51 42.800 42.136 0.664 1
1 641 . 5 1 1 A 51 51 ILE N N 51 124.600 120.911 3.689 1
1 642 . 5 1 1 A 52 52 ARG H H 52 7.980 8.586 -0.606 1
1 643 . 5 1 1 A 52 52 ARG HA H 52 4.170 4.306 -0.136 1
1 651 . 5 1 1 A 52 52 ARG C C 52 174.600 175.929 -1.329 1
1 652 . 5 1 1 A 52 52 ARG CA C 52 57.100 56.257 0.843 1
1 653 . 5 1 1 A 52 52 ARG CB C 52 31.300 31.105 0.195 1
1 657 . 5 1 1 A 52 52 ARG N N 52 125.900 127.914 -2.014 1
1 659 . 5 1 1 A 53 53 ILE H H 53 8.290 8.799 -0.509 1
1 660 . 5 1 1 A 53 53 ILE HA H 53 5.160 5.058 0.102 1
1 670 . 5 1 1 A 53 53 ILE C C 53 172.400 174.619 -2.219 1
1 671 . 5 1 1 A 53 53 ILE CA C 53 58.600 59.091 -0.491 1
1 672 . 5 1 1 A 53 53 ILE CB C 53 41.900 42.258 -0.358 1
1 676 . 5 1 1 A 53 53 ILE N N 53 118.500 121.234 -2.734 1
1 677 . 5 1 1 A 54 54 SER H H 54 8.350 8.771 -0.421 1
1 678 . 5 1 1 A 54 54 SER HA H 54 5.070 5.313 -0.243 1
1 681 . 5 1 1 A 54 54 SER C C 54 172.400 171.846 0.554 1
1 682 . 5 1 1 A 54 54 SER CA C 54 57.000 56.693 0.307 1
1 683 . 5 1 1 A 54 54 SER CB C 54 65.900 65.767 0.133 1
1 684 . 5 1 1 A 54 54 SER N N 54 120.700 117.626 3.074 1
1 685 . 5 1 1 A 55 55 SER H H 55 9.130 9.092 0.038 1
1 686 . 5 1 1 A 55 55 SER HA H 55 5.270 5.179 0.091 1
1 690 . 5 1 1 A 55 55 SER C C 55 174.400 172.726 1.674 1
1 691 . 5 1 1 A 55 55 SER CA C 55 55.500 56.526 -1.026 1
1 692 . 5 1 1 A 55 55 SER CB C 55 64.500 64.749 -0.249 1
1 693 . 5 1 1 A 55 55 SER N N 55 117.200 119.866 -2.666 1
1 694 . 5 1 1 A 56 56 PHE H H 56 8.970 8.702 0.268 1
1 695 . 5 1 1 A 56 56 PHE HA H 56 4.600 4.978 -0.378 1
1 703 . 5 1 1 A 56 56 PHE C C 56 176.500 176.992 -0.492 1
1 704 . 5 1 1 A 56 56 PHE CA C 56 58.300 57.165 1.135 1
1 705 . 5 1 1 A 56 56 PHE CB C 56 37.900 40.943 -3.043 1
1 711 . 5 1 1 A 56 56 PHE N N 56 129.400 127.048 2.352 1
1 712 . 5 1 1 A 57 57 GLY H H 57 8.570 8.930 -0.360 1
1 713 . 5 1 1 A 57 57 GLY HA2 H 57 4.020 4.117 -0.097 1
1 714 . 5 1 1 A 57 57 GLY HA3 H 57 4.380 4.130 0.250 1
1 715 . 5 1 1 A 57 57 GLY C C 57 173.700 174.377 -0.677 1
1 716 . 5 1 1 A 57 57 GLY CA C 57 46.300 45.609 0.691 1
1 717 . 5 1 1 A 57 57 GLY N N 57 112.500 112.265 0.235 1
1 718 . 5 1 1 A 58 58 LYS H H 58 6.800 7.875 -1.075 1
1 719 . 5 1 1 A 58 58 LYS HA H 58 4.410 4.376 0.034 1
1 728 . 5 1 1 A 58 58 LYS C C 58 174.800 175.698 -0.898 1
1 729 . 5 1 1 A 58 58 LYS CA C 58 55.200 56.507 -1.307 1
1 730 . 5 1 1 A 58 58 LYS CB C 58 33.300 33.548 -0.248 1
1 734 . 5 1 1 A 58 58 LYS N N 58 118.700 121.175 -2.475 1
1 735 . 5 1 1 A 59 59 GLN H H 59 8.390 8.602 -0.212 1
1 736 . 5 1 1 A 59 59 GLN HA H 59 1.830 3.735 -1.905 1
1 743 . 5 1 1 A 59 59 GLN C C 59 174.100 174.599 -0.499 1
1 744 . 5 1 1 A 59 59 GLN CA C 59 57.100 54.803 2.297 1
1 745 . 5 1 1 A 59 59 GLN CB C 59 28.900 29.492 -0.592 1
1 748 . 5 1 1 A 59 59 GLN N N 59 124.000 123.391 0.609 1
1 750 . 5 1 1 A 60 60 LEU H H 60 5.320 8.017 -2.697 1
1 751 . 5 1 1 A 60 60 LEU HA H 60 4.370 5.013 -0.643 1
1 761 . 5 1 1 A 60 60 LEU CA C 60 52.800 53.340 -0.540 1
1 762 . 5 1 1 A 60 60 LEU CB C 60 46.700 44.953 1.747 1
1 766 . 5 1 1 A 60 60 LEU N N 60 121.800 123.618 -1.818 1
1 767 . 5 1 1 A 61 61 GLN H H 61 8.660 8.747 -0.087 1
1 768 . 5 1 1 A 61 61 GLN HA H 61 4.440 4.632 -0.192 1
1 775 . 5 1 1 A 61 61 GLN C C 61 174.000 174.933 -0.933 1
1 776 . 5 1 1 A 61 61 GLN CA C 61 53.800 54.116 -0.316 1
1 777 . 5 1 1 A 61 61 GLN CB C 61 31.800 31.211 0.589 1
1 780 . 5 1 1 A 61 61 GLN N N 61 120.300 120.477 -0.177 1
1 782 . 5 1 1 A 62 62 ASP H H 62 8.450 8.736 -0.286 1
1 783 . 5 1 1 A 62 62 ASP HA H 62 4.130 4.364 -0.234 1
1 786 . 5 1 1 A 62 62 ASP C C 62 177.200 176.487 0.713 1
1 787 . 5 1 1 A 62 62 ASP CA C 62 55.700 55.099 0.601 1
1 788 . 5 1 1 A 62 62 ASP CB C 62 39.400 40.728 -1.328 1
1 789 . 5 1 1 A 62 62 ASP N N 62 122.400 123.864 -1.464 1
1 790 . 5 1 1 A 63 63 SER H H 63 9.210 8.560 0.650 1
1 791 . 5 1 1 A 63 63 SER HA H 63 3.850 4.076 -0.226 1
1 794 . 5 1 1 A 63 63 SER C C 63 173.200 172.699 0.501 1
1 795 . 5 1 1 A 63 63 SER CA C 63 61.700 58.956 2.744 1
1 796 . 5 1 1 A 63 63 SER CB C 63 61.800 61.661 0.139 1
1 797 . 5 1 1 A 63 63 SER N N 63 114.300 117.173 -2.873 1
1 798 . 5 1 1 A 64 64 ASP H H 64 7.960 7.634 0.326 1
1 799 . 5 1 1 A 64 64 ASP HA H 64 4.540 4.847 -0.307 1
1 802 . 5 1 1 A 64 64 ASP C C 64 174.900 174.262 0.638 1
1 803 . 5 1 1 A 64 64 ASP CA C 64 54.900 53.755 1.145 1
1 804 . 5 1 1 A 64 64 ASP CB C 64 40.900 44.041 -3.141 1
1 805 . 5 1 1 A 64 64 ASP N N 64 122.600 120.606 1.994 1
1 806 . 5 1 1 A 65 65 VAL H H 65 8.180 8.768 -0.588 1
1 807 . 5 1 1 A 65 65 VAL HA H 65 4.670 4.501 0.169 1
1 815 . 5 1 1 A 65 65 VAL C C 65 175.900 175.613 0.287 1
1 816 . 5 1 1 A 65 65 VAL CA C 65 62.300 62.734 -0.434 1
1 817 . 5 1 1 A 65 65 VAL CB C 65 31.700 30.905 0.795 1
1 820 . 5 1 1 A 65 65 VAL N N 65 123.100 126.562 -3.462 1
1 821 . 5 1 1 A 66 66 VAL H H 66 8.770 8.698 0.072 1
1 822 . 5 1 1 A 66 66 VAL HA H 66 5.160 5.101 0.059 1
1 830 . 5 1 1 A 66 66 VAL C C 66 173.600 173.317 0.283 1
1 831 . 5 1 1 A 66 66 VAL CA C 66 58.100 58.806 -0.706 1
1 832 . 5 1 1 A 66 66 VAL CB C 66 35.700 36.167 -0.467 1
1 835 . 5 1 1 A 66 66 VAL N N 66 118.100 120.794 -2.694 1
1 836 . 5 1 1 A 67 67 ARG H H 67 8.880 8.780 0.100 1
1 837 . 5 1 1 A 67 67 ARG HA H 67 5.110 5.209 -0.099 1
1 845 . 5 1 1 A 67 67 ARG C C 67 175.300 174.533 0.767 1
1 846 . 5 1 1 A 67 67 ARG CA C 67 54.200 54.421 -0.221 1
1 847 . 5 1 1 A 67 67 ARG CB C 67 32.200 33.474 -1.274 1
1 851 . 5 1 1 A 67 67 ARG N N 67 120.200 121.392 -1.192 1
1 853 . 5 1 1 A 68 68 ILE H H 68 9.220 8.962 0.258 1
1 854 . 5 1 1 A 68 68 ILE HA H 68 4.990 4.598 0.392 1
1 864 . 5 1 1 A 68 68 ILE C C 68 174.900 174.644 0.256 1
1 865 . 5 1 1 A 68 68 ILE CA C 68 58.600 59.447 -0.847 1
1 866 . 5 1 1 A 68 68 ILE CB C 68 39.300 38.791 0.509 1
1 870 . 5 1 1 A 68 68 ILE N N 68 127.200 128.451 -1.251 1
1 871 . 5 1 1 A 69 69 ASP H H 69 9.110 9.027 0.083 1
1 872 . 5 1 1 A 69 69 ASP HA H 69 5.370 5.050 0.320 1
1 875 . 5 1 1 A 69 69 ASP C C 69 175.800 176.446 -0.646 1
1 876 . 5 1 1 A 69 69 ASP CA C 69 52.400 52.650 -0.250 1
1 877 . 5 1 1 A 69 69 ASP CB C 69 43.700 42.952 0.748 1
1 878 . 5 1 1 A 69 69 ASP N N 69 123.400 125.508 -2.108 1
1 879 . 5 1 1 A 70 70 ASN H H 70 8.300 9.107 -0.807 1
1 880 . 5 1 1 A 70 70 ASN HA H 70 4.160 4.422 -0.262 1
1 885 . 5 1 1 A 70 70 ASN C C 70 176.300 174.635 1.665 1
1 886 . 5 1 1 A 70 70 ASN CA C 70 54.300 54.211 0.089 1
1 887 . 5 1 1 A 70 70 ASN CB C 70 37.500 37.547 -0.047 1
1 889 . 5 1 1 A 70 70 ASN N N 70 119.800 121.156 -1.356 1
1 891 . 5 1 1 A 71 71 ALA H H 71 9.100 7.906 1.194 1
1 892 . 5 1 1 A 71 71 ALA HA H 71 4.500 4.479 0.021 1
1 896 . 5 1 1 A 71 71 ALA C C 71 175.700 176.668 -0.968 1
1 897 . 5 1 1 A 71 71 ALA CA C 71 51.900 52.636 -0.736 1
1 898 . 5 1 1 A 71 71 ALA CB C 71 19.600 19.769 -0.169 1
1 899 . 5 1 1 A 71 71 ALA N N 71 123.000 121.156 1.844 1
1 900 . 5 1 1 A 72 72 ARG H H 72 8.490 8.525 -0.035 1
1 901 . 5 1 1 A 72 72 ARG HA H 72 4.720 4.613 0.107 1
1 909 . 5 1 1 A 72 72 ARG C C 72 175.800 175.474 0.326 1
1 910 . 5 1 1 A 72 72 ARG CA C 72 54.400 55.075 -0.675 1
1 911 . 5 1 1 A 72 72 ARG CB C 72 32.700 31.472 1.228 1
1 915 . 5 1 1 A 72 72 ARG N N 72 122.500 123.730 -1.230 1
1 917 . 5 1 1 A 73 73 VAL H H 73 8.310 8.024 0.286 1
1 918 . 5 1 1 A 73 73 VAL HA H 73 4.250 4.482 -0.232 1
1 926 . 5 1 1 A 73 73 VAL C C 73 174.600 175.488 -0.888 1
1 927 . 5 1 1 A 73 73 VAL CA C 73 62.800 61.985 0.815 1
1 928 . 5 1 1 A 73 73 VAL CB C 73 32.100 31.902 0.198 1
1 931 . 5 1 1 A 73 73 VAL N N 73 127.100 126.365 0.735 1
1 932 . 5 1 1 A 74 74 ALA H H 74 8.880 8.886 -0.006 1
1 933 . 5 1 1 A 74 74 ALA HA H 74 4.500 5.131 -0.631 1
1 937 . 5 1 1 A 74 74 ALA C C 74 174.800 174.767 0.033 1
1 938 . 5 1 1 A 74 74 ALA CA C 74 50.500 50.438 0.062 1
1 939 . 5 1 1 A 74 74 ALA CB C 74 22.500 23.978 -1.478 1
1 940 . 5 1 1 A 74 74 ALA N N 74 131.000 128.843 2.157 1
1 941 . 5 1 1 A 75 75 GLN H H 75 8.280 8.508 -0.228 1
1 942 . 5 1 1 A 75 75 GLN HA H 75 4.910 5.174 -0.264 1
1 949 . 5 1 1 A 75 75 GLN C C 75 175.100 174.115 0.985 1
1 950 . 5 1 1 A 75 75 GLN CA C 75 54.600 54.109 0.491 1
1 951 . 5 1 1 A 75 75 GLN CB C 75 31.400 31.697 -0.297 1
1 954 . 5 1 1 A 75 75 GLN N N 75 118.800 120.738 -1.938 1
1 956 . 5 1 1 A 76 76 PHE H H 76 8.710 9.274 -0.564 1
1 957 . 5 1 1 A 76 76 PHE HA H 76 4.660 4.913 -0.253 1
1 965 . 5 1 1 A 76 76 PHE C C 76 174.900 175.490 -0.590 1
1 966 . 5 1 1 A 76 76 PHE CA C 76 57.000 56.706 0.294 1
1 967 . 5 1 1 A 76 76 PHE CB C 76 41.000 41.990 -0.990 1
1 973 . 5 1 1 A 76 76 PHE N N 76 125.000 125.529 -0.529 1
1 974 . 5 1 1 A 77 77 ASN H H 77 9.040 9.413 -0.373 1
1 975 . 5 1 1 A 77 77 ASN HA H 77 4.170 4.496 -0.326 1
1 980 . 5 1 1 A 77 77 ASN C C 77 174.200 175.677 -1.477 1
1 981 . 5 1 1 A 77 77 ASN CA C 77 53.800 54.516 -0.716 1
1 982 . 5 1 1 A 77 77 ASN CB C 77 37.400 37.532 -0.132 1
1 984 . 5 1 1 A 77 77 ASN N N 77 123.200 123.778 -0.578 1
1 986 . 5 1 1 A 78 78 GLY H H 78 8.370 8.620 -0.250 1
1 987 . 5 1 1 A 78 78 GLY HA2 H 78 3.410 3.615 -0.205 1
1 988 . 5 1 1 A 78 78 GLY HA3 H 78 3.980 3.707 0.273 1
1 989 . 5 1 1 A 78 78 GLY C C 78 173.800 173.140 0.660 1
1 990 . 5 1 1 A 78 78 GLY CA C 78 45.000 45.282 -0.282 1
1 991 . 5 1 1 A 78 78 GLY N N 78 103.300 104.717 -1.417 1
1 992 . 5 1 1 A 79 79 TYR H H 79 7.670 8.216 -0.546 1
1 993 . 5 1 1 A 79 79 TYR HA H 79 4.860 4.836 0.024 1
1 1000 . 5 1 1 A 79 79 TYR C C 79 174.800 175.735 -0.935 1
1 1001 . 5 1 1 A 79 79 TYR CA C 79 56.300 57.478 -1.178 1
1 1002 . 5 1 1 A 79 79 TYR CB C 79 40.800 40.682 0.118 1
1 1007 . 5 1 1 A 79 79 TYR N N 79 118.700 119.318 -0.618 1
1 1008 . 5 1 1 A 80 80 LEU H H 80 8.760 8.701 0.059 1
1 1009 . 5 1 1 A 80 80 LEU HA H 80 4.830 4.449 0.381 1
1 1019 . 5 1 1 A 80 80 LEU C C 80 176.200 176.913 -0.713 1
1 1020 . 5 1 1 A 80 80 LEU CA C 80 54.700 55.114 -0.414 1
1 1021 . 5 1 1 A 80 80 LEU CB C 80 43.500 42.555 0.945 1
1 1025 . 5 1 1 A 80 80 LEU N N 80 122.600 125.975 -3.375 1
1 1026 . 5 1 1 A 81 81 SER H H 81 8.650 8.820 -0.170 1
1 1027 . 5 1 1 A 81 81 SER HA H 81 4.860 5.071 -0.211 1
1 1030 . 5 1 1 A 81 81 SER C C 81 172.600 172.962 -0.362 1
1 1031 . 5 1 1 A 81 81 SER CA C 81 56.600 57.276 -0.676 1
1 1032 . 5 1 1 A 81 81 SER CB C 81 66.300 65.353 0.947 1
1 1033 . 5 1 1 A 81 81 SER N N 81 114.700 118.216 -3.516 1
1 1034 . 5 1 1 A 82 82 LEU H H 82 8.680 8.589 0.091 1
1 1035 . 5 1 1 A 82 82 LEU HA H 82 5.190 5.147 0.043 1
1 1045 . 5 1 1 A 82 82 LEU C C 82 177.100 175.763 1.337 1
1 1046 . 5 1 1 A 82 82 LEU CA C 82 53.300 53.744 -0.444 1
1 1047 . 5 1 1 A 82 82 LEU CB C 82 43.800 43.706 0.094 1
1 1051 . 5 1 1 A 82 82 LEU N N 82 119.800 125.174 -5.374 1
1 1052 . 5 1 1 A 83 83 SER H H 83 9.560 9.522 0.038 1
1 1053 . 5 1 1 A 83 83 SER HA H 83 5.390 5.423 -0.033 1
1 1056 . 5 1 1 A 83 83 SER C C 83 174.200 173.884 0.316 1
1 1057 . 5 1 1 A 83 83 SER CA C 83 57.100 57.866 -0.766 1
1 1058 . 5 1 1 A 83 83 SER CB C 83 64.400 64.497 -0.097 1
1 1059 . 5 1 1 A 83 83 SER N N 83 119.000 122.188 -3.188 1
1 1060 . 5 1 1 A 84 84 VAL H H 84 9.150 8.923 0.227 1
1 1061 . 5 1 1 A 84 84 VAL HA H 84 4.490 4.674 -0.184 1
1 1069 . 5 1 1 A 84 84 VAL C C 84 174.700 176.190 -1.490 1
1 1070 . 5 1 1 A 84 84 VAL CA C 84 61.300 61.361 -0.061 1
1 1071 . 5 1 1 A 84 84 VAL CB C 84 33.000 32.231 0.769 1
1 1074 . 5 1 1 A 84 84 VAL N N 84 128.300 127.431 0.869 1
1 1075 . 5 1 1 A 85 85 GLY H H 85 7.970 8.772 -0.802 1
1 1076 . 5 1 1 A 85 85 GLY HA2 H 85 4.030 4.268 -0.238 1
1 1077 . 5 1 1 A 85 85 GLY HA3 H 85 4.840 4.326 0.514 1
1 1078 . 5 1 1 A 85 85 GLY C C 85 175.800 174.833 0.967 1
1 1079 . 5 1 1 A 85 85 GLY CA C 85 44.800 44.420 0.380 1
1 1080 . 5 1 1 A 85 85 GLY N N 85 114.300 115.147 -0.847 1
1 1081 . 5 1 1 A 86 86 ASP H H 86 8.860 8.750 0.110 1
1 1082 . 5 1 1 A 86 86 ASP HA H 86 4.370 4.394 -0.024 1
1 1085 . 5 1 1 A 86 86 ASP C C 86 177.400 177.331 0.069 1
1 1086 . 5 1 1 A 86 86 ASP CA C 86 57.400 56.354 1.046 1
1 1087 . 5 1 1 A 86 86 ASP CB C 86 40.600 40.464 0.136 1
1 1088 . 5 1 1 A 86 86 ASP N N 86 122.500 119.630 2.870 1
1 1089 . 5 1 1 A 87 87 SER H H 87 8.540 7.716 0.824 1
1 1090 . 5 1 1 A 87 87 SER HA H 87 4.620 4.427 0.193 1
1 1093 . 5 1 1 A 87 87 SER C C 87 174.700 174.741 -0.041 1
1 1094 . 5 1 1 A 87 87 SER CA C 87 58.200 58.677 -0.477 1
1 1095 . 5 1 1 A 87 87 SER CB C 87 63.300 63.828 -0.528 1
1 1096 . 5 1 1 A 87 87 SER N N 87 112.100 111.641 0.459 1
1 1097 . 5 1 1 A 88 88 SER H H 88 7.880 7.417 0.463 1
1 1098 . 5 1 1 A 88 88 SER HA H 88 5.050 4.537 0.513 1
1 1101 . 5 1 1 A 88 88 SER C C 88 172.700 173.584 -0.884 1
1 1102 . 5 1 1 A 88 88 SER CA C 88 57.600 57.908 -0.308 1
1 1103 . 5 1 1 A 88 88 SER CB C 88 64.300 65.196 -0.896 1
1 1104 . 5 1 1 A 88 88 SER N N 88 119.200 117.156 2.044 1
1 1105 . 5 1 1 A 89 89 ARG H H 89 8.350 8.303 0.047 1
1 1106 . 5 1 1 A 89 89 ARG HA H 89 4.720 5.316 -0.596 1
1 1114 . 5 1 1 A 89 89 ARG C C 89 174.200 174.759 -0.559 1
1 1115 . 5 1 1 A 89 89 ARG CA C 89 55.000 54.385 0.615 1
1 1116 . 5 1 1 A 89 89 ARG CB C 89 33.500 34.422 -0.922 1
1 1120 . 5 1 1 A 89 89 ARG N N 89 122.800 119.126 3.674 1
1 1122 . 5 1 1 A 90 90 ILE H H 90 8.530 8.885 -0.355 1
1 1123 . 5 1 1 A 90 90 ILE HA H 90 4.790 5.097 -0.307 1
1 1133 . 5 1 1 A 90 90 ILE C C 90 175.400 174.974 0.426 1
1 1134 . 5 1 1 A 90 90 ILE CA C 90 60.600 60.031 0.569 1
1 1135 . 5 1 1 A 90 90 ILE CB C 90 40.600 40.796 -0.196 1
1 1139 . 5 1 1 A 90 90 ILE N N 90 123.100 123.103 -0.003 1
1 1140 . 5 1 1 A 91 91 GLU H H 91 9.000 8.864 0.136 1
1 1141 . 5 1 1 A 91 91 GLU HA H 91 4.730 4.849 -0.119 1
1 1146 . 5 1 1 A 91 91 GLU C C 91 175.100 175.903 -0.803 1
1 1147 . 5 1 1 A 91 91 GLU CA C 91 54.300 54.407 -0.107 1
1 1148 . 5 1 1 A 91 91 GLU CB C 91 32.400 33.113 -0.713 1
1 1150 . 5 1 1 A 91 91 GLU N N 91 126.400 126.587 -0.187 1
1 1151 . 5 1 1 A 92 92 SER H H 92 8.830 8.806 0.024 1
1 1152 . 5 1 1 A 92 92 SER HA H 92 4.700 4.677 0.023 1
1 1155 . 5 1 1 A 92 92 SER C C 92 174.600 174.237 0.363 1
1 1156 . 5 1 1 A 92 92 SER CA C 92 59.300 58.432 0.868 1
1 1157 . 5 1 1 A 92 92 SER CB C 92 63.100 63.793 -0.693 1
1 1158 . 5 1 1 A 92 92 SER N N 92 119.800 119.313 0.487 1
1 1159 . 5 1 1 A 93 93 VAL H H 93 8.350 8.337 0.013 1
1 1160 . 5 1 1 A 93 93 VAL HA H 93 4.290 4.543 -0.253 1
1 1168 . 5 1 1 A 93 93 VAL C C 93 175.100 176.103 -1.003 1
1 1169 . 5 1 1 A 93 93 VAL CA C 93 61.300 60.921 0.379 1
1 1170 . 5 1 1 A 93 93 VAL CB C 93 33.900 33.827 0.073 1
1 1173 . 5 1 1 A 93 93 VAL N N 93 121.800 125.224 -3.424 1
1 1174 . 5 1 1 A 94 94 ASN H H 94 8.510 9.410 -0.900 1
1 1175 . 5 1 1 A 94 94 ASN HA H 94 4.770 4.375 0.395 1
1 1180 . 5 1 1 A 94 94 ASN C C 94 175.000 175.618 -0.618 1
1 1181 . 5 1 1 A 94 94 ASN CA C 94 52.700 55.229 -2.529 1
1 1182 . 5 1 1 A 94 94 ASN CB C 94 38.500 37.337 1.163 1
1 1184 . 5 1 1 A 94 94 ASN N N 94 121.800 122.565 -0.765 1
1 1186 . 5 1 1 A 95 95 VAL H H 95 7.860 8.520 -0.660 1
1 1187 . 5 1 1 A 95 95 VAL HA H 95 4.100 3.686 0.414 1
1 1195 . 5 1 1 A 95 95 VAL C C 95 175.100 175.104 -0.004 1
1 1196 . 5 1 1 A 95 95 VAL CA C 95 61.700 64.321 -2.621 1
1 1197 . 5 1 1 A 95 95 VAL CB C 95 33.100 30.044 3.056 1
1 1200 . 5 1 1 A 95 95 VAL N N 95 119.700 118.615 1.085 1
1 1201 . 5 1 1 A 96 96 ASN H H 96 8.490 7.899 0.591 1
1 1202 . 5 1 1 A 96 96 ASN HA H 96 4.700 4.973 -0.273 1
1 1207 . 5 1 1 A 96 96 ASN C C 96 174.600 174.110 0.490 1
1 1208 . 5 1 1 A 96 96 ASN CA C 96 53.000 53.049 -0.049 1
1 1209 . 5 1 1 A 96 96 ASN CB C 96 39.000 40.200 -1.200 1
1 1211 . 5 1 1 A 96 96 ASN N N 96 122.200 119.839 2.361 1
1 1213 . 5 1 1 A 97 97 ILE H H 97 8.080 8.392 -0.312 1
1 1214 . 5 1 1 A 97 97 ILE HA H 97 4.370 4.553 -0.183 1
1 1224 . 5 1 1 A 97 97 ILE CA C 97 58.600 58.040 0.560 1
1 1225 . 5 1 1 A 97 97 ILE CB C 97 38.600 37.902 0.698 1
1 1229 . 5 1 1 A 97 97 ILE N N 97 123.500 116.764 6.736 1
1 1230 . 5 1 1 A 98 98 PRO HA H 98 4.360 4.452 -0.092 1
1 1237 . 5 1 1 A 98 98 PRO C C 98 176.600 177.735 -1.135 1
1 1238 . 5 1 1 A 98 98 PRO CA C 98 63.100 63.838 -0.738 1
1 1239 . 5 1 1 A 98 98 PRO CB C 98 31.800 31.915 -0.115 1
1 1242 . 5 1 1 A 99 99 LEU H H 99 8.200 7.744 0.456 1
1 1243 . 5 1 1 A 99 99 LEU HA H 99 4.200 3.882 0.318 1
1 1253 . 5 1 1 A 99 99 LEU C C 99 177.300 176.775 0.525 1
1 1254 . 5 1 1 A 99 99 LEU CA C 99 55.000 58.025 -3.025 1
1 1255 . 5 1 1 A 99 99 LEU CB C 99 42.400 41.972 0.428 1
1 1259 . 5 1 1 A 99 99 LEU N N 99 122.500 118.708 3.792 1
1 1260 . 5 1 1 A 100 100 GLU H H 100 8.250 8.021 0.229 1
1 1261 . 5 1 1 A 100 100 GLU HA H 100 4.140 4.029 0.111 1
1 1266 . 5 1 1 A 100 100 GLU C C 100 176.100 176.344 -0.244 1
1 1267 . 5 1 1 A 100 100 GLU CA C 100 56.100 57.036 -0.936 1
1 1268 . 5 1 1 A 100 100 GLU CB C 100 29.900 28.168 1.732 1
1 1270 . 5 1 1 A 100 100 GLU N N 100 121.000 118.238 2.762 1
1 1271 . 5 1 1 A 101 101 HIS H H 101 8.540 7.773 0.767 1
1 1272 . 5 1 1 A 101 101 HIS HA H 101 4.600 4.158 0.442 1
1 1275 . 5 1 1 A 101 101 HIS C C 101 174.200 175.334 -1.134 1
1 1276 . 5 1 1 A 101 101 HIS CA C 101 55.200 59.620 -4.420 1
1 1277 . 5 1 1 A 101 101 HIS CB C 101 29.000 29.766 -0.766 1
1 1278 . 5 1 1 A 101 101 HIS N N 101 119.400 124.793 -5.393 1
1 1279 . 5 1 1 A 102 102 HIS H H 102 8.660 7.567 1.093 1
1 1280 . 5 1 1 A 102 102 HIS HA H 102 4.630 4.444 0.186 1
1 1283 . 5 1 1 A 102 102 HIS C C 102 174.200 175.421 -1.221 1
1 1284 . 5 1 1 A 102 102 HIS CA C 102 55.200 57.182 -1.982 1
1 1285 . 5 1 1 A 102 102 HIS CB C 102 29.100 30.509 -1.409 1
1 1286 . 5 1 1 A 102 102 HIS N N 102 119.700 117.248 2.452 1
1 1287 . 5 1 1 A 103 103 HIS H H 103 8.680 8.973 -0.293 1
1 1288 . 5 1 1 A 103 103 HIS HA H 103 4.640 5.254 -0.614 1
1 1291 . 5 1 1 A 103 103 HIS C C 103 174.200 174.522 -0.322 1
1 1292 . 5 1 1 A 103 103 HIS CA C 103 55.200 54.652 0.548 1
1 1293 . 5 1 1 A 103 103 HIS CB C 103 29.200 33.777 -4.577 1
1 1294 . 5 1 1 A 103 103 HIS N N 103 120.500 118.872 1.628 1
1 1295 . 5 1 1 A 104 104 HIS H H 104 8.580 9.068 -0.488 1
1 1296 . 5 1 1 A 104 104 HIS HA H 104 4.590 4.764 -0.174 1
1 1299 . 5 1 1 A 104 104 HIS C C 104 174.200 173.814 0.386 1
1 1300 . 5 1 1 A 104 104 HIS CA C 104 55.200 55.536 -0.336 1
1 1301 . 5 1 1 A 104 104 HIS CB C 104 29.300 30.965 -1.665 1
1 1302 . 5 1 1 A 104 104 HIS N N 104 120.700 122.242 -1.542 1
1 1303 . 5 1 1 A 105 105 HIS H H 105 8.550 8.242 0.308 1
1 1304 . 5 1 1 A 105 105 HIS HA H 105 4.610 4.682 -0.072 1
1 1307 . 5 1 1 A 105 105 HIS C C 105 173.500 174.858 -1.358 1
1 1308 . 5 1 1 A 105 105 HIS CA C 105 55.400 54.454 0.946 1
1 1309 . 5 1 1 A 105 105 HIS CB C 105 28.800 29.953 -1.153 1
1 1310 . 5 1 1 A 105 105 HIS N N 105 119.000 120.182 -1.182 1
1 7 . 6 1 1 A 2 2 ASP H H 2 8.890 7.749 1.141 1
1 8 . 6 1 1 A 2 2 ASP HA H 2 4.740 4.605 0.135 1
1 11 . 6 1 1 A 2 2 ASP C C 2 174.600 175.119 -0.519 1
1 12 . 6 1 1 A 2 2 ASP CA C 2 53.800 54.136 -0.336 1
1 13 . 6 1 1 A 2 2 ASP CB C 2 41.500 41.221 0.279 1
1 14 . 6 1 1 A 2 2 ASP N N 2 122.100 121.109 0.991 1
1 15 . 6 1 1 A 3 3 LEU H H 3 8.280 8.373 -0.093 1
1 16 . 6 1 1 A 3 3 LEU HA H 3 4.420 4.644 -0.224 1
1 26 . 6 1 1 A 3 3 LEU C C 3 176.900 176.147 0.753 1
1 27 . 6 1 1 A 3 3 LEU CA C 3 55.000 55.484 -0.484 1
1 28 . 6 1 1 A 3 3 LEU CB C 3 42.700 42.612 0.088 1
1 32 . 6 1 1 A 3 3 LEU N N 3 122.300 126.154 -3.854 1
1 33 . 6 1 1 A 4 4 VAL H H 4 8.640 8.575 0.065 1
1 34 . 6 1 1 A 4 4 VAL HA H 4 4.540 4.970 -0.430 1
1 42 . 6 1 1 A 4 4 VAL C C 4 175.800 174.999 0.801 1
1 43 . 6 1 1 A 4 4 VAL CA C 4 59.400 58.694 0.706 1
1 44 . 6 1 1 A 4 4 VAL CB C 4 35.400 36.023 -0.623 1
1 47 . 6 1 1 A 4 4 VAL N N 4 122.600 119.495 3.105 1
1 48 . 6 1 1 A 5 5 LYS H H 5 8.630 8.634 -0.004 1
1 49 . 6 1 1 A 5 5 LYS HA H 5 4.450 4.359 0.091 1
1 58 . 6 1 1 A 5 5 LYS C C 5 179.400 178.471 0.929 1
1 59 . 6 1 1 A 5 5 LYS CA C 5 53.600 55.862 -2.262 1
1 60 . 6 1 1 A 5 5 LYS CB C 5 30.900 33.301 -2.401 1
1 64 . 6 1 1 A 5 5 LYS N N 5 121.100 121.394 -0.294 1
1 65 . 6 1 1 A 6 6 ILE H H 6 10.320 8.890 1.430 1
1 66 . 6 1 1 A 6 6 ILE HA H 6 3.440 3.712 -0.272 1
1 76 . 6 1 1 A 6 6 ILE C C 6 178.300 177.628 0.672 1
1 77 . 6 1 1 A 6 6 ILE CA C 6 65.700 65.019 0.681 1
1 78 . 6 1 1 A 6 6 ILE CB C 6 35.900 37.685 -1.785 1
1 82 . 6 1 1 A 6 6 ILE N N 6 125.400 122.538 2.862 1
1 83 . 6 1 1 A 7 7 ARG H H 7 8.210 8.003 0.207 1
1 84 . 6 1 1 A 7 7 ARG HA H 7 3.850 4.216 -0.366 1
1 92 . 6 1 1 A 7 7 ARG C C 7 175.600 177.146 -1.546 1
1 93 . 6 1 1 A 7 7 ARG CA C 7 57.800 58.700 -0.900 1
1 94 . 6 1 1 A 7 7 ARG CB C 7 30.300 30.096 0.204 1
1 98 . 6 1 1 A 7 7 ARG N N 7 118.800 120.603 -1.803 1
1 100 . 6 1 1 A 8 8 ASP H H 8 7.850 7.546 0.304 1
1 101 . 6 1 1 A 8 8 ASP HA H 8 4.700 4.679 0.021 1
1 104 . 6 1 1 A 8 8 ASP C C 8 176.100 176.503 -0.403 1
1 105 . 6 1 1 A 8 8 ASP CA C 8 54.100 54.389 -0.289 1
1 106 . 6 1 1 A 8 8 ASP CB C 8 41.200 41.100 0.100 1
1 107 . 6 1 1 A 8 8 ASP N N 8 116.800 119.201 -2.401 1
1 108 . 6 1 1 A 9 9 VAL H H 9 7.240 7.423 -0.183 1
1 109 . 6 1 1 A 9 9 VAL HA H 9 3.710 3.955 -0.245 1
1 117 . 6 1 1 A 9 9 VAL C C 9 174.900 175.588 -0.688 1
1 118 . 6 1 1 A 9 9 VAL CA C 9 64.300 63.360 0.940 1
1 119 . 6 1 1 A 9 9 VAL CB C 9 31.500 31.734 -0.234 1
1 122 . 6 1 1 A 9 9 VAL N N 9 121.800 121.450 0.350 1
1 123 . 6 1 1 A 10 10 SER H H 10 8.600 8.206 0.394 1
1 124 . 6 1 1 A 10 10 SER HA H 10 4.600 4.672 -0.072 1
1 127 . 6 1 1 A 10 10 SER CA C 10 56.700 56.858 -0.158 1
1 128 . 6 1 1 A 10 10 SER CB C 10 66.100 65.700 0.400 1
1 129 . 6 1 1 A 10 10 SER N N 10 122.200 120.643 1.557 1
1 130 . 6 1 1 A 11 11 LEU H H 11 8.660 8.969 -0.309 1
1 131 . 6 1 1 A 11 11 LEU HA H 11 3.900 3.950 -0.050 1
1 141 . 6 1 1 A 11 11 LEU C C 11 178.100 178.671 -0.571 1
1 142 . 6 1 1 A 11 11 LEU CA C 11 56.700 58.058 -1.358 1
1 143 . 6 1 1 A 11 11 LEU CB C 11 41.400 41.143 0.257 1
1 147 . 6 1 1 A 11 11 LEU N N 11 120.300 123.294 -2.994 1
1 148 . 6 1 1 A 12 12 SER H H 12 8.160 8.174 -0.014 1
1 149 . 6 1 1 A 12 12 SER HA H 12 4.270 4.366 -0.096 1
1 152 . 6 1 1 A 12 12 SER C C 12 174.200 175.316 -1.116 1
1 153 . 6 1 1 A 12 12 SER CA C 12 59.900 61.959 -2.059 1
1 154 . 6 1 1 A 12 12 SER CB C 12 63.100 63.064 0.036 1
1 155 . 6 1 1 A 12 12 SER N N 12 112.100 113.499 -1.399 1
1 156 . 6 1 1 A 13 13 THR H H 13 7.460 7.630 -0.170 1
1 157 . 6 1 1 A 13 13 THR HA H 13 4.760 4.663 0.097 1
1 162 . 6 1 1 A 13 13 THR CA C 13 56.600 58.990 -2.390 1
1 163 . 6 1 1 A 13 13 THR CB C 13 70.100 68.942 1.158 1
1 165 . 6 1 1 A 13 13 THR N N 13 114.700 107.992 6.708 1
1 166 . 6 1 1 A 14 14 PRO HA H 14 4.050 4.358 -0.308 1
1 173 . 6 1 1 A 14 14 PRO C C 14 175.800 175.816 -0.016 1
1 174 . 6 1 1 A 14 14 PRO CA C 14 65.100 64.376 0.724 1
1 175 . 6 1 1 A 14 14 PRO CB C 14 32.100 31.653 0.447 1
1 178 . 6 1 1 A 15 15 TYR H H 15 7.380 7.520 -0.140 1
1 179 . 6 1 1 A 15 15 TYR HA H 15 5.570 5.547 0.023 1
1 186 . 6 1 1 A 15 15 TYR C C 15 176.100 175.075 1.025 1
1 187 . 6 1 1 A 15 15 TYR CA C 15 56.400 56.827 -0.427 1
1 188 . 6 1 1 A 15 15 TYR CB C 15 41.500 40.143 1.357 1
1 193 . 6 1 1 A 15 15 TYR N N 15 113.800 117.731 -3.931 1
1 194 . 6 1 1 A 16 16 VAL H H 16 9.010 8.661 0.349 1
1 195 . 6 1 1 A 16 16 VAL HA H 16 4.920 5.108 -0.188 1
1 203 . 6 1 1 A 16 16 VAL C C 16 174.300 173.389 0.911 1
1 204 . 6 1 1 A 16 16 VAL CA C 16 59.600 59.405 0.195 1
1 205 . 6 1 1 A 16 16 VAL CB C 16 36.800 36.274 0.526 1
1 208 . 6 1 1 A 16 16 VAL N N 16 113.800 118.438 -4.638 1
1 209 . 6 1 1 A 17 17 SER H H 17 7.960 8.945 -0.985 1
1 210 . 6 1 1 A 17 17 SER HA H 17 5.860 5.509 0.351 1
1 213 . 6 1 1 A 17 17 SER C C 17 172.700 173.283 -0.583 1
1 214 . 6 1 1 A 17 17 SER CA C 17 57.300 56.431 0.869 1
1 215 . 6 1 1 A 17 17 SER CB C 17 64.000 65.116 -1.116 1
1 216 . 6 1 1 A 17 17 SER N N 17 117.100 117.255 -0.155 1
1 217 . 6 1 1 A 18 18 VAL H H 18 8.570 8.802 -0.232 1
1 218 . 6 1 1 A 18 18 VAL HA H 18 4.900 5.160 -0.260 1
1 226 . 6 1 1 A 18 18 VAL C C 18 173.700 173.599 0.101 1
1 227 . 6 1 1 A 18 18 VAL CA C 18 58.800 59.169 -0.369 1
1 228 . 6 1 1 A 18 18 VAL CB C 18 36.700 35.949 0.751 1
1 231 . 6 1 1 A 18 18 VAL N N 18 113.500 119.421 -5.921 1
1 232 . 6 1 1 A 19 19 ILE H H 19 8.490 8.658 -0.168 1
1 233 . 6 1 1 A 19 19 ILE HA H 19 5.300 5.024 0.276 1
1 243 . 6 1 1 A 19 19 ILE C C 19 175.800 174.720 1.080 1
1 244 . 6 1 1 A 19 19 ILE CA C 19 59.700 59.284 0.416 1
1 245 . 6 1 1 A 19 19 ILE CB C 19 41.700 42.626 -0.926 1
1 249 . 6 1 1 A 19 19 ILE N N 19 120.600 121.828 -1.228 1
1 250 . 6 1 1 A 20 20 GLY H H 20 8.670 8.164 0.506 1
1 251 . 6 1 1 A 20 20 GLY HA2 H 20 3.760 4.187 -0.427 1
1 252 . 6 1 1 A 20 20 GLY HA3 H 20 4.190 4.191 -0.001 1
1 253 . 6 1 1 A 20 20 GLY C C 20 169.900 172.267 -2.367 1
1 254 . 6 1 1 A 20 20 GLY CA C 20 46.000 45.810 0.190 1
1 255 . 6 1 1 A 20 20 GLY N N 20 110.200 113.348 -3.148 1
1 256 . 6 1 1 A 21 21 LYS H H 21 8.920 8.359 0.561 1
1 257 . 6 1 1 A 21 21 LYS HA H 21 5.210 5.325 -0.115 1
1 266 . 6 1 1 A 21 21 LYS C C 21 176.400 175.116 1.284 1
1 267 . 6 1 1 A 21 21 LYS CA C 21 54.400 54.984 -0.584 1
1 268 . 6 1 1 A 21 21 LYS CB C 21 35.400 35.256 0.144 1
1 272 . 6 1 1 A 21 21 LYS N N 21 119.100 117.007 2.093 1
1 273 . 6 1 1 A 22 22 ILE H H 22 8.900 8.625 0.275 1
1 274 . 6 1 1 A 22 22 ILE HA H 22 5.050 5.237 -0.187 1
1 284 . 6 1 1 A 22 22 ILE C C 22 176.900 175.185 1.715 1
1 285 . 6 1 1 A 22 22 ILE CA C 22 57.800 60.310 -2.510 1
1 286 . 6 1 1 A 22 22 ILE CB C 22 36.200 39.527 -3.327 1
1 290 . 6 1 1 A 22 22 ILE N N 22 130.000 125.215 4.785 1
1 291 . 6 1 1 A 23 23 THR H H 23 9.020 8.904 0.116 1
1 292 . 6 1 1 A 23 23 THR HA H 23 4.660 4.858 -0.198 1
1 297 . 6 1 1 A 23 23 THR C C 23 174.000 173.937 0.063 1
1 298 . 6 1 1 A 23 23 THR CA C 23 60.800 59.944 0.856 1
1 299 . 6 1 1 A 23 23 THR CB C 23 73.400 71.724 1.676 1
1 301 . 6 1 1 A 23 23 THR N N 23 118.200 120.683 -2.483 1
1 302 . 6 1 1 A 24 24 GLY H H 24 8.430 8.565 -0.135 1
1 303 . 6 1 1 A 24 24 GLY HA2 H 24 3.910 3.944 -0.034 1
1 304 . 6 1 1 A 24 24 GLY HA3 H 24 3.910 4.085 -0.175 1
1 305 . 6 1 1 A 24 24 GLY C C 24 175.400 175.176 0.224 1
1 306 . 6 1 1 A 24 24 GLY CA C 24 47.100 46.938 0.162 1
1 307 . 6 1 1 A 24 24 GLY N N 24 107.200 114.805 -7.605 1
1 308 . 6 1 1 A 25 25 ILE H H 25 9.370 8.131 1.239 1
1 309 . 6 1 1 A 25 25 ILE HA H 25 4.480 4.238 0.242 1
1 319 . 6 1 1 A 25 25 ILE C C 25 178.200 175.576 2.624 1
1 320 . 6 1 1 A 25 25 ILE CA C 25 59.200 61.195 -1.995 1
1 321 . 6 1 1 A 25 25 ILE CB C 25 35.400 37.790 -2.390 1
1 325 . 6 1 1 A 25 25 ILE N N 25 120.600 120.765 -0.165 1
1 326 . 6 1 1 A 26 26 HIS H H 26 9.000 9.061 -0.061 1
1 327 . 6 1 1 A 26 26 HIS HA H 26 4.770 5.139 -0.369 1
1 330 . 6 1 1 A 26 26 HIS C C 26 172.700 174.091 -1.391 1
1 331 . 6 1 1 A 26 26 HIS CA C 26 55.000 54.356 0.644 1
1 332 . 6 1 1 A 26 26 HIS CB C 26 31.100 32.791 -1.691 1
1 333 . 6 1 1 A 26 26 HIS N N 26 123.800 125.644 -1.844 1
1 334 . 6 1 1 A 27 27 LYS H H 27 8.930 8.782 0.148 1
1 335 . 6 1 1 A 27 27 LYS HA H 27 4.770 4.348 0.422 1
1 344 . 6 1 1 A 27 27 LYS C C 27 175.300 175.464 -0.164 1
1 345 . 6 1 1 A 27 27 LYS CA C 27 55.100 56.267 -1.167 1
1 346 . 6 1 1 A 27 27 LYS CB C 27 34.400 33.252 1.148 1
1 350 . 6 1 1 A 27 27 LYS N N 27 125.900 124.764 1.136 1
1 351 . 6 1 1 A 28 28 LYS H H 28 8.880 8.567 0.313 1
1 352 . 6 1 1 A 28 28 LYS HA H 28 4.570 4.985 -0.415 1
1 361 . 6 1 1 A 28 28 LYS C C 28 174.500 174.875 -0.375 1
1 362 . 6 1 1 A 28 28 LYS CA C 28 54.600 54.568 0.032 1
1 363 . 6 1 1 A 28 28 LYS CB C 28 35.300 36.889 -1.589 1
1 367 . 6 1 1 A 28 28 LYS N N 28 127.400 125.176 2.224 1
1 368 . 6 1 1 A 29 29 GLU H H 29 8.440 8.437 0.003 1
1 369 . 6 1 1 A 29 29 GLU HA H 29 5.260 5.152 0.108 1
1 374 . 6 1 1 A 29 29 GLU C C 29 175.800 175.465 0.335 1
1 375 . 6 1 1 A 29 29 GLU CA C 29 54.800 54.805 -0.005 1
1 376 . 6 1 1 A 29 29 GLU CB C 29 31.500 32.977 -1.477 1
1 378 . 6 1 1 A 29 29 GLU N N 29 122.200 120.754 1.446 1
1 379 . 6 1 1 A 30 30 TYR H H 30 8.960 8.706 0.254 1
1 380 . 6 1 1 A 30 30 TYR HA H 30 4.820 5.501 -0.681 1
1 387 . 6 1 1 A 30 30 TYR C C 30 172.600 172.964 -0.364 1
1 388 . 6 1 1 A 30 30 TYR CA C 30 56.300 55.338 0.962 1
1 389 . 6 1 1 A 30 30 TYR CB C 30 40.500 41.823 -1.323 1
1 394 . 6 1 1 A 30 30 TYR N N 30 121.100 118.817 2.283 1
1 395 . 6 1 1 A 31 31 GLU H H 31 8.610 8.776 -0.166 1
1 396 . 6 1 1 A 31 31 GLU HA H 31 4.810 4.470 0.340 1
1 401 . 6 1 1 A 31 31 GLU C C 31 176.100 176.168 -0.068 1
1 402 . 6 1 1 A 31 31 GLU CA C 31 55.100 55.752 -0.652 1
1 403 . 6 1 1 A 31 31 GLU CB C 31 30.300 30.074 0.226 1
1 405 . 6 1 1 A 31 31 GLU N N 31 121.800 120.846 0.954 1
1 406 . 6 1 1 A 32 32 SER H H 32 8.570 8.843 -0.273 1
1 407 . 6 1 1 A 32 32 SER HA H 32 4.520 4.621 -0.101 1
1 410 . 6 1 1 A 32 32 SER C C 32 174.300 172.944 1.356 1
1 411 . 6 1 1 A 32 32 SER CA C 32 57.300 56.458 0.842 1
1 412 . 6 1 1 A 32 32 SER CB C 32 64.100 65.063 -0.963 1
1 413 . 6 1 1 A 32 32 SER N N 32 118.500 120.115 -1.615 1
1 414 . 6 1 1 A 33 33 ASP H H 33 9.290 8.521 0.769 1
1 415 . 6 1 1 A 33 33 ASP HA H 33 4.340 4.508 -0.168 1
1 418 . 6 1 1 A 33 33 ASP C C 33 175.900 176.909 -1.009 1
1 419 . 6 1 1 A 33 33 ASP CA C 33 55.000 53.600 1.400 1
1 420 . 6 1 1 A 33 33 ASP CB C 33 39.300 39.474 -0.174 1
1 421 . 6 1 1 A 33 33 ASP N N 33 125.700 123.084 2.616 1
1 422 . 6 1 1 A 34 34 GLY H H 34 8.690 9.021 -0.331 1
1 423 . 6 1 1 A 34 34 GLY HA2 H 34 3.660 3.897 -0.237 1
1 424 . 6 1 1 A 34 34 GLY HA3 H 34 4.140 3.900 0.240 1
1 425 . 6 1 1 A 34 34 GLY C C 34 174.200 173.605 0.595 1
1 426 . 6 1 1 A 34 34 GLY CA C 34 45.600 46.131 -0.531 1
1 427 . 6 1 1 A 34 34 GLY N N 34 104.800 111.726 -6.926 1
1 428 . 6 1 1 A 35 35 THR H H 35 7.840 7.631 0.209 1
1 429 . 6 1 1 A 35 35 THR HA H 35 4.660 4.788 -0.128 1
1 434 . 6 1 1 A 35 35 THR C C 35 173.000 173.331 -0.331 1
1 435 . 6 1 1 A 35 35 THR CA C 35 60.200 61.106 -0.906 1
1 436 . 6 1 1 A 35 35 THR CB C 35 71.200 72.425 -1.225 1
1 438 . 6 1 1 A 35 35 THR N N 35 114.800 114.651 0.149 1
1 439 . 6 1 1 A 36 36 THR H H 36 8.480 8.718 -0.238 1
1 440 . 6 1 1 A 36 36 THR HA H 36 4.620 4.568 0.052 1
1 445 . 6 1 1 A 36 36 THR C C 36 173.800 174.118 -0.318 1
1 446 . 6 1 1 A 36 36 THR CA C 36 62.300 62.553 -0.253 1
1 447 . 6 1 1 A 36 36 THR CB C 36 69.500 69.400 0.100 1
1 449 . 6 1 1 A 36 36 THR N N 36 119.400 121.592 -2.192 1
1 450 . 6 1 1 A 37 37 LYS H H 37 8.880 8.340 0.540 1
1 451 . 6 1 1 A 37 37 LYS HA H 37 4.570 4.813 -0.243 1
1 460 . 6 1 1 A 37 37 LYS C C 37 174.500 175.089 -0.589 1
1 461 . 6 1 1 A 37 37 LYS CA C 37 54.600 53.975 0.625 1
1 462 . 6 1 1 A 37 37 LYS CB C 37 35.500 36.027 -0.527 1
1 466 . 6 1 1 A 37 37 LYS N N 37 128.000 125.686 2.314 1
1 467 . 6 1 1 A 38 38 SER H H 38 8.370 8.729 -0.359 1
1 468 . 6 1 1 A 38 38 SER HA H 38 5.250 4.741 0.509 1
1 471 . 6 1 1 A 38 38 SER C C 38 173.200 173.726 -0.526 1
1 472 . 6 1 1 A 38 38 SER CA C 38 57.900 58.484 -0.584 1
1 473 . 6 1 1 A 38 38 SER CB C 38 65.500 63.699 1.801 1
1 474 . 6 1 1 A 38 38 SER N N 38 114.300 119.212 -4.912 1
1 475 . 6 1 1 A 39 39 VAL H H 39 9.020 8.736 0.284 1
1 476 . 6 1 1 A 39 39 VAL HA H 39 4.900 4.901 -0.001 1
1 484 . 6 1 1 A 39 39 VAL C C 39 173.200 172.741 0.459 1
1 485 . 6 1 1 A 39 39 VAL CA C 39 59.200 59.567 -0.367 1
1 486 . 6 1 1 A 39 39 VAL CB C 39 34.600 35.356 -0.756 1
1 489 . 6 1 1 A 39 39 VAL N N 39 123.600 124.229 -0.629 1
1 490 . 6 1 1 A 40 40 TYR H H 40 8.900 8.645 0.255 1
1 491 . 6 1 1 A 40 40 TYR HA H 40 4.730 5.391 -0.661 1
1 498 . 6 1 1 A 40 40 TYR CA C 40 56.500 56.730 -0.230 1
1 499 . 6 1 1 A 40 40 TYR CB C 40 39.000 40.738 -1.738 1
1 504 . 6 1 1 A 40 40 TYR N N 40 126.300 127.436 -1.136 1
1 505 . 6 1 1 A 41 41 GLN H H 41 8.630 8.391 0.239 1
1 506 . 6 1 1 A 41 41 GLN HA H 41 5.330 5.199 0.131 1
1 513 . 6 1 1 A 41 41 GLN C C 41 175.500 175.772 -0.272 1
1 514 . 6 1 1 A 41 41 GLN CA C 41 53.800 54.169 -0.369 1
1 515 . 6 1 1 A 41 41 GLN CB C 41 32.100 31.797 0.303 1
1 518 . 6 1 1 A 41 41 GLN N N 41 122.000 121.939 0.061 1
1 520 . 6 1 1 A 42 42 GLY H H 42 8.560 7.864 0.696 1
1 521 . 6 1 1 A 42 42 GLY HA2 H 42 3.680 4.353 -0.673 1
1 522 . 6 1 1 A 42 42 GLY HA3 H 42 4.020 4.406 -0.386 1
1 523 . 6 1 1 A 42 42 GLY C C 42 171.600 170.981 0.619 1
1 524 . 6 1 1 A 42 42 GLY CA C 42 47.300 46.144 1.156 1
1 525 . 6 1 1 A 42 42 GLY N N 42 113.000 108.879 4.121 1
1 526 . 6 1 1 A 43 43 TYR H H 43 9.320 8.626 0.694 1
1 527 . 6 1 1 A 43 43 TYR HA H 43 5.280 5.500 -0.220 1
1 534 . 6 1 1 A 43 43 TYR C C 43 173.200 174.125 -0.925 1
1 535 . 6 1 1 A 43 43 TYR CA C 43 57.600 56.597 1.003 1
1 536 . 6 1 1 A 43 43 TYR CB C 43 42.400 43.361 -0.961 1
1 541 . 6 1 1 A 43 43 TYR N N 43 126.300 117.743 8.557 1
1 542 . 6 1 1 A 44 44 ILE H H 44 9.160 8.826 0.334 1
1 543 . 6 1 1 A 44 44 ILE HA H 44 5.270 5.428 -0.158 1
1 553 . 6 1 1 A 44 44 ILE C C 44 172.900 173.515 -0.615 1
1 554 . 6 1 1 A 44 44 ILE CA C 44 59.000 59.547 -0.547 1
1 555 . 6 1 1 A 44 44 ILE CB C 44 42.200 42.240 -0.040 1
1 559 . 6 1 1 A 44 44 ILE N N 44 117.700 122.072 -4.372 1
1 560 . 6 1 1 A 45 45 GLU H H 45 8.420 8.711 -0.291 1
1 561 . 6 1 1 A 45 45 GLU HA H 45 5.600 5.417 0.183 1
1 566 . 6 1 1 A 45 45 GLU C C 45 174.300 174.419 -0.119 1
1 567 . 6 1 1 A 45 45 GLU CA C 45 54.000 54.673 -0.673 1
1 568 . 6 1 1 A 45 45 GLU CB C 45 34.400 33.852 0.548 1
1 570 . 6 1 1 A 45 45 GLU N N 45 123.600 127.872 -4.272 1
1 571 . 6 1 1 A 46 46 ASP H H 46 8.530 8.579 -0.049 1
1 572 . 6 1 1 A 46 46 ASP HA H 46 5.070 4.906 0.164 1
1 575 . 6 1 1 A 46 46 ASP C C 46 175.000 176.054 -1.054 1
1 576 . 6 1 1 A 46 46 ASP CA C 46 51.800 53.086 -1.286 1
1 577 . 6 1 1 A 46 46 ASP CB C 46 41.300 41.595 -0.295 1
1 578 . 6 1 1 A 46 46 ASP N N 46 125.500 123.371 2.129 1
1 579 . 6 1 1 A 47 47 ASP H H 47 9.160 8.720 0.440 1
1 580 . 6 1 1 A 47 47 ASP HA H 47 4.430 4.547 -0.117 1
1 583 . 6 1 1 A 47 47 ASP C C 47 176.000 177.701 -1.701 1
1 584 . 6 1 1 A 47 47 ASP CA C 47 55.000 55.433 -0.433 1
1 585 . 6 1 1 A 47 47 ASP CB C 47 38.900 40.893 -1.993 1
1 586 . 6 1 1 A 47 47 ASP N N 47 114.200 118.241 -4.041 1
1 587 . 6 1 1 A 48 48 THR H H 48 9.470 8.311 1.159 1
1 588 . 6 1 1 A 48 48 THR HA H 48 4.520 4.465 0.055 1
1 593 . 6 1 1 A 48 48 THR C C 48 174.500 175.017 -0.517 1
1 594 . 6 1 1 A 48 48 THR CA C 48 62.600 62.320 0.280 1
1 595 . 6 1 1 A 48 48 THR CB C 48 70.400 69.368 1.032 1
1 597 . 6 1 1 A 48 48 THR N N 48 111.800 108.226 3.574 1
1 598 . 6 1 1 A 49 49 ALA H H 49 7.850 7.675 0.175 1
1 599 . 6 1 1 A 49 49 ALA HA H 49 4.440 4.437 0.003 1
1 603 . 6 1 1 A 49 49 ALA C C 49 173.200 175.511 -2.311 1
1 604 . 6 1 1 A 49 49 ALA CA C 49 52.700 51.361 1.339 1
1 605 . 6 1 1 A 49 49 ALA CB C 49 21.300 20.212 1.088 1
1 606 . 6 1 1 A 49 49 ALA N N 49 123.400 120.517 2.883 1
1 607 . 6 1 1 A 50 50 ARG H H 50 8.160 8.800 -0.640 1
1 608 . 6 1 1 A 50 50 ARG HA H 50 5.350 5.620 -0.270 1
1 616 . 6 1 1 A 50 50 ARG C C 50 174.700 174.285 0.415 1
1 617 . 6 1 1 A 50 50 ARG CA C 50 54.000 54.537 -0.537 1
1 618 . 6 1 1 A 50 50 ARG CB C 50 34.500 34.398 0.102 1
1 622 . 6 1 1 A 50 50 ARG N N 50 117.400 115.734 1.666 1
1 624 . 6 1 1 A 51 51 ILE H H 51 9.390 8.611 0.779 1
1 625 . 6 1 1 A 51 51 ILE HA H 51 4.790 4.963 -0.173 1
1 635 . 6 1 1 A 51 51 ILE C C 51 172.600 173.123 -0.523 1
1 636 . 6 1 1 A 51 51 ILE CA C 51 60.000 59.208 0.792 1
1 637 . 6 1 1 A 51 51 ILE CB C 51 42.800 41.862 0.938 1
1 641 . 6 1 1 A 51 51 ILE N N 51 124.600 121.068 3.532 1
1 642 . 6 1 1 A 52 52 ARG H H 52 7.980 8.586 -0.606 1
1 643 . 6 1 1 A 52 52 ARG HA H 52 4.170 4.247 -0.077 1
1 651 . 6 1 1 A 52 52 ARG C C 52 174.600 175.927 -1.327 1
1 652 . 6 1 1 A 52 52 ARG CA C 52 57.100 56.268 0.832 1
1 653 . 6 1 1 A 52 52 ARG CB C 52 31.300 30.954 0.346 1
1 657 . 6 1 1 A 52 52 ARG N N 52 125.900 129.752 -3.852 1
1 659 . 6 1 1 A 53 53 ILE H H 53 8.290 8.472 -0.182 1
1 660 . 6 1 1 A 53 53 ILE HA H 53 5.160 5.198 -0.038 1
1 670 . 6 1 1 A 53 53 ILE C C 53 172.400 174.015 -1.615 1
1 671 . 6 1 1 A 53 53 ILE CA C 53 58.600 58.931 -0.331 1
1 672 . 6 1 1 A 53 53 ILE CB C 53 41.900 42.531 -0.631 1
1 676 . 6 1 1 A 53 53 ILE N N 53 118.500 120.712 -2.212 1
1 677 . 6 1 1 A 54 54 SER H H 54 8.350 8.621 -0.271 1
1 678 . 6 1 1 A 54 54 SER HA H 54 5.070 5.193 -0.123 1
1 681 . 6 1 1 A 54 54 SER C C 54 172.400 172.313 0.087 1
1 682 . 6 1 1 A 54 54 SER CA C 54 57.000 56.656 0.344 1
1 683 . 6 1 1 A 54 54 SER CB C 54 65.900 65.135 0.765 1
1 684 . 6 1 1 A 54 54 SER N N 54 120.700 117.634 3.066 1
1 685 . 6 1 1 A 55 55 SER H H 55 9.130 8.936 0.194 1
1 686 . 6 1 1 A 55 55 SER HA H 55 5.270 5.121 0.149 1
1 690 . 6 1 1 A 55 55 SER C C 55 174.400 172.711 1.689 1
1 691 . 6 1 1 A 55 55 SER CA C 55 55.500 56.509 -1.009 1
1 692 . 6 1 1 A 55 55 SER CB C 55 64.500 64.870 -0.370 1
1 693 . 6 1 1 A 55 55 SER N N 55 117.200 119.473 -2.273 1
1 694 . 6 1 1 A 56 56 PHE H H 56 8.970 8.696 0.274 1
1 695 . 6 1 1 A 56 56 PHE HA H 56 4.600 4.923 -0.323 1
1 703 . 6 1 1 A 56 56 PHE C C 56 176.500 177.096 -0.596 1
1 704 . 6 1 1 A 56 56 PHE CA C 56 58.300 57.246 1.054 1
1 705 . 6 1 1 A 56 56 PHE CB C 56 37.900 40.850 -2.950 1
1 711 . 6 1 1 A 56 56 PHE N N 56 129.400 125.945 3.455 1
1 712 . 6 1 1 A 57 57 GLY H H 57 8.570 8.815 -0.245 1
1 713 . 6 1 1 A 57 57 GLY HA2 H 57 4.020 4.146 -0.126 1
1 714 . 6 1 1 A 57 57 GLY HA3 H 57 4.380 4.154 0.226 1
1 715 . 6 1 1 A 57 57 GLY C C 57 173.700 174.285 -0.585 1
1 716 . 6 1 1 A 57 57 GLY CA C 57 46.300 45.688 0.612 1
1 717 . 6 1 1 A 57 57 GLY N N 57 112.500 112.266 0.234 1
1 718 . 6 1 1 A 58 58 LYS H H 58 6.800 8.327 -1.527 1
1 719 . 6 1 1 A 58 58 LYS HA H 58 4.410 4.422 -0.012 1
1 728 . 6 1 1 A 58 58 LYS C C 58 174.800 175.693 -0.893 1
1 729 . 6 1 1 A 58 58 LYS CA C 58 55.200 56.501 -1.301 1
1 730 . 6 1 1 A 58 58 LYS CB C 58 33.300 33.440 -0.140 1
1 734 . 6 1 1 A 58 58 LYS N N 58 118.700 121.182 -2.482 1
1 735 . 6 1 1 A 59 59 GLN H H 59 8.390 8.659 -0.269 1
1 736 . 6 1 1 A 59 59 GLN HA H 59 1.830 4.050 -2.220 1
1 743 . 6 1 1 A 59 59 GLN C C 59 174.100 174.386 -0.286 1
1 744 . 6 1 1 A 59 59 GLN CA C 59 57.100 54.899 2.201 1
1 745 . 6 1 1 A 59 59 GLN CB C 59 28.900 29.721 -0.821 1
1 748 . 6 1 1 A 59 59 GLN N N 59 124.000 123.629 0.371 1
1 750 . 6 1 1 A 60 60 LEU H H 60 5.320 8.132 -2.812 1
1 751 . 6 1 1 A 60 60 LEU HA H 60 4.370 4.862 -0.492 1
1 761 . 6 1 1 A 60 60 LEU CA C 60 52.800 53.442 -0.642 1
1 762 . 6 1 1 A 60 60 LEU CB C 60 46.700 45.868 0.832 1
1 766 . 6 1 1 A 60 60 LEU N N 60 121.800 124.469 -2.669 1
1 767 . 6 1 1 A 61 61 GLN H H 61 8.660 8.373 0.287 1
1 768 . 6 1 1 A 61 61 GLN HA H 61 4.440 4.631 -0.191 1
1 775 . 6 1 1 A 61 61 GLN C C 61 174.000 174.984 -0.984 1
1 776 . 6 1 1 A 61 61 GLN CA C 61 53.800 53.796 0.004 1
1 777 . 6 1 1 A 61 61 GLN CB C 61 31.800 30.780 1.020 1
1 780 . 6 1 1 A 61 61 GLN N N 61 120.300 120.401 -0.101 1
1 782 . 6 1 1 A 62 62 ASP H H 62 8.450 8.681 -0.231 1
1 783 . 6 1 1 A 62 62 ASP HA H 62 4.130 4.578 -0.448 1
1 786 . 6 1 1 A 62 62 ASP C C 62 177.200 176.140 1.060 1
1 787 . 6 1 1 A 62 62 ASP CA C 62 55.700 53.785 1.915 1
1 788 . 6 1 1 A 62 62 ASP CB C 62 39.400 41.362 -1.962 1
1 789 . 6 1 1 A 62 62 ASP N N 62 122.400 121.725 0.675 1
1 790 . 6 1 1 A 63 63 SER H H 63 9.210 8.917 0.293 1
1 791 . 6 1 1 A 63 63 SER HA H 63 3.850 4.158 -0.308 1
1 794 . 6 1 1 A 63 63 SER C C 63 173.200 173.644 -0.444 1
1 795 . 6 1 1 A 63 63 SER CA C 63 61.700 59.176 2.524 1
1 796 . 6 1 1 A 63 63 SER CB C 63 61.800 61.081 0.719 1
1 797 . 6 1 1 A 63 63 SER N N 63 114.300 116.820 -2.520 1
1 798 . 6 1 1 A 64 64 ASP H H 64 7.960 7.720 0.240 1
1 799 . 6 1 1 A 64 64 ASP HA H 64 4.540 4.943 -0.403 1
1 802 . 6 1 1 A 64 64 ASP C C 64 174.900 175.187 -0.287 1
1 803 . 6 1 1 A 64 64 ASP CA C 64 54.900 52.783 2.117 1
1 804 . 6 1 1 A 64 64 ASP CB C 64 40.900 41.953 -1.053 1
1 805 . 6 1 1 A 64 64 ASP N N 64 122.600 121.226 1.374 1
1 806 . 6 1 1 A 65 65 VAL H H 65 8.180 8.506 -0.326 1
1 807 . 6 1 1 A 65 65 VAL HA H 65 4.670 4.301 0.369 1
1 815 . 6 1 1 A 65 65 VAL C C 65 175.900 175.617 0.283 1
1 816 . 6 1 1 A 65 65 VAL CA C 65 62.300 62.633 -0.333 1
1 817 . 6 1 1 A 65 65 VAL CB C 65 31.700 30.885 0.815 1
1 820 . 6 1 1 A 65 65 VAL N N 65 123.100 124.695 -1.595 1
1 821 . 6 1 1 A 66 66 VAL H H 66 8.770 8.865 -0.095 1
1 822 . 6 1 1 A 66 66 VAL HA H 66 5.160 5.138 0.022 1
1 830 . 6 1 1 A 66 66 VAL C C 66 173.600 173.300 0.300 1
1 831 . 6 1 1 A 66 66 VAL CA C 66 58.100 58.789 -0.689 1
1 832 . 6 1 1 A 66 66 VAL CB C 66 35.700 36.164 -0.464 1
1 835 . 6 1 1 A 66 66 VAL N N 66 118.100 120.779 -2.679 1
1 836 . 6 1 1 A 67 67 ARG H H 67 8.880 8.654 0.226 1
1 837 . 6 1 1 A 67 67 ARG HA H 67 5.110 5.151 -0.041 1
1 845 . 6 1 1 A 67 67 ARG C C 67 175.300 174.546 0.754 1
1 846 . 6 1 1 A 67 67 ARG CA C 67 54.200 54.359 -0.159 1
1 847 . 6 1 1 A 67 67 ARG CB C 67 32.200 33.543 -1.343 1
1 851 . 6 1 1 A 67 67 ARG N N 67 120.200 121.677 -1.477 1
1 853 . 6 1 1 A 68 68 ILE H H 68 9.220 8.995 0.225 1
1 854 . 6 1 1 A 68 68 ILE HA H 68 4.990 4.663 0.327 1
1 864 . 6 1 1 A 68 68 ILE C C 68 174.900 174.654 0.246 1
1 865 . 6 1 1 A 68 68 ILE CA C 68 58.600 59.869 -1.269 1
1 866 . 6 1 1 A 68 68 ILE CB C 68 39.300 38.645 0.655 1
1 870 . 6 1 1 A 68 68 ILE N N 68 127.200 128.013 -0.813 1
1 871 . 6 1 1 A 69 69 ASP H H 69 9.110 8.941 0.169 1
1 872 . 6 1 1 A 69 69 ASP HA H 69 5.370 5.085 0.285 1
1 875 . 6 1 1 A 69 69 ASP C C 69 175.800 176.386 -0.586 1
1 876 . 6 1 1 A 69 69 ASP CA C 69 52.400 52.649 -0.249 1
1 877 . 6 1 1 A 69 69 ASP CB C 69 43.700 43.186 0.514 1
1 878 . 6 1 1 A 69 69 ASP N N 69 123.400 125.932 -2.532 1
1 879 . 6 1 1 A 70 70 ASN H H 70 8.300 9.096 -0.796 1
1 880 . 6 1 1 A 70 70 ASN HA H 70 4.160 4.402 -0.242 1
1 885 . 6 1 1 A 70 70 ASN C C 70 176.300 174.635 1.665 1
1 886 . 6 1 1 A 70 70 ASN CA C 70 54.300 54.177 0.123 1
1 887 . 6 1 1 A 70 70 ASN CB C 70 37.500 37.541 -0.041 1
1 889 . 6 1 1 A 70 70 ASN N N 70 119.800 121.127 -1.327 1
1 891 . 6 1 1 A 71 71 ALA H H 71 9.100 7.847 1.253 1
1 892 . 6 1 1 A 71 71 ALA HA H 71 4.500 4.487 0.013 1
1 896 . 6 1 1 A 71 71 ALA C C 71 175.700 176.614 -0.914 1
1 897 . 6 1 1 A 71 71 ALA CA C 71 51.900 52.990 -1.090 1
1 898 . 6 1 1 A 71 71 ALA CB C 71 19.600 19.948 -0.348 1
1 899 . 6 1 1 A 71 71 ALA N N 71 123.000 121.077 1.923 1
1 900 . 6 1 1 A 72 72 ARG H H 72 8.490 8.368 0.122 1
1 901 . 6 1 1 A 72 72 ARG HA H 72 4.720 4.867 -0.147 1
1 909 . 6 1 1 A 72 72 ARG C C 72 175.800 174.939 0.861 1
1 910 . 6 1 1 A 72 72 ARG CA C 72 54.400 54.833 -0.433 1
1 911 . 6 1 1 A 72 72 ARG CB C 72 32.700 31.942 0.758 1
1 915 . 6 1 1 A 72 72 ARG N N 72 122.500 122.803 -0.303 1
1 917 . 6 1 1 A 73 73 VAL H H 73 8.310 8.184 0.126 1
1 918 . 6 1 1 A 73 73 VAL HA H 73 4.250 4.559 -0.309 1
1 926 . 6 1 1 A 73 73 VAL C C 73 174.600 175.553 -0.953 1
1 927 . 6 1 1 A 73 73 VAL CA C 73 62.800 62.007 0.793 1
1 928 . 6 1 1 A 73 73 VAL CB C 73 32.100 32.115 -0.015 1
1 931 . 6 1 1 A 73 73 VAL N N 73 127.100 127.195 -0.095 1
1 932 . 6 1 1 A 74 74 ALA H H 74 8.880 8.855 0.025 1
1 933 . 6 1 1 A 74 74 ALA HA H 74 4.500 5.060 -0.560 1
1 937 . 6 1 1 A 74 74 ALA C C 74 174.800 174.765 0.035 1
1 938 . 6 1 1 A 74 74 ALA CA C 74 50.500 50.546 -0.046 1
1 939 . 6 1 1 A 74 74 ALA CB C 74 22.500 23.736 -1.236 1
1 940 . 6 1 1 A 74 74 ALA N N 74 131.000 128.604 2.396 1
1 941 . 6 1 1 A 75 75 GLN H H 75 8.280 8.556 -0.276 1
1 942 . 6 1 1 A 75 75 GLN HA H 75 4.910 4.961 -0.051 1
1 949 . 6 1 1 A 75 75 GLN C C 75 175.100 174.227 0.873 1
1 950 . 6 1 1 A 75 75 GLN CA C 75 54.600 54.033 0.567 1
1 951 . 6 1 1 A 75 75 GLN CB C 75 31.400 30.964 0.436 1
1 954 . 6 1 1 A 75 75 GLN N N 75 118.800 120.534 -1.734 1
1 956 . 6 1 1 A 76 76 PHE H H 76 8.710 9.308 -0.598 1
1 957 . 6 1 1 A 76 76 PHE HA H 76 4.660 4.924 -0.264 1
1 965 . 6 1 1 A 76 76 PHE C C 76 174.900 176.351 -1.451 1
1 966 . 6 1 1 A 76 76 PHE CA C 76 57.000 56.902 0.098 1
1 967 . 6 1 1 A 76 76 PHE CB C 76 41.000 41.679 -0.679 1
1 973 . 6 1 1 A 76 76 PHE N N 76 125.000 125.909 -0.909 1
1 974 . 6 1 1 A 77 77 ASN H H 77 9.040 9.512 -0.472 1
1 975 . 6 1 1 A 77 77 ASN HA H 77 4.170 4.530 -0.360 1
1 980 . 6 1 1 A 77 77 ASN C C 77 174.200 174.762 -0.562 1
1 981 . 6 1 1 A 77 77 ASN CA C 77 53.800 54.195 -0.395 1
1 982 . 6 1 1 A 77 77 ASN CB C 77 37.400 37.596 -0.196 1
1 984 . 6 1 1 A 77 77 ASN N N 77 123.200 123.058 0.142 1
1 986 . 6 1 1 A 78 78 GLY H H 78 8.370 8.576 -0.206 1
1 987 . 6 1 1 A 78 78 GLY HA2 H 78 3.410 3.651 -0.241 1
1 988 . 6 1 1 A 78 78 GLY HA3 H 78 3.980 3.703 0.277 1
1 989 . 6 1 1 A 78 78 GLY C C 78 173.800 173.167 0.633 1
1 990 . 6 1 1 A 78 78 GLY CA C 78 45.000 45.312 -0.312 1
1 991 . 6 1 1 A 78 78 GLY N N 78 103.300 104.182 -0.882 1
1 992 . 6 1 1 A 79 79 TYR H H 79 7.670 8.318 -0.648 1
1 993 . 6 1 1 A 79 79 TYR HA H 79 4.860 4.822 0.038 1
1 1000 . 6 1 1 A 79 79 TYR C C 79 174.800 175.548 -0.748 1
1 1001 . 6 1 1 A 79 79 TYR CA C 79 56.300 57.428 -1.128 1
1 1002 . 6 1 1 A 79 79 TYR CB C 79 40.800 40.781 0.019 1
1 1007 . 6 1 1 A 79 79 TYR N N 79 118.700 119.235 -0.535 1
1 1008 . 6 1 1 A 80 80 LEU H H 80 8.760 8.785 -0.025 1
1 1009 . 6 1 1 A 80 80 LEU HA H 80 4.830 4.476 0.354 1
1 1019 . 6 1 1 A 80 80 LEU C C 80 176.200 176.301 -0.101 1
1 1020 . 6 1 1 A 80 80 LEU CA C 80 54.700 55.138 -0.438 1
1 1021 . 6 1 1 A 80 80 LEU CB C 80 43.500 42.511 0.989 1
1 1025 . 6 1 1 A 80 80 LEU N N 80 122.600 126.209 -3.609 1
1 1026 . 6 1 1 A 81 81 SER H H 81 8.650 8.974 -0.324 1
1 1027 . 6 1 1 A 81 81 SER HA H 81 4.860 5.318 -0.458 1
1 1030 . 6 1 1 A 81 81 SER C C 81 172.600 172.336 0.264 1
1 1031 . 6 1 1 A 81 81 SER CA C 81 56.600 57.301 -0.701 1
1 1032 . 6 1 1 A 81 81 SER CB C 81 66.300 66.555 -0.255 1
1 1033 . 6 1 1 A 81 81 SER N N 81 114.700 117.294 -2.594 1
1 1034 . 6 1 1 A 82 82 LEU H H 82 8.680 8.524 0.156 1
1 1035 . 6 1 1 A 82 82 LEU HA H 82 5.190 5.189 0.001 1
1 1045 . 6 1 1 A 82 82 LEU C C 82 177.100 175.224 1.876 1
1 1046 . 6 1 1 A 82 82 LEU CA C 82 53.300 53.724 -0.424 1
1 1047 . 6 1 1 A 82 82 LEU CB C 82 43.800 43.907 -0.107 1
1 1051 . 6 1 1 A 82 82 LEU N N 82 119.800 122.278 -2.478 1
1 1052 . 6 1 1 A 83 83 SER H H 83 9.560 9.419 0.141 1
1 1053 . 6 1 1 A 83 83 SER HA H 83 5.390 5.235 0.155 1
1 1056 . 6 1 1 A 83 83 SER C C 83 174.200 173.225 0.975 1
1 1057 . 6 1 1 A 83 83 SER CA C 83 57.100 56.749 0.351 1
1 1058 . 6 1 1 A 83 83 SER CB C 83 64.400 64.757 -0.357 1
1 1059 . 6 1 1 A 83 83 SER N N 83 119.000 120.711 -1.711 1
1 1060 . 6 1 1 A 84 84 VAL H H 84 9.150 9.036 0.114 1
1 1061 . 6 1 1 A 84 84 VAL HA H 84 4.490 4.612 -0.122 1
1 1069 . 6 1 1 A 84 84 VAL C C 84 174.700 176.184 -1.484 1
1 1070 . 6 1 1 A 84 84 VAL CA C 84 61.300 61.327 -0.027 1
1 1071 . 6 1 1 A 84 84 VAL CB C 84 33.000 31.397 1.603 1
1 1074 . 6 1 1 A 84 84 VAL N N 84 128.300 127.394 0.906 1
1 1075 . 6 1 1 A 85 85 GLY H H 85 7.970 8.874 -0.904 1
1 1076 . 6 1 1 A 85 85 GLY HA2 H 85 4.030 4.221 -0.191 1
1 1077 . 6 1 1 A 85 85 GLY HA3 H 85 4.840 4.313 0.527 1
1 1078 . 6 1 1 A 85 85 GLY C C 85 175.800 174.775 1.025 1
1 1079 . 6 1 1 A 85 85 GLY CA C 85 44.800 44.544 0.256 1
1 1080 . 6 1 1 A 85 85 GLY N N 85 114.300 115.223 -0.923 1
1 1081 . 6 1 1 A 86 86 ASP H H 86 8.860 8.769 0.091 1
1 1082 . 6 1 1 A 86 86 ASP HA H 86 4.370 4.377 -0.007 1
1 1085 . 6 1 1 A 86 86 ASP C C 86 177.400 177.976 -0.576 1
1 1086 . 6 1 1 A 86 86 ASP CA C 86 57.400 56.986 0.414 1
1 1087 . 6 1 1 A 86 86 ASP CB C 86 40.600 40.415 0.185 1
1 1088 . 6 1 1 A 86 86 ASP N N 86 122.500 119.631 2.869 1
1 1089 . 6 1 1 A 87 87 SER H H 87 8.540 7.884 0.656 1
1 1090 . 6 1 1 A 87 87 SER HA H 87 4.620 4.419 0.201 1
1 1093 . 6 1 1 A 87 87 SER C C 87 174.700 174.419 0.281 1
1 1094 . 6 1 1 A 87 87 SER CA C 87 58.200 59.970 -1.770 1
1 1095 . 6 1 1 A 87 87 SER CB C 87 63.300 63.599 -0.299 1
1 1096 . 6 1 1 A 87 87 SER N N 87 112.100 112.811 -0.711 1
1 1097 . 6 1 1 A 88 88 SER H H 88 7.880 7.576 0.304 1
1 1098 . 6 1 1 A 88 88 SER HA H 88 5.050 4.520 0.530 1
1 1101 . 6 1 1 A 88 88 SER C C 88 172.700 173.408 -0.708 1
1 1102 . 6 1 1 A 88 88 SER CA C 88 57.600 57.714 -0.114 1
1 1103 . 6 1 1 A 88 88 SER CB C 88 64.300 65.182 -0.882 1
1 1104 . 6 1 1 A 88 88 SER N N 88 119.200 115.538 3.662 1
1 1105 . 6 1 1 A 89 89 ARG H H 89 8.350 8.270 0.080 1
1 1106 . 6 1 1 A 89 89 ARG HA H 89 4.720 5.211 -0.491 1
1 1114 . 6 1 1 A 89 89 ARG C C 89 174.200 174.972 -0.772 1
1 1115 . 6 1 1 A 89 89 ARG CA C 89 55.000 54.614 0.386 1
1 1116 . 6 1 1 A 89 89 ARG CB C 89 33.500 33.705 -0.205 1
1 1120 . 6 1 1 A 89 89 ARG N N 89 122.800 119.148 3.652 1
1 1122 . 6 1 1 A 90 90 ILE H H 90 8.530 9.055 -0.525 1
1 1123 . 6 1 1 A 90 90 ILE HA H 90 4.790 4.989 -0.199 1
1 1133 . 6 1 1 A 90 90 ILE C C 90 175.400 174.279 1.121 1
1 1134 . 6 1 1 A 90 90 ILE CA C 90 60.600 60.156 0.444 1
1 1135 . 6 1 1 A 90 90 ILE CB C 90 40.600 40.920 -0.320 1
1 1139 . 6 1 1 A 90 90 ILE N N 90 123.100 123.277 -0.177 1
1 1140 . 6 1 1 A 91 91 GLU H H 91 9.000 9.003 -0.003 1
1 1141 . 6 1 1 A 91 91 GLU HA H 91 4.730 5.004 -0.274 1
1 1146 . 6 1 1 A 91 91 GLU C C 91 175.100 175.465 -0.365 1
1 1147 . 6 1 1 A 91 91 GLU CA C 91 54.300 54.431 -0.131 1
1 1148 . 6 1 1 A 91 91 GLU CB C 91 32.400 32.427 -0.027 1
1 1150 . 6 1 1 A 91 91 GLU N N 91 126.400 128.358 -1.958 1
1 1151 . 6 1 1 A 92 92 SER H H 92 8.830 8.928 -0.098 1
1 1152 . 6 1 1 A 92 92 SER HA H 92 4.700 4.556 0.144 1
1 1155 . 6 1 1 A 92 92 SER C C 92 174.600 174.782 -0.182 1
1 1156 . 6 1 1 A 92 92 SER CA C 92 59.300 58.722 0.578 1
1 1157 . 6 1 1 A 92 92 SER CB C 92 63.100 63.972 -0.872 1
1 1158 . 6 1 1 A 92 92 SER N N 92 119.800 123.240 -3.440 1
1 1159 . 6 1 1 A 93 93 VAL H H 93 8.350 8.289 0.061 1
1 1160 . 6 1 1 A 93 93 VAL HA H 93 4.290 4.176 0.114 1
1 1168 . 6 1 1 A 93 93 VAL C C 93 175.100 175.985 -0.885 1
1 1169 . 6 1 1 A 93 93 VAL CA C 93 61.300 62.337 -1.037 1
1 1170 . 6 1 1 A 93 93 VAL CB C 93 33.900 32.758 1.142 1
1 1173 . 6 1 1 A 93 93 VAL N N 93 121.800 124.993 -3.193 1
1 1174 . 6 1 1 A 94 94 ASN H H 94 8.510 8.633 -0.123 1
1 1175 . 6 1 1 A 94 94 ASN HA H 94 4.770 4.613 0.157 1
1 1180 . 6 1 1 A 94 94 ASN C C 94 175.000 174.926 0.074 1
1 1181 . 6 1 1 A 94 94 ASN CA C 94 52.700 53.326 -0.626 1
1 1182 . 6 1 1 A 94 94 ASN CB C 94 38.500 38.685 -0.185 1
1 1184 . 6 1 1 A 94 94 ASN N N 94 121.800 125.265 -3.465 1
1 1186 . 6 1 1 A 95 95 VAL H H 95 7.860 8.071 -0.211 1
1 1187 . 6 1 1 A 95 95 VAL HA H 95 4.100 4.142 -0.042 1
1 1195 . 6 1 1 A 95 95 VAL C C 95 175.100 175.296 -0.196 1
1 1196 . 6 1 1 A 95 95 VAL CA C 95 61.700 62.413 -0.713 1
1 1197 . 6 1 1 A 95 95 VAL CB C 95 33.100 32.990 0.110 1
1 1200 . 6 1 1 A 95 95 VAL N N 95 119.700 123.338 -3.638 1
1 1201 . 6 1 1 A 96 96 ASN H H 96 8.490 8.731 -0.241 1
1 1202 . 6 1 1 A 96 96 ASN HA H 96 4.700 4.590 0.110 1
1 1207 . 6 1 1 A 96 96 ASN C C 96 174.600 175.164 -0.564 1
1 1208 . 6 1 1 A 96 96 ASN CA C 96 53.000 53.541 -0.541 1
1 1209 . 6 1 1 A 96 96 ASN CB C 96 39.000 38.772 0.228 1
1 1211 . 6 1 1 A 96 96 ASN N N 96 122.200 126.030 -3.830 1
1 1213 . 6 1 1 A 97 97 ILE H H 97 8.080 8.814 -0.734 1
1 1214 . 6 1 1 A 97 97 ILE HA H 97 4.370 3.715 0.655 1
1 1224 . 6 1 1 A 97 97 ILE CA C 97 58.600 61.839 -3.239 1
1 1225 . 6 1 1 A 97 97 ILE CB C 97 38.600 36.543 2.057 1
1 1229 . 6 1 1 A 97 97 ILE N N 97 123.500 117.069 6.431 1
1 1230 . 6 1 1 A 98 98 PRO HA H 98 4.360 4.555 -0.195 1
1 1237 . 6 1 1 A 98 98 PRO C C 98 176.600 175.964 0.636 1
1 1238 . 6 1 1 A 98 98 PRO CA C 98 63.100 62.861 0.239 1
1 1239 . 6 1 1 A 98 98 PRO CB C 98 31.800 31.958 -0.158 1
1 1242 . 6 1 1 A 99 99 LEU H H 99 8.200 8.386 -0.186 1
1 1243 . 6 1 1 A 99 99 LEU HA H 99 4.200 4.633 -0.433 1
1 1253 . 6 1 1 A 99 99 LEU C C 99 177.300 176.816 0.484 1
1 1254 . 6 1 1 A 99 99 LEU CA C 99 55.000 54.266 0.734 1
1 1255 . 6 1 1 A 99 99 LEU CB C 99 42.400 41.379 1.021 1
1 1259 . 6 1 1 A 99 99 LEU N N 99 122.500 123.420 -0.920 1
1 1260 . 6 1 1 A 100 100 GLU H H 100 8.250 8.715 -0.465 1
1 1261 . 6 1 1 A 100 100 GLU HA H 100 4.140 4.743 -0.603 1
1 1266 . 6 1 1 A 100 100 GLU C C 100 176.100 176.285 -0.185 1
1 1267 . 6 1 1 A 100 100 GLU CA C 100 56.100 55.310 0.790 1
1 1268 . 6 1 1 A 100 100 GLU CB C 100 29.900 30.857 -0.957 1
1 1270 . 6 1 1 A 100 100 GLU N N 100 121.000 126.167 -5.167 1
1 1271 . 6 1 1 A 101 101 HIS H H 101 8.540 9.187 -0.647 1
1 1272 . 6 1 1 A 101 101 HIS HA H 101 4.600 4.251 0.349 1
1 1275 . 6 1 1 A 101 101 HIS C C 101 174.200 175.546 -1.346 1
1 1276 . 6 1 1 A 101 101 HIS CA C 101 55.200 56.614 -1.414 1
1 1277 . 6 1 1 A 101 101 HIS CB C 101 29.000 28.262 0.738 1
1 1278 . 6 1 1 A 101 101 HIS N N 101 119.400 119.630 -0.230 1
1 1279 . 6 1 1 A 102 102 HIS H H 102 8.660 7.958 0.702 1
1 1280 . 6 1 1 A 102 102 HIS HA H 102 4.630 4.295 0.335 1
1 1283 . 6 1 1 A 102 102 HIS C C 102 174.200 174.843 -0.643 1
1 1284 . 6 1 1 A 102 102 HIS CA C 102 55.200 59.436 -4.236 1
1 1285 . 6 1 1 A 102 102 HIS CB C 102 29.100 30.626 -1.526 1
1 1286 . 6 1 1 A 102 102 HIS N N 102 119.700 119.021 0.679 1
1 1287 . 6 1 1 A 103 103 HIS H H 103 8.680 7.674 1.006 1
1 1288 . 6 1 1 A 103 103 HIS HA H 103 4.640 4.534 0.106 1
1 1291 . 6 1 1 A 103 103 HIS C C 103 174.200 174.730 -0.530 1
1 1292 . 6 1 1 A 103 103 HIS CA C 103 55.200 54.230 0.970 1
1 1293 . 6 1 1 A 103 103 HIS CB C 103 29.200 31.044 -1.844 1
1 1294 . 6 1 1 A 103 103 HIS N N 103 120.500 111.266 9.234 1
1 1295 . 6 1 1 A 104 104 HIS H H 104 8.580 8.493 0.087 1
1 1296 . 6 1 1 A 104 104 HIS HA H 104 4.590 4.087 0.503 1
1 1299 . 6 1 1 A 104 104 HIS C C 104 174.200 174.795 -0.595 1
1 1300 . 6 1 1 A 104 104 HIS CA C 104 55.200 59.011 -3.811 1
1 1301 . 6 1 1 A 104 104 HIS CB C 104 29.300 30.558 -1.258 1
1 1302 . 6 1 1 A 104 104 HIS N N 104 120.700 121.458 -0.758 1
1 1303 . 6 1 1 A 105 105 HIS H H 105 8.550 7.578 0.972 1
1 1304 . 6 1 1 A 105 105 HIS HA H 105 4.610 4.950 -0.340 1
1 1307 . 6 1 1 A 105 105 HIS C C 105 173.500 173.274 0.226 1
1 1308 . 6 1 1 A 105 105 HIS CA C 105 55.400 54.428 0.972 1
1 1309 . 6 1 1 A 105 105 HIS CB C 105 28.800 32.513 -3.713 1
1 1310 . 6 1 1 A 105 105 HIS N N 105 119.000 112.145 6.855 1
1 7 . 7 1 1 A 2 2 ASP H H 2 8.890 8.631 0.259 1
1 8 . 7 1 1 A 2 2 ASP HA H 2 4.740 4.700 0.040 1
1 11 . 7 1 1 A 2 2 ASP C C 2 174.600 176.081 -1.481 1
1 12 . 7 1 1 A 2 2 ASP CA C 2 53.800 54.738 -0.938 1
1 13 . 7 1 1 A 2 2 ASP CB C 2 41.500 41.334 0.166 1
1 14 . 7 1 1 A 2 2 ASP N N 2 122.100 124.119 -2.019 1
1 15 . 7 1 1 A 3 3 LEU H H 3 8.280 8.413 -0.133 1
1 16 . 7 1 1 A 3 3 LEU HA H 3 4.420 4.781 -0.361 1
1 26 . 7 1 1 A 3 3 LEU C C 3 176.900 176.102 0.798 1
1 27 . 7 1 1 A 3 3 LEU CA C 3 55.000 55.299 -0.299 1
1 28 . 7 1 1 A 3 3 LEU CB C 3 42.700 42.762 -0.062 1
1 32 . 7 1 1 A 3 3 LEU N N 3 122.300 125.182 -2.882 1
1 33 . 7 1 1 A 4 4 VAL H H 4 8.640 8.554 0.086 1
1 34 . 7 1 1 A 4 4 VAL HA H 4 4.540 4.935 -0.395 1
1 42 . 7 1 1 A 4 4 VAL C C 4 175.800 174.885 0.915 1
1 43 . 7 1 1 A 4 4 VAL CA C 4 59.400 58.611 0.789 1
1 44 . 7 1 1 A 4 4 VAL CB C 4 35.400 35.920 -0.520 1
1 47 . 7 1 1 A 4 4 VAL N N 4 122.600 119.163 3.437 1
1 48 . 7 1 1 A 5 5 LYS H H 5 8.630 8.628 0.002 1
1 49 . 7 1 1 A 5 5 LYS HA H 5 4.450 4.307 0.143 1
1 58 . 7 1 1 A 5 5 LYS C C 5 179.400 178.354 1.046 1
1 59 . 7 1 1 A 5 5 LYS CA C 5 53.600 56.715 -3.115 1
1 60 . 7 1 1 A 5 5 LYS CB C 5 30.900 32.858 -1.958 1
1 64 . 7 1 1 A 5 5 LYS N N 5 121.100 121.813 -0.713 1
1 65 . 7 1 1 A 6 6 ILE H H 6 10.320 8.842 1.478 1
1 66 . 7 1 1 A 6 6 ILE HA H 6 3.440 3.715 -0.275 1
1 76 . 7 1 1 A 6 6 ILE C C 6 178.300 178.004 0.296 1
1 77 . 7 1 1 A 6 6 ILE CA C 6 65.700 64.973 0.727 1
1 78 . 7 1 1 A 6 6 ILE CB C 6 35.900 37.646 -1.746 1
1 82 . 7 1 1 A 6 6 ILE N N 6 125.400 122.174 3.226 1
1 83 . 7 1 1 A 7 7 ARG H H 7 8.210 7.941 0.269 1
1 84 . 7 1 1 A 7 7 ARG HA H 7 3.850 4.084 -0.234 1
1 92 . 7 1 1 A 7 7 ARG C C 7 175.600 177.585 -1.985 1
1 93 . 7 1 1 A 7 7 ARG CA C 7 57.800 58.814 -1.014 1
1 94 . 7 1 1 A 7 7 ARG CB C 7 30.300 29.763 0.537 1
1 98 . 7 1 1 A 7 7 ARG N N 7 118.800 121.127 -2.327 1
1 100 . 7 1 1 A 8 8 ASP H H 8 7.850 7.737 0.113 1
1 101 . 7 1 1 A 8 8 ASP HA H 8 4.700 4.736 -0.036 1
1 104 . 7 1 1 A 8 8 ASP C C 8 176.100 176.351 -0.251 1
1 105 . 7 1 1 A 8 8 ASP CA C 8 54.100 53.523 0.577 1
1 106 . 7 1 1 A 8 8 ASP CB C 8 41.200 40.770 0.430 1
1 107 . 7 1 1 A 8 8 ASP N N 8 116.800 118.022 -1.222 1
1 108 . 7 1 1 A 9 9 VAL H H 9 7.240 7.202 0.038 1
1 109 . 7 1 1 A 9 9 VAL HA H 9 3.710 3.989 -0.279 1
1 117 . 7 1 1 A 9 9 VAL C C 9 174.900 175.608 -0.708 1
1 118 . 7 1 1 A 9 9 VAL CA C 9 64.300 63.200 1.100 1
1 119 . 7 1 1 A 9 9 VAL CB C 9 31.500 31.739 -0.239 1
1 122 . 7 1 1 A 9 9 VAL N N 9 121.800 121.055 0.745 1
1 123 . 7 1 1 A 10 10 SER H H 10 8.600 8.576 0.024 1
1 124 . 7 1 1 A 10 10 SER HA H 10 4.600 4.754 -0.154 1
1 127 . 7 1 1 A 10 10 SER CA C 10 56.700 56.818 -0.118 1
1 128 . 7 1 1 A 10 10 SER CB C 10 66.100 65.895 0.205 1
1 129 . 7 1 1 A 10 10 SER N N 10 122.200 120.733 1.467 1
1 130 . 7 1 1 A 11 11 LEU H H 11 8.660 8.935 -0.275 1
1 131 . 7 1 1 A 11 11 LEU HA H 11 3.900 4.160 -0.260 1
1 141 . 7 1 1 A 11 11 LEU C C 11 178.100 178.393 -0.293 1
1 142 . 7 1 1 A 11 11 LEU CA C 11 56.700 56.825 -0.125 1
1 143 . 7 1 1 A 11 11 LEU CB C 11 41.400 41.526 -0.126 1
1 147 . 7 1 1 A 11 11 LEU N N 11 120.300 122.173 -1.873 1
1 148 . 7 1 1 A 12 12 SER H H 12 8.160 8.033 0.127 1
1 149 . 7 1 1 A 12 12 SER HA H 12 4.270 4.448 -0.178 1
1 152 . 7 1 1 A 12 12 SER C C 12 174.200 174.775 -0.575 1
1 153 . 7 1 1 A 12 12 SER CA C 12 59.900 60.742 -0.842 1
1 154 . 7 1 1 A 12 12 SER CB C 12 63.100 63.628 -0.528 1
1 155 . 7 1 1 A 12 12 SER N N 12 112.100 114.018 -1.918 1
1 156 . 7 1 1 A 13 13 THR H H 13 7.460 7.405 0.055 1
1 157 . 7 1 1 A 13 13 THR HA H 13 4.760 4.707 0.053 1
1 162 . 7 1 1 A 13 13 THR CA C 13 56.600 58.942 -2.342 1
1 163 . 7 1 1 A 13 13 THR CB C 13 70.100 69.025 1.075 1
1 165 . 7 1 1 A 13 13 THR N N 13 114.700 110.010 4.690 1
1 166 . 7 1 1 A 14 14 PRO HA H 14 4.050 4.250 -0.200 1
1 173 . 7 1 1 A 14 14 PRO C C 14 175.800 175.945 -0.145 1
1 174 . 7 1 1 A 14 14 PRO CA C 14 65.100 64.820 0.280 1
1 175 . 7 1 1 A 14 14 PRO CB C 14 32.100 31.433 0.667 1
1 178 . 7 1 1 A 15 15 TYR H H 15 7.380 7.669 -0.289 1
1 179 . 7 1 1 A 15 15 TYR HA H 15 5.570 5.598 -0.028 1
1 186 . 7 1 1 A 15 15 TYR C C 15 176.100 175.255 0.845 1
1 187 . 7 1 1 A 15 15 TYR CA C 15 56.400 56.809 -0.409 1
1 188 . 7 1 1 A 15 15 TYR CB C 15 41.500 41.360 0.140 1
1 193 . 7 1 1 A 15 15 TYR N N 15 113.800 117.300 -3.500 1
1 194 . 7 1 1 A 16 16 VAL H H 16 9.010 8.756 0.254 1
1 195 . 7 1 1 A 16 16 VAL HA H 16 4.920 5.040 -0.120 1
1 203 . 7 1 1 A 16 16 VAL C C 16 174.300 174.404 -0.104 1
1 204 . 7 1 1 A 16 16 VAL CA C 16 59.600 59.440 0.160 1
1 205 . 7 1 1 A 16 16 VAL CB C 16 36.800 36.389 0.411 1
1 208 . 7 1 1 A 16 16 VAL N N 16 113.800 117.589 -3.789 1
1 209 . 7 1 1 A 17 17 SER H H 17 7.960 8.386 -0.426 1
1 210 . 7 1 1 A 17 17 SER HA H 17 5.860 5.587 0.273 1
1 213 . 7 1 1 A 17 17 SER C C 17 172.700 173.616 -0.916 1
1 214 . 7 1 1 A 17 17 SER CA C 17 57.300 57.164 0.136 1
1 215 . 7 1 1 A 17 17 SER CB C 17 64.000 65.968 -1.968 1
1 216 . 7 1 1 A 17 17 SER N N 17 117.100 117.337 -0.237 1
1 217 . 7 1 1 A 18 18 VAL H H 18 8.570 8.946 -0.376 1
1 218 . 7 1 1 A 18 18 VAL HA H 18 4.900 5.116 -0.216 1
1 226 . 7 1 1 A 18 18 VAL C C 18 173.700 173.522 0.178 1
1 227 . 7 1 1 A 18 18 VAL CA C 18 58.800 59.214 -0.414 1
1 228 . 7 1 1 A 18 18 VAL CB C 18 36.700 36.176 0.524 1
1 231 . 7 1 1 A 18 18 VAL N N 18 113.500 118.716 -5.216 1
1 232 . 7 1 1 A 19 19 ILE H H 19 8.490 8.606 -0.116 1
1 233 . 7 1 1 A 19 19 ILE HA H 19 5.300 4.961 0.339 1
1 243 . 7 1 1 A 19 19 ILE C C 19 175.800 174.881 0.919 1
1 244 . 7 1 1 A 19 19 ILE CA C 19 59.700 59.266 0.434 1
1 245 . 7 1 1 A 19 19 ILE CB C 19 41.700 42.239 -0.539 1
1 249 . 7 1 1 A 19 19 ILE N N 19 120.600 122.096 -1.496 1
1 250 . 7 1 1 A 20 20 GLY H H 20 8.670 7.940 0.730 1
1 251 . 7 1 1 A 20 20 GLY HA2 H 20 3.760 4.148 -0.388 1
1 252 . 7 1 1 A 20 20 GLY HA3 H 20 4.190 4.149 0.041 1
1 253 . 7 1 1 A 20 20 GLY C C 20 169.900 172.340 -2.440 1
1 254 . 7 1 1 A 20 20 GLY CA C 20 46.000 45.952 0.048 1
1 255 . 7 1 1 A 20 20 GLY N N 20 110.200 113.674 -3.474 1
1 256 . 7 1 1 A 21 21 LYS H H 21 8.920 8.344 0.576 1
1 257 . 7 1 1 A 21 21 LYS HA H 21 5.210 5.346 -0.136 1
1 266 . 7 1 1 A 21 21 LYS C C 21 176.400 175.085 1.315 1
1 267 . 7 1 1 A 21 21 LYS CA C 21 54.400 54.845 -0.445 1
1 268 . 7 1 1 A 21 21 LYS CB C 21 35.400 35.211 0.189 1
1 272 . 7 1 1 A 21 21 LYS N N 21 119.100 116.687 2.413 1
1 273 . 7 1 1 A 22 22 ILE H H 22 8.900 8.574 0.326 1
1 274 . 7 1 1 A 22 22 ILE HA H 22 5.050 5.067 -0.017 1
1 284 . 7 1 1 A 22 22 ILE C C 22 176.900 175.261 1.639 1
1 285 . 7 1 1 A 22 22 ILE CA C 22 57.800 60.487 -2.687 1
1 286 . 7 1 1 A 22 22 ILE CB C 22 36.200 39.224 -3.024 1
1 290 . 7 1 1 A 22 22 ILE N N 22 130.000 125.019 4.981 1
1 291 . 7 1 1 A 23 23 THR H H 23 9.020 8.996 0.024 1
1 292 . 7 1 1 A 23 23 THR HA H 23 4.660 5.087 -0.427 1
1 297 . 7 1 1 A 23 23 THR C C 23 174.000 174.353 -0.353 1
1 298 . 7 1 1 A 23 23 THR CA C 23 60.800 59.586 1.214 1
1 299 . 7 1 1 A 23 23 THR CB C 23 73.400 71.901 1.499 1
1 301 . 7 1 1 A 23 23 THR N N 23 118.200 121.025 -2.825 1
1 302 . 7 1 1 A 24 24 GLY H H 24 8.430 8.488 -0.058 1
1 303 . 7 1 1 A 24 24 GLY HA2 H 24 3.910 4.001 -0.091 1
1 304 . 7 1 1 A 24 24 GLY HA3 H 24 3.910 4.072 -0.162 1
1 305 . 7 1 1 A 24 24 GLY C C 24 175.400 174.548 0.852 1
1 306 . 7 1 1 A 24 24 GLY CA C 24 47.100 45.604 1.496 1
1 307 . 7 1 1 A 24 24 GLY N N 24 107.200 115.262 -8.062 1
1 308 . 7 1 1 A 25 25 ILE H H 25 9.370 8.411 0.959 1
1 309 . 7 1 1 A 25 25 ILE HA H 25 4.480 4.122 0.358 1
1 319 . 7 1 1 A 25 25 ILE C C 25 178.200 174.413 3.787 1
1 320 . 7 1 1 A 25 25 ILE CA C 25 59.200 62.512 -3.312 1
1 321 . 7 1 1 A 25 25 ILE CB C 25 35.400 37.080 -1.680 1
1 325 . 7 1 1 A 25 25 ILE N N 25 120.600 118.411 2.189 1
1 326 . 7 1 1 A 26 26 HIS H H 26 9.000 8.400 0.600 1
1 327 . 7 1 1 A 26 26 HIS HA H 26 4.770 5.025 -0.255 1
1 330 . 7 1 1 A 26 26 HIS C C 26 172.700 172.642 0.058 1
1 331 . 7 1 1 A 26 26 HIS CA C 26 55.000 55.804 -0.804 1
1 332 . 7 1 1 A 26 26 HIS CB C 26 31.100 33.666 -2.566 1
1 333 . 7 1 1 A 26 26 HIS N N 26 123.800 125.795 -1.995 1
1 334 . 7 1 1 A 27 27 LYS H H 27 8.930 9.406 -0.476 1
1 335 . 7 1 1 A 27 27 LYS HA H 27 4.770 4.686 0.084 1
1 344 . 7 1 1 A 27 27 LYS C C 27 175.300 174.945 0.355 1
1 345 . 7 1 1 A 27 27 LYS CA C 27 55.100 54.764 0.336 1
1 346 . 7 1 1 A 27 27 LYS CB C 27 34.400 34.971 -0.571 1
1 350 . 7 1 1 A 27 27 LYS N N 27 125.900 127.475 -1.575 1
1 351 . 7 1 1 A 28 28 LYS H H 28 8.880 8.579 0.301 1
1 352 . 7 1 1 A 28 28 LYS HA H 28 4.570 4.869 -0.299 1
1 361 . 7 1 1 A 28 28 LYS C C 28 174.500 174.663 -0.163 1
1 362 . 7 1 1 A 28 28 LYS CA C 28 54.600 54.530 0.070 1
1 363 . 7 1 1 A 28 28 LYS CB C 28 35.300 36.891 -1.591 1
1 367 . 7 1 1 A 28 28 LYS N N 28 127.400 124.894 2.506 1
1 368 . 7 1 1 A 29 29 GLU H H 29 8.440 8.402 0.038 1
1 369 . 7 1 1 A 29 29 GLU HA H 29 5.260 5.146 0.114 1
1 374 . 7 1 1 A 29 29 GLU C C 29 175.800 175.696 0.104 1
1 375 . 7 1 1 A 29 29 GLU CA C 29 54.800 54.792 0.008 1
1 376 . 7 1 1 A 29 29 GLU CB C 29 31.500 33.143 -1.643 1
1 378 . 7 1 1 A 29 29 GLU N N 29 122.200 120.863 1.337 1
1 379 . 7 1 1 A 30 30 TYR H H 30 8.960 8.614 0.346 1
1 380 . 7 1 1 A 30 30 TYR HA H 30 4.820 5.339 -0.519 1
1 387 . 7 1 1 A 30 30 TYR C C 30 172.600 172.466 0.134 1
1 388 . 7 1 1 A 30 30 TYR CA C 30 56.300 55.666 0.634 1
1 389 . 7 1 1 A 30 30 TYR CB C 30 40.500 41.608 -1.108 1
1 394 . 7 1 1 A 30 30 TYR N N 30 121.100 118.701 2.399 1
1 395 . 7 1 1 A 31 31 GLU H H 31 8.610 8.941 -0.331 1
1 396 . 7 1 1 A 31 31 GLU HA H 31 4.810 4.543 0.267 1
1 401 . 7 1 1 A 31 31 GLU C C 31 176.100 176.236 -0.136 1
1 402 . 7 1 1 A 31 31 GLU CA C 31 55.100 55.421 -0.321 1
1 403 . 7 1 1 A 31 31 GLU CB C 31 30.300 30.745 -0.445 1
1 405 . 7 1 1 A 31 31 GLU N N 31 121.800 122.191 -0.391 1
1 406 . 7 1 1 A 32 32 SER H H 32 8.570 8.961 -0.391 1
1 407 . 7 1 1 A 32 32 SER HA H 32 4.520 4.853 -0.333 1
1 410 . 7 1 1 A 32 32 SER C C 32 174.300 173.949 0.351 1
1 411 . 7 1 1 A 32 32 SER CA C 32 57.300 57.249 0.051 1
1 412 . 7 1 1 A 32 32 SER CB C 32 64.100 63.877 0.223 1
1 413 . 7 1 1 A 32 32 SER N N 32 118.500 120.759 -2.259 1
1 414 . 7 1 1 A 33 33 ASP H H 33 9.290 8.623 0.667 1
1 415 . 7 1 1 A 33 33 ASP HA H 33 4.340 4.388 -0.048 1
1 418 . 7 1 1 A 33 33 ASP C C 33 175.900 177.064 -1.164 1
1 419 . 7 1 1 A 33 33 ASP CA C 33 55.000 54.212 0.788 1
1 420 . 7 1 1 A 33 33 ASP CB C 33 39.300 39.854 -0.554 1
1 421 . 7 1 1 A 33 33 ASP N N 33 125.700 121.831 3.869 1
1 422 . 7 1 1 A 34 34 GLY H H 34 8.690 9.002 -0.312 1
1 423 . 7 1 1 A 34 34 GLY HA2 H 34 3.660 3.858 -0.198 1
1 424 . 7 1 1 A 34 34 GLY HA3 H 34 4.140 3.860 0.280 1
1 425 . 7 1 1 A 34 34 GLY C C 34 174.200 173.576 0.624 1
1 426 . 7 1 1 A 34 34 GLY CA C 34 45.600 45.744 -0.144 1
1 427 . 7 1 1 A 34 34 GLY N N 34 104.800 112.490 -7.690 1
1 428 . 7 1 1 A 35 35 THR H H 35 7.840 7.705 0.135 1
1 429 . 7 1 1 A 35 35 THR HA H 35 4.660 4.643 0.017 1
1 434 . 7 1 1 A 35 35 THR C C 35 173.000 173.318 -0.318 1
1 435 . 7 1 1 A 35 35 THR CA C 35 60.200 61.145 -0.945 1
1 436 . 7 1 1 A 35 35 THR CB C 35 71.200 71.684 -0.484 1
1 438 . 7 1 1 A 35 35 THR N N 35 114.800 115.359 -0.559 1
1 439 . 7 1 1 A 36 36 THR H H 36 8.480 8.661 -0.181 1
1 440 . 7 1 1 A 36 36 THR HA H 36 4.620 4.468 0.152 1
1 445 . 7 1 1 A 36 36 THR C C 36 173.800 174.224 -0.424 1
1 446 . 7 1 1 A 36 36 THR CA C 36 62.300 62.618 -0.318 1
1 447 . 7 1 1 A 36 36 THR CB C 36 69.500 69.242 0.258 1
1 449 . 7 1 1 A 36 36 THR N N 36 119.400 121.933 -2.533 1
1 450 . 7 1 1 A 37 37 LYS H H 37 8.880 8.256 0.624 1
1 451 . 7 1 1 A 37 37 LYS HA H 37 4.570 4.823 -0.253 1
1 460 . 7 1 1 A 37 37 LYS C C 37 174.500 175.925 -1.425 1
1 461 . 7 1 1 A 37 37 LYS CA C 37 54.600 53.922 0.678 1
1 462 . 7 1 1 A 37 37 LYS CB C 37 35.500 36.334 -0.834 1
1 466 . 7 1 1 A 37 37 LYS N N 37 128.000 125.262 2.738 1
1 467 . 7 1 1 A 38 38 SER H H 38 8.370 8.610 -0.240 1
1 468 . 7 1 1 A 38 38 SER HA H 38 5.250 5.045 0.205 1
1 471 . 7 1 1 A 38 38 SER C C 38 173.200 173.875 -0.675 1
1 472 . 7 1 1 A 38 38 SER CA C 38 57.900 57.441 0.459 1
1 473 . 7 1 1 A 38 38 SER CB C 38 65.500 64.560 0.940 1
1 474 . 7 1 1 A 38 38 SER N N 38 114.300 117.141 -2.841 1
1 475 . 7 1 1 A 39 39 VAL H H 39 9.020 9.156 -0.136 1
1 476 . 7 1 1 A 39 39 VAL HA H 39 4.900 5.032 -0.132 1
1 484 . 7 1 1 A 39 39 VAL C C 39 173.200 173.037 0.163 1
1 485 . 7 1 1 A 39 39 VAL CA C 39 59.200 59.677 -0.477 1
1 486 . 7 1 1 A 39 39 VAL CB C 39 34.600 35.126 -0.526 1
1 489 . 7 1 1 A 39 39 VAL N N 39 123.600 121.078 2.522 1
1 490 . 7 1 1 A 40 40 TYR H H 40 8.900 8.976 -0.076 1
1 491 . 7 1 1 A 40 40 TYR HA H 40 4.730 5.330 -0.600 1
1 498 . 7 1 1 A 40 40 TYR CA C 40 56.500 56.849 -0.349 1
1 499 . 7 1 1 A 40 40 TYR CB C 40 39.000 39.978 -0.978 1
1 504 . 7 1 1 A 40 40 TYR N N 40 126.300 127.958 -1.658 1
1 505 . 7 1 1 A 41 41 GLN H H 41 8.630 8.667 -0.037 1
1 506 . 7 1 1 A 41 41 GLN HA H 41 5.330 5.215 0.115 1
1 513 . 7 1 1 A 41 41 GLN C C 41 175.500 175.695 -0.195 1
1 514 . 7 1 1 A 41 41 GLN CA C 41 53.800 54.111 -0.311 1
1 515 . 7 1 1 A 41 41 GLN CB C 41 32.100 32.327 -0.227 1
1 518 . 7 1 1 A 41 41 GLN N N 41 122.000 121.672 0.328 1
1 520 . 7 1 1 A 42 42 GLY H H 42 8.560 7.900 0.660 1
1 521 . 7 1 1 A 42 42 GLY HA2 H 42 3.680 4.240 -0.560 1
1 522 . 7 1 1 A 42 42 GLY HA3 H 42 4.020 4.248 -0.228 1
1 523 . 7 1 1 A 42 42 GLY C C 42 171.600 171.070 0.530 1
1 524 . 7 1 1 A 42 42 GLY CA C 42 47.300 46.090 1.210 1
1 525 . 7 1 1 A 42 42 GLY N N 42 113.000 108.754 4.246 1
1 526 . 7 1 1 A 43 43 TYR H H 43 9.320 8.504 0.816 1
1 527 . 7 1 1 A 43 43 TYR HA H 43 5.280 5.449 -0.169 1
1 534 . 7 1 1 A 43 43 TYR C C 43 173.200 173.866 -0.666 1
1 535 . 7 1 1 A 43 43 TYR CA C 43 57.600 56.410 1.190 1
1 536 . 7 1 1 A 43 43 TYR CB C 43 42.400 41.792 0.608 1
1 541 . 7 1 1 A 43 43 TYR N N 43 126.300 118.946 7.354 1
1 542 . 7 1 1 A 44 44 ILE H H 44 9.160 8.839 0.321 1
1 543 . 7 1 1 A 44 44 ILE HA H 44 5.270 5.434 -0.164 1
1 553 . 7 1 1 A 44 44 ILE C C 44 172.900 173.902 -1.002 1
1 554 . 7 1 1 A 44 44 ILE CA C 44 59.000 59.292 -0.292 1
1 555 . 7 1 1 A 44 44 ILE CB C 44 42.200 41.056 1.144 1
1 559 . 7 1 1 A 44 44 ILE N N 44 117.700 123.921 -6.221 1
1 560 . 7 1 1 A 45 45 GLU H H 45 8.420 8.785 -0.365 1
1 561 . 7 1 1 A 45 45 GLU HA H 45 5.600 5.245 0.355 1
1 566 . 7 1 1 A 45 45 GLU C C 45 174.300 175.107 -0.807 1
1 567 . 7 1 1 A 45 45 GLU CA C 45 54.000 54.600 -0.600 1
1 568 . 7 1 1 A 45 45 GLU CB C 45 34.400 33.399 1.001 1
1 570 . 7 1 1 A 45 45 GLU N N 45 123.600 127.808 -4.208 1
1 571 . 7 1 1 A 46 46 ASP H H 46 8.530 8.461 0.069 1
1 572 . 7 1 1 A 46 46 ASP HA H 46 5.070 4.959 0.111 1
1 575 . 7 1 1 A 46 46 ASP C C 46 175.000 175.487 -0.487 1
1 576 . 7 1 1 A 46 46 ASP CA C 46 51.800 52.812 -1.012 1
1 577 . 7 1 1 A 46 46 ASP CB C 46 41.300 44.067 -2.767 1
1 578 . 7 1 1 A 46 46 ASP N N 46 125.500 121.209 4.291 1
1 579 . 7 1 1 A 47 47 ASP H H 47 9.160 8.703 0.457 1
1 580 . 7 1 1 A 47 47 ASP HA H 47 4.430 4.281 0.149 1
1 583 . 7 1 1 A 47 47 ASP C C 47 176.000 178.015 -2.015 1
1 584 . 7 1 1 A 47 47 ASP CA C 47 55.000 57.298 -2.298 1
1 585 . 7 1 1 A 47 47 ASP CB C 47 38.900 40.880 -1.980 1
1 586 . 7 1 1 A 47 47 ASP N N 47 114.200 123.808 -9.608 1
1 587 . 7 1 1 A 48 48 THR H H 48 9.470 7.795 1.675 1
1 588 . 7 1 1 A 48 48 THR HA H 48 4.520 4.159 0.361 1
1 593 . 7 1 1 A 48 48 THR C C 48 174.500 174.180 0.320 1
1 594 . 7 1 1 A 48 48 THR CA C 48 62.600 63.737 -1.137 1
1 595 . 7 1 1 A 48 48 THR CB C 48 70.400 68.209 2.191 1
1 597 . 7 1 1 A 48 48 THR N N 48 111.800 113.316 -1.516 1
1 598 . 7 1 1 A 49 49 ALA H H 49 7.850 7.629 0.221 1
1 599 . 7 1 1 A 49 49 ALA HA H 49 4.440 4.462 -0.022 1
1 603 . 7 1 1 A 49 49 ALA C C 49 173.200 175.510 -2.310 1
1 604 . 7 1 1 A 49 49 ALA CA C 49 52.700 50.980 1.720 1
1 605 . 7 1 1 A 49 49 ALA CB C 49 21.300 20.436 0.864 1
1 606 . 7 1 1 A 49 49 ALA N N 49 123.400 121.249 2.151 1
1 607 . 7 1 1 A 50 50 ARG H H 50 8.160 8.870 -0.710 1
1 608 . 7 1 1 A 50 50 ARG HA H 50 5.350 5.568 -0.218 1
1 616 . 7 1 1 A 50 50 ARG C C 50 174.700 174.398 0.302 1
1 617 . 7 1 1 A 50 50 ARG CA C 50 54.000 54.539 -0.539 1
1 618 . 7 1 1 A 50 50 ARG CB C 50 34.500 34.436 0.064 1
1 622 . 7 1 1 A 50 50 ARG N N 50 117.400 114.115 3.285 1
1 624 . 7 1 1 A 51 51 ILE H H 51 9.390 8.560 0.830 1
1 625 . 7 1 1 A 51 51 ILE HA H 51 4.790 4.909 -0.119 1
1 635 . 7 1 1 A 51 51 ILE C C 51 172.600 173.055 -0.455 1
1 636 . 7 1 1 A 51 51 ILE CA C 51 60.000 59.005 0.995 1
1 637 . 7 1 1 A 51 51 ILE CB C 51 42.800 41.757 1.043 1
1 641 . 7 1 1 A 51 51 ILE N N 51 124.600 120.688 3.912 1
1 642 . 7 1 1 A 52 52 ARG H H 52 7.980 8.529 -0.549 1
1 643 . 7 1 1 A 52 52 ARG HA H 52 4.170 4.033 0.137 1
1 651 . 7 1 1 A 52 52 ARG C C 52 174.600 175.757 -1.157 1
1 652 . 7 1 1 A 52 52 ARG CA C 52 57.100 56.152 0.948 1
1 653 . 7 1 1 A 52 52 ARG CB C 52 31.300 30.811 0.489 1
1 657 . 7 1 1 A 52 52 ARG N N 52 125.900 127.907 -2.007 1
1 659 . 7 1 1 A 53 53 ILE H H 53 8.290 8.864 -0.574 1
1 660 . 7 1 1 A 53 53 ILE HA H 53 5.160 5.137 0.023 1
1 670 . 7 1 1 A 53 53 ILE C C 53 172.400 174.748 -2.348 1
1 671 . 7 1 1 A 53 53 ILE CA C 53 58.600 58.945 -0.345 1
1 672 . 7 1 1 A 53 53 ILE CB C 53 41.900 42.480 -0.580 1
1 676 . 7 1 1 A 53 53 ILE N N 53 118.500 120.745 -2.245 1
1 677 . 7 1 1 A 54 54 SER H H 54 8.350 8.782 -0.432 1
1 678 . 7 1 1 A 54 54 SER HA H 54 5.070 5.179 -0.109 1
1 681 . 7 1 1 A 54 54 SER C C 54 172.400 172.760 -0.360 1
1 682 . 7 1 1 A 54 54 SER CA C 54 57.000 56.992 0.008 1
1 683 . 7 1 1 A 54 54 SER CB C 54 65.900 65.755 0.145 1
1 684 . 7 1 1 A 54 54 SER N N 54 120.700 118.691 2.009 1
1 685 . 7 1 1 A 55 55 SER H H 55 9.130 8.934 0.196 1
1 686 . 7 1 1 A 55 55 SER HA H 55 5.270 5.254 0.016 1
1 690 . 7 1 1 A 55 55 SER C C 55 174.400 172.719 1.681 1
1 691 . 7 1 1 A 55 55 SER CA C 55 55.500 56.207 -0.707 1
1 692 . 7 1 1 A 55 55 SER CB C 55 64.500 65.736 -1.236 1
1 693 . 7 1 1 A 55 55 SER N N 55 117.200 118.905 -1.705 1
1 694 . 7 1 1 A 56 56 PHE H H 56 8.970 8.524 0.446 1
1 695 . 7 1 1 A 56 56 PHE HA H 56 4.600 4.922 -0.322 1
1 703 . 7 1 1 A 56 56 PHE C C 56 176.500 177.256 -0.756 1
1 704 . 7 1 1 A 56 56 PHE CA C 56 58.300 57.568 0.732 1
1 705 . 7 1 1 A 56 56 PHE CB C 56 37.900 40.502 -2.602 1
1 711 . 7 1 1 A 56 56 PHE N N 56 129.400 122.763 6.637 1
1 712 . 7 1 1 A 57 57 GLY H H 57 8.570 8.945 -0.375 1
1 713 . 7 1 1 A 57 57 GLY HA2 H 57 4.020 4.171 -0.151 1
1 714 . 7 1 1 A 57 57 GLY HA3 H 57 4.380 4.236 0.144 1
1 715 . 7 1 1 A 57 57 GLY C C 57 173.700 174.172 -0.472 1
1 716 . 7 1 1 A 57 57 GLY CA C 57 46.300 45.626 0.674 1
1 717 . 7 1 1 A 57 57 GLY N N 57 112.500 112.251 0.249 1
1 718 . 7 1 1 A 58 58 LYS H H 58 6.800 8.506 -1.706 1
1 719 . 7 1 1 A 58 58 LYS HA H 58 4.410 4.286 0.124 1
1 728 . 7 1 1 A 58 58 LYS C C 58 174.800 175.400 -0.600 1
1 729 . 7 1 1 A 58 58 LYS CA C 58 55.200 56.494 -1.294 1
1 730 . 7 1 1 A 58 58 LYS CB C 58 33.300 33.398 -0.098 1
1 734 . 7 1 1 A 58 58 LYS N N 58 118.700 121.296 -2.596 1
1 735 . 7 1 1 A 59 59 GLN H H 59 8.390 8.507 -0.117 1
1 736 . 7 1 1 A 59 59 GLN HA H 59 1.830 3.725 -1.895 1
1 743 . 7 1 1 A 59 59 GLN C C 59 174.100 174.286 -0.186 1
1 744 . 7 1 1 A 59 59 GLN CA C 59 57.100 54.260 2.840 1
1 745 . 7 1 1 A 59 59 GLN CB C 59 28.900 30.248 -1.348 1
1 748 . 7 1 1 A 59 59 GLN N N 59 124.000 123.061 0.939 1
1 750 . 7 1 1 A 60 60 LEU H H 60 5.320 8.412 -3.092 1
1 751 . 7 1 1 A 60 60 LEU HA H 60 4.370 4.925 -0.555 1
1 761 . 7 1 1 A 60 60 LEU CA C 60 52.800 53.541 -0.741 1
1 762 . 7 1 1 A 60 60 LEU CB C 60 46.700 45.601 1.099 1
1 766 . 7 1 1 A 60 60 LEU N N 60 121.800 124.713 -2.913 1
1 767 . 7 1 1 A 61 61 GLN H H 61 8.660 8.891 -0.231 1
1 768 . 7 1 1 A 61 61 GLN HA H 61 4.440 4.877 -0.437 1
1 775 . 7 1 1 A 61 61 GLN C C 61 174.000 174.887 -0.887 1
1 776 . 7 1 1 A 61 61 GLN CA C 61 53.800 54.045 -0.245 1
1 777 . 7 1 1 A 61 61 GLN CB C 61 31.800 32.060 -0.260 1
1 780 . 7 1 1 A 61 61 GLN N N 61 120.300 120.707 -0.407 1
1 782 . 7 1 1 A 62 62 ASP H H 62 8.450 8.713 -0.263 1
1 783 . 7 1 1 A 62 62 ASP HA H 62 4.130 4.249 -0.119 1
1 786 . 7 1 1 A 62 62 ASP C C 62 177.200 176.969 0.231 1
1 787 . 7 1 1 A 62 62 ASP CA C 62 55.700 55.238 0.462 1
1 788 . 7 1 1 A 62 62 ASP CB C 62 39.400 40.761 -1.361 1
1 789 . 7 1 1 A 62 62 ASP N N 62 122.400 123.123 -0.723 1
1 790 . 7 1 1 A 63 63 SER H H 63 9.210 9.112 0.098 1
1 791 . 7 1 1 A 63 63 SER HA H 63 3.850 4.104 -0.254 1
1 794 . 7 1 1 A 63 63 SER C C 63 173.200 173.847 -0.647 1
1 795 . 7 1 1 A 63 63 SER CA C 63 61.700 59.164 2.536 1
1 796 . 7 1 1 A 63 63 SER CB C 63 61.800 61.961 -0.161 1
1 797 . 7 1 1 A 63 63 SER N N 63 114.300 120.561 -6.261 1
1 798 . 7 1 1 A 64 64 ASP H H 64 7.960 7.568 0.392 1
1 799 . 7 1 1 A 64 64 ASP HA H 64 4.540 4.740 -0.200 1
1 802 . 7 1 1 A 64 64 ASP C C 64 174.900 175.150 -0.250 1
1 803 . 7 1 1 A 64 64 ASP CA C 64 54.900 53.683 1.217 1
1 804 . 7 1 1 A 64 64 ASP CB C 64 40.900 40.908 -0.008 1
1 805 . 7 1 1 A 64 64 ASP N N 64 122.600 121.330 1.270 1
1 806 . 7 1 1 A 65 65 VAL H H 65 8.180 8.576 -0.396 1
1 807 . 7 1 1 A 65 65 VAL HA H 65 4.670 4.428 0.242 1
1 815 . 7 1 1 A 65 65 VAL C C 65 175.900 175.505 0.395 1
1 816 . 7 1 1 A 65 65 VAL CA C 65 62.300 62.354 -0.054 1
1 817 . 7 1 1 A 65 65 VAL CB C 65 31.700 30.924 0.776 1
1 820 . 7 1 1 A 65 65 VAL N N 65 123.100 127.986 -4.886 1
1 821 . 7 1 1 A 66 66 VAL H H 66 8.770 8.715 0.055 1
1 822 . 7 1 1 A 66 66 VAL HA H 66 5.160 5.087 0.073 1
1 830 . 7 1 1 A 66 66 VAL C C 66 173.600 173.320 0.280 1
1 831 . 7 1 1 A 66 66 VAL CA C 66 58.100 58.799 -0.699 1
1 832 . 7 1 1 A 66 66 VAL CB C 66 35.700 36.129 -0.429 1
1 835 . 7 1 1 A 66 66 VAL N N 66 118.100 120.585 -2.485 1
1 836 . 7 1 1 A 67 67 ARG H H 67 8.880 9.239 -0.359 1
1 837 . 7 1 1 A 67 67 ARG HA H 67 5.110 5.029 0.081 1
1 845 . 7 1 1 A 67 67 ARG C C 67 175.300 174.628 0.672 1
1 846 . 7 1 1 A 67 67 ARG CA C 67 54.200 54.378 -0.178 1
1 847 . 7 1 1 A 67 67 ARG CB C 67 32.200 33.641 -1.441 1
1 851 . 7 1 1 A 67 67 ARG N N 67 120.200 121.703 -1.503 1
1 853 . 7 1 1 A 68 68 ILE H H 68 9.220 9.110 0.110 1
1 854 . 7 1 1 A 68 68 ILE HA H 68 4.990 4.766 0.224 1
1 864 . 7 1 1 A 68 68 ILE C C 68 174.900 174.395 0.505 1
1 865 . 7 1 1 A 68 68 ILE CA C 68 58.600 59.764 -1.164 1
1 866 . 7 1 1 A 68 68 ILE CB C 68 39.300 39.483 -0.183 1
1 870 . 7 1 1 A 68 68 ILE N N 68 127.200 128.117 -0.917 1
1 871 . 7 1 1 A 69 69 ASP H H 69 9.110 8.848 0.262 1
1 872 . 7 1 1 A 69 69 ASP HA H 69 5.370 5.143 0.227 1
1 875 . 7 1 1 A 69 69 ASP C C 69 175.800 175.599 0.201 1
1 876 . 7 1 1 A 69 69 ASP CA C 69 52.400 53.142 -0.742 1
1 877 . 7 1 1 A 69 69 ASP CB C 69 43.700 43.633 0.067 1
1 878 . 7 1 1 A 69 69 ASP N N 69 123.400 126.933 -3.533 1
1 879 . 7 1 1 A 70 70 ASN H H 70 8.300 8.802 -0.502 1
1 880 . 7 1 1 A 70 70 ASN HA H 70 4.160 4.433 -0.273 1
1 885 . 7 1 1 A 70 70 ASN C C 70 176.300 174.601 1.699 1
1 886 . 7 1 1 A 70 70 ASN CA C 70 54.300 54.343 -0.043 1
1 887 . 7 1 1 A 70 70 ASN CB C 70 37.500 37.825 -0.325 1
1 889 . 7 1 1 A 70 70 ASN N N 70 119.800 123.061 -3.261 1
1 891 . 7 1 1 A 71 71 ALA H H 71 9.100 8.083 1.017 1
1 892 . 7 1 1 A 71 71 ALA HA H 71 4.500 4.506 -0.006 1
1 896 . 7 1 1 A 71 71 ALA C C 71 175.700 176.718 -1.018 1
1 897 . 7 1 1 A 71 71 ALA CA C 71 51.900 52.471 -0.571 1
1 898 . 7 1 1 A 71 71 ALA CB C 71 19.600 19.839 -0.239 1
1 899 . 7 1 1 A 71 71 ALA N N 71 123.000 121.179 1.821 1
1 900 . 7 1 1 A 72 72 ARG H H 72 8.490 8.386 0.104 1
1 901 . 7 1 1 A 72 72 ARG HA H 72 4.720 4.814 -0.094 1
1 909 . 7 1 1 A 72 72 ARG C C 72 175.800 175.319 0.481 1
1 910 . 7 1 1 A 72 72 ARG CA C 72 54.400 55.000 -0.600 1
1 911 . 7 1 1 A 72 72 ARG CB C 72 32.700 31.826 0.874 1
1 915 . 7 1 1 A 72 72 ARG N N 72 122.500 123.622 -1.122 1
1 917 . 7 1 1 A 73 73 VAL H H 73 8.310 8.039 0.271 1
1 918 . 7 1 1 A 73 73 VAL HA H 73 4.250 4.458 -0.208 1
1 926 . 7 1 1 A 73 73 VAL C C 73 174.600 175.417 -0.817 1
1 927 . 7 1 1 A 73 73 VAL CA C 73 62.800 62.327 0.473 1
1 928 . 7 1 1 A 73 73 VAL CB C 73 32.100 32.150 -0.050 1
1 931 . 7 1 1 A 73 73 VAL N N 73 127.100 126.632 0.468 1
1 932 . 7 1 1 A 74 74 ALA H H 74 8.880 9.160 -0.280 1
1 933 . 7 1 1 A 74 74 ALA HA H 74 4.500 5.187 -0.687 1
1 937 . 7 1 1 A 74 74 ALA C C 74 174.800 175.074 -0.274 1
1 938 . 7 1 1 A 74 74 ALA CA C 74 50.500 50.032 0.468 1
1 939 . 7 1 1 A 74 74 ALA CB C 74 22.500 22.964 -0.464 1
1 940 . 7 1 1 A 74 74 ALA N N 74 131.000 129.697 1.303 1
1 941 . 7 1 1 A 75 75 GLN H H 75 8.280 8.779 -0.499 1
1 942 . 7 1 1 A 75 75 GLN HA H 75 4.910 4.828 0.082 1
1 949 . 7 1 1 A 75 75 GLN C C 75 175.100 175.243 -0.143 1
1 950 . 7 1 1 A 75 75 GLN CA C 75 54.600 54.352 0.248 1
1 951 . 7 1 1 A 75 75 GLN CB C 75 31.400 29.772 1.628 1
1 954 . 7 1 1 A 75 75 GLN N N 75 118.800 121.617 -2.817 1
1 956 . 7 1 1 A 76 76 PHE H H 76 8.710 9.281 -0.571 1
1 957 . 7 1 1 A 76 76 PHE HA H 76 4.660 4.771 -0.111 1
1 965 . 7 1 1 A 76 76 PHE C C 76 174.900 175.942 -1.042 1
1 966 . 7 1 1 A 76 76 PHE CA C 76 57.000 58.087 -1.087 1
1 967 . 7 1 1 A 76 76 PHE CB C 76 41.000 40.213 0.787 1
1 973 . 7 1 1 A 76 76 PHE N N 76 125.000 125.495 -0.495 1
1 974 . 7 1 1 A 77 77 ASN H H 77 9.040 8.990 0.050 1
1 975 . 7 1 1 A 77 77 ASN HA H 77 4.170 4.422 -0.252 1
1 980 . 7 1 1 A 77 77 ASN C C 77 174.200 176.462 -2.262 1
1 981 . 7 1 1 A 77 77 ASN CA C 77 53.800 54.608 -0.808 1
1 982 . 7 1 1 A 77 77 ASN CB C 77 37.400 36.861 0.539 1
1 984 . 7 1 1 A 77 77 ASN N N 77 123.200 119.228 3.972 1
1 986 . 7 1 1 A 78 78 GLY H H 78 8.370 9.079 -0.709 1
1 987 . 7 1 1 A 78 78 GLY HA2 H 78 3.410 3.597 -0.187 1
1 988 . 7 1 1 A 78 78 GLY HA3 H 78 3.980 3.757 0.223 1
1 989 . 7 1 1 A 78 78 GLY C C 78 173.800 172.783 1.017 1
1 990 . 7 1 1 A 78 78 GLY CA C 78 45.000 45.599 -0.599 1
1 991 . 7 1 1 A 78 78 GLY N N 78 103.300 105.362 -2.062 1
1 992 . 7 1 1 A 79 79 TYR H H 79 7.670 7.898 -0.228 1
1 993 . 7 1 1 A 79 79 TYR HA H 79 4.860 5.122 -0.262 1
1 1000 . 7 1 1 A 79 79 TYR C C 79 174.800 175.047 -0.247 1
1 1001 . 7 1 1 A 79 79 TYR CA C 79 56.300 56.355 -0.055 1
1 1002 . 7 1 1 A 79 79 TYR CB C 79 40.800 42.745 -1.945 1
1 1007 . 7 1 1 A 79 79 TYR N N 79 118.700 118.250 0.450 1
1 1008 . 7 1 1 A 80 80 LEU H H 80 8.760 8.932 -0.172 1
1 1009 . 7 1 1 A 80 80 LEU HA H 80 4.830 5.362 -0.532 1
1 1019 . 7 1 1 A 80 80 LEU C C 80 176.200 175.485 0.715 1
1 1020 . 7 1 1 A 80 80 LEU CA C 80 54.700 53.847 0.853 1
1 1021 . 7 1 1 A 80 80 LEU CB C 80 43.500 44.142 -0.642 1
1 1025 . 7 1 1 A 80 80 LEU N N 80 122.600 124.408 -1.808 1
1 1026 . 7 1 1 A 81 81 SER H H 81 8.650 8.690 -0.040 1
1 1027 . 7 1 1 A 81 81 SER HA H 81 4.860 5.189 -0.329 1
1 1030 . 7 1 1 A 81 81 SER C C 81 172.600 172.392 0.208 1
1 1031 . 7 1 1 A 81 81 SER CA C 81 56.600 57.250 -0.650 1
1 1032 . 7 1 1 A 81 81 SER CB C 81 66.300 66.357 -0.057 1
1 1033 . 7 1 1 A 81 81 SER N N 81 114.700 117.434 -2.734 1
1 1034 . 7 1 1 A 82 82 LEU H H 82 8.680 8.483 0.197 1
1 1035 . 7 1 1 A 82 82 LEU HA H 82 5.190 5.165 0.025 1
1 1045 . 7 1 1 A 82 82 LEU C C 82 177.100 175.577 1.523 1
1 1046 . 7 1 1 A 82 82 LEU CA C 82 53.300 53.736 -0.436 1
1 1047 . 7 1 1 A 82 82 LEU CB C 82 43.800 43.952 -0.152 1
1 1051 . 7 1 1 A 82 82 LEU N N 82 119.800 121.701 -1.901 1
1 1052 . 7 1 1 A 83 83 SER H H 83 9.560 9.476 0.084 1
1 1053 . 7 1 1 A 83 83 SER HA H 83 5.390 5.627 -0.237 1
1 1056 . 7 1 1 A 83 83 SER C C 83 174.200 173.253 0.947 1
1 1057 . 7 1 1 A 83 83 SER CA C 83 57.100 56.663 0.437 1
1 1058 . 7 1 1 A 83 83 SER CB C 83 64.400 64.833 -0.433 1
1 1059 . 7 1 1 A 83 83 SER N N 83 119.000 118.614 0.386 1
1 1060 . 7 1 1 A 84 84 VAL H H 84 9.150 9.490 -0.340 1
1 1061 . 7 1 1 A 84 84 VAL HA H 84 4.490 4.656 -0.166 1
1 1069 . 7 1 1 A 84 84 VAL C C 84 174.700 175.872 -1.172 1
1 1070 . 7 1 1 A 84 84 VAL CA C 84 61.300 61.233 0.067 1
1 1071 . 7 1 1 A 84 84 VAL CB C 84 33.000 32.235 0.765 1
1 1074 . 7 1 1 A 84 84 VAL N N 84 128.300 126.218 2.082 1
1 1075 . 7 1 1 A 85 85 GLY H H 85 7.970 8.854 -0.884 1
1 1076 . 7 1 1 A 85 85 GLY HA2 H 85 4.030 4.352 -0.322 1
1 1077 . 7 1 1 A 85 85 GLY HA3 H 85 4.840 4.492 0.348 1
1 1078 . 7 1 1 A 85 85 GLY C C 85 175.800 175.127 0.673 1
1 1079 . 7 1 1 A 85 85 GLY CA C 85 44.800 44.265 0.535 1
1 1080 . 7 1 1 A 85 85 GLY N N 85 114.300 115.547 -1.247 1
1 1081 . 7 1 1 A 86 86 ASP H H 86 8.860 8.906 -0.046 1
1 1082 . 7 1 1 A 86 86 ASP HA H 86 4.370 4.399 -0.029 1
1 1085 . 7 1 1 A 86 86 ASP C C 86 177.400 177.435 -0.035 1
1 1086 . 7 1 1 A 86 86 ASP CA C 86 57.400 56.897 0.503 1
1 1087 . 7 1 1 A 86 86 ASP CB C 86 40.600 40.533 0.067 1
1 1088 . 7 1 1 A 86 86 ASP N N 86 122.500 120.669 1.831 1
1 1089 . 7 1 1 A 87 87 SER H H 87 8.540 7.653 0.887 1
1 1090 . 7 1 1 A 87 87 SER HA H 87 4.620 4.381 0.239 1
1 1093 . 7 1 1 A 87 87 SER C C 87 174.700 174.611 0.089 1
1 1094 . 7 1 1 A 87 87 SER CA C 87 58.200 58.911 -0.711 1
1 1095 . 7 1 1 A 87 87 SER CB C 87 63.300 63.691 -0.391 1
1 1096 . 7 1 1 A 87 87 SER N N 87 112.100 111.279 0.821 1
1 1097 . 7 1 1 A 88 88 SER H H 88 7.880 7.518 0.362 1
1 1098 . 7 1 1 A 88 88 SER HA H 88 5.050 4.488 0.562 1
1 1101 . 7 1 1 A 88 88 SER C C 88 172.700 173.797 -1.097 1
1 1102 . 7 1 1 A 88 88 SER CA C 88 57.600 58.166 -0.566 1
1 1103 . 7 1 1 A 88 88 SER CB C 88 64.300 64.461 -0.161 1
1 1104 . 7 1 1 A 88 88 SER N N 88 119.200 118.289 0.911 1
1 1105 . 7 1 1 A 89 89 ARG H H 89 8.350 8.250 0.100 1
1 1106 . 7 1 1 A 89 89 ARG HA H 89 4.720 5.241 -0.521 1
1 1114 . 7 1 1 A 89 89 ARG C C 89 174.200 175.013 -0.813 1
1 1115 . 7 1 1 A 89 89 ARG CA C 89 55.000 54.630 0.370 1
1 1116 . 7 1 1 A 89 89 ARG CB C 89 33.500 33.685 -0.185 1
1 1120 . 7 1 1 A 89 89 ARG N N 89 122.800 122.646 0.154 1
1 1122 . 7 1 1 A 90 90 ILE H H 90 8.530 9.017 -0.487 1
1 1123 . 7 1 1 A 90 90 ILE HA H 90 4.790 5.075 -0.285 1
1 1133 . 7 1 1 A 90 90 ILE C C 90 175.400 174.596 0.804 1
1 1134 . 7 1 1 A 90 90 ILE CA C 90 60.600 60.059 0.541 1
1 1135 . 7 1 1 A 90 90 ILE CB C 90 40.600 40.819 -0.219 1
1 1139 . 7 1 1 A 90 90 ILE N N 90 123.100 123.377 -0.277 1
1 1140 . 7 1 1 A 91 91 GLU H H 91 9.000 9.118 -0.118 1
1 1141 . 7 1 1 A 91 91 GLU HA H 91 4.730 5.204 -0.474 1
1 1146 . 7 1 1 A 91 91 GLU C C 91 175.100 176.181 -1.081 1
1 1147 . 7 1 1 A 91 91 GLU CA C 91 54.300 54.437 -0.137 1
1 1148 . 7 1 1 A 91 91 GLU CB C 91 32.400 33.045 -0.645 1
1 1150 . 7 1 1 A 91 91 GLU N N 91 126.400 128.512 -2.112 1
1 1151 . 7 1 1 A 92 92 SER H H 92 8.830 8.707 0.123 1
1 1152 . 7 1 1 A 92 92 SER HA H 92 4.700 4.744 -0.044 1
1 1155 . 7 1 1 A 92 92 SER C C 92 174.600 174.457 0.143 1
1 1156 . 7 1 1 A 92 92 SER CA C 92 59.300 58.081 1.219 1
1 1157 . 7 1 1 A 92 92 SER CB C 92 63.100 64.503 -1.403 1
1 1158 . 7 1 1 A 92 92 SER N N 92 119.800 119.460 0.340 1
1 1159 . 7 1 1 A 93 93 VAL H H 93 8.350 8.355 -0.005 1
1 1160 . 7 1 1 A 93 93 VAL HA H 93 4.290 4.494 -0.204 1
1 1168 . 7 1 1 A 93 93 VAL C C 93 175.100 174.592 0.508 1
1 1169 . 7 1 1 A 93 93 VAL CA C 93 61.300 61.797 -0.497 1
1 1170 . 7 1 1 A 93 93 VAL CB C 93 33.900 34.076 -0.176 1
1 1173 . 7 1 1 A 93 93 VAL N N 93 121.800 122.662 -0.862 1
1 1174 . 7 1 1 A 94 94 ASN H H 94 8.510 8.762 -0.252 1
1 1175 . 7 1 1 A 94 94 ASN HA H 94 4.770 5.062 -0.292 1
1 1180 . 7 1 1 A 94 94 ASN C C 94 175.000 174.581 0.419 1
1 1181 . 7 1 1 A 94 94 ASN CA C 94 52.700 53.438 -0.738 1
1 1182 . 7 1 1 A 94 94 ASN CB C 94 38.500 38.642 -0.142 1
1 1184 . 7 1 1 A 94 94 ASN N N 94 121.800 126.358 -4.558 1
1 1186 . 7 1 1 A 95 95 VAL H H 95 7.860 8.523 -0.663 1
1 1187 . 7 1 1 A 95 95 VAL HA H 95 4.100 4.019 0.081 1
1 1195 . 7 1 1 A 95 95 VAL C C 95 175.100 176.497 -1.397 1
1 1196 . 7 1 1 A 95 95 VAL CA C 95 61.700 65.233 -3.533 1
1 1197 . 7 1 1 A 95 95 VAL CB C 95 33.100 32.028 1.072 1
1 1200 . 7 1 1 A 95 95 VAL N N 95 119.700 125.308 -5.608 1
1 1201 . 7 1 1 A 96 96 ASN H H 96 8.490 8.230 0.260 1
1 1202 . 7 1 1 A 96 96 ASN HA H 96 4.700 4.452 0.248 1
1 1207 . 7 1 1 A 96 96 ASN C C 96 174.600 174.556 0.044 1
1 1208 . 7 1 1 A 96 96 ASN CA C 96 53.000 53.897 -0.897 1
1 1209 . 7 1 1 A 96 96 ASN CB C 96 39.000 36.157 2.843 1
1 1211 . 7 1 1 A 96 96 ASN N N 96 122.200 118.870 3.330 1
1 1213 . 7 1 1 A 97 97 ILE H H 97 8.080 8.336 -0.256 1
1 1214 . 7 1 1 A 97 97 ILE HA H 97 4.370 3.687 0.683 1
1 1224 . 7 1 1 A 97 97 ILE CA C 97 58.600 61.972 -3.372 1
1 1225 . 7 1 1 A 97 97 ILE CB C 97 38.600 36.758 1.842 1
1 1229 . 7 1 1 A 97 97 ILE N N 97 123.500 112.260 11.240 1
1 1230 . 7 1 1 A 98 98 PRO HA H 98 4.360 4.663 -0.303 1
1 1237 . 7 1 1 A 98 98 PRO C C 98 176.600 176.417 0.183 1
1 1238 . 7 1 1 A 98 98 PRO CA C 98 63.100 62.741 0.359 1
1 1239 . 7 1 1 A 98 98 PRO CB C 98 31.800 32.686 -0.886 1
1 1242 . 7 1 1 A 99 99 LEU H H 99 8.200 8.632 -0.432 1
1 1243 . 7 1 1 A 99 99 LEU HA H 99 4.200 4.644 -0.444 1
1 1253 . 7 1 1 A 99 99 LEU C C 99 177.300 176.231 1.069 1
1 1254 . 7 1 1 A 99 99 LEU CA C 99 55.000 54.426 0.574 1
1 1255 . 7 1 1 A 99 99 LEU CB C 99 42.400 43.013 -0.613 1
1 1259 . 7 1 1 A 99 99 LEU N N 99 122.500 116.951 5.549 1
1 1260 . 7 1 1 A 100 100 GLU H H 100 8.250 7.903 0.347 1
1 1261 . 7 1 1 A 100 100 GLU HA H 100 4.140 4.517 -0.377 1
1 1266 . 7 1 1 A 100 100 GLU C C 100 176.100 175.771 0.329 1
1 1267 . 7 1 1 A 100 100 GLU CA C 100 56.100 56.354 -0.254 1
1 1268 . 7 1 1 A 100 100 GLU CB C 100 29.900 32.733 -2.833 1
1 1270 . 7 1 1 A 100 100 GLU N N 100 121.000 118.981 2.019 1
1 1271 . 7 1 1 A 101 101 HIS H H 101 8.540 9.285 -0.745 1
1 1272 . 7 1 1 A 101 101 HIS HA H 101 4.600 4.328 0.272 1
1 1275 . 7 1 1 A 101 101 HIS C C 101 174.200 175.532 -1.332 1
1 1276 . 7 1 1 A 101 101 HIS CA C 101 55.200 56.574 -1.374 1
1 1277 . 7 1 1 A 101 101 HIS CB C 101 29.000 28.877 0.123 1
1 1278 . 7 1 1 A 101 101 HIS N N 101 119.400 125.581 -6.181 1
1 1279 . 7 1 1 A 102 102 HIS H H 102 8.660 7.983 0.677 1
1 1280 . 7 1 1 A 102 102 HIS HA H 102 4.630 4.122 0.508 1
1 1283 . 7 1 1 A 102 102 HIS C C 102 174.200 175.548 -1.348 1
1 1284 . 7 1 1 A 102 102 HIS CA C 102 55.200 59.420 -4.220 1
1 1285 . 7 1 1 A 102 102 HIS CB C 102 29.100 30.351 -1.251 1
1 1286 . 7 1 1 A 102 102 HIS N N 102 119.700 118.866 0.834 1
1 1287 . 7 1 1 A 103 103 HIS H H 103 8.680 7.706 0.974 1
1 1288 . 7 1 1 A 103 103 HIS HA H 103 4.640 4.488 0.152 1
1 1291 . 7 1 1 A 103 103 HIS C C 103 174.200 175.664 -1.464 1
1 1292 . 7 1 1 A 103 103 HIS CA C 103 55.200 56.696 -1.496 1
1 1293 . 7 1 1 A 103 103 HIS CB C 103 29.200 30.887 -1.687 1
1 1294 . 7 1 1 A 103 103 HIS N N 103 120.500 116.387 4.113 1
1 1295 . 7 1 1 A 104 104 HIS H H 104 8.580 8.382 0.198 1
1 1296 . 7 1 1 A 104 104 HIS HA H 104 4.590 4.804 -0.214 1
1 1299 . 7 1 1 A 104 104 HIS C C 104 174.200 175.848 -1.648 1
1 1300 . 7 1 1 A 104 104 HIS CA C 104 55.200 55.146 0.054 1
1 1301 . 7 1 1 A 104 104 HIS CB C 104 29.300 30.919 -1.619 1
1 1302 . 7 1 1 A 104 104 HIS N N 104 120.700 116.986 3.714 1
1 1303 . 7 1 1 A 105 105 HIS H H 105 8.550 7.889 0.661 1
1 1304 . 7 1 1 A 105 105 HIS HA H 105 4.610 4.019 0.591 1
1 1307 . 7 1 1 A 105 105 HIS C C 105 173.500 175.818 -2.318 1
1 1308 . 7 1 1 A 105 105 HIS CA C 105 55.400 58.479 -3.079 1
1 1309 . 7 1 1 A 105 105 HIS CB C 105 28.800 28.945 -0.145 1
1 1310 . 7 1 1 A 105 105 HIS N N 105 119.000 118.630 0.370 1
1 7 . 8 1 1 A 2 2 ASP H H 2 8.890 8.367 0.523 1
1 8 . 8 1 1 A 2 2 ASP HA H 2 4.740 4.669 0.071 1
1 11 . 8 1 1 A 2 2 ASP C C 2 174.600 175.450 -0.850 1
1 12 . 8 1 1 A 2 2 ASP CA C 2 53.800 54.267 -0.467 1
1 13 . 8 1 1 A 2 2 ASP CB C 2 41.500 41.762 -0.262 1
1 14 . 8 1 1 A 2 2 ASP N N 2 122.100 124.422 -2.322 1
1 15 . 8 1 1 A 3 3 LEU H H 3 8.280 8.371 -0.091 1
1 16 . 8 1 1 A 3 3 LEU HA H 3 4.420 4.789 -0.369 1
1 26 . 8 1 1 A 3 3 LEU C C 3 176.900 176.168 0.732 1
1 27 . 8 1 1 A 3 3 LEU CA C 3 55.000 54.837 0.163 1
1 28 . 8 1 1 A 3 3 LEU CB C 3 42.700 42.717 -0.017 1
1 32 . 8 1 1 A 3 3 LEU N N 3 122.300 126.242 -3.942 1
1 33 . 8 1 1 A 4 4 VAL H H 4 8.640 8.555 0.085 1
1 34 . 8 1 1 A 4 4 VAL HA H 4 4.540 4.985 -0.445 1
1 42 . 8 1 1 A 4 4 VAL C C 4 175.800 174.941 0.859 1
1 43 . 8 1 1 A 4 4 VAL CA C 4 59.400 58.685 0.715 1
1 44 . 8 1 1 A 4 4 VAL CB C 4 35.400 35.947 -0.547 1
1 47 . 8 1 1 A 4 4 VAL N N 4 122.600 119.426 3.174 1
1 48 . 8 1 1 A 5 5 LYS H H 5 8.630 8.640 -0.010 1
1 49 . 8 1 1 A 5 5 LYS HA H 5 4.450 4.346 0.104 1
1 58 . 8 1 1 A 5 5 LYS C C 5 179.400 178.454 0.946 1
1 59 . 8 1 1 A 5 5 LYS CA C 5 53.600 55.974 -2.374 1
1 60 . 8 1 1 A 5 5 LYS CB C 5 30.900 33.276 -2.376 1
1 64 . 8 1 1 A 5 5 LYS N N 5 121.100 121.432 -0.332 1
1 65 . 8 1 1 A 6 6 ILE H H 6 10.320 8.874 1.446 1
1 66 . 8 1 1 A 6 6 ILE HA H 6 3.440 3.709 -0.269 1
1 76 . 8 1 1 A 6 6 ILE C C 6 178.300 177.604 0.696 1
1 77 . 8 1 1 A 6 6 ILE CA C 6 65.700 65.031 0.669 1
1 78 . 8 1 1 A 6 6 ILE CB C 6 35.900 37.672 -1.772 1
1 82 . 8 1 1 A 6 6 ILE N N 6 125.400 122.559 2.841 1
1 83 . 8 1 1 A 7 7 ARG H H 7 8.210 7.993 0.217 1
1 84 . 8 1 1 A 7 7 ARG HA H 7 3.850 4.143 -0.293 1
1 92 . 8 1 1 A 7 7 ARG C C 7 175.600 176.992 -1.392 1
1 93 . 8 1 1 A 7 7 ARG CA C 7 57.800 58.905 -1.105 1
1 94 . 8 1 1 A 7 7 ARG CB C 7 30.300 29.950 0.350 1
1 98 . 8 1 1 A 7 7 ARG N N 7 118.800 120.533 -1.733 1
1 100 . 8 1 1 A 8 8 ASP H H 8 7.850 7.768 0.082 1
1 101 . 8 1 1 A 8 8 ASP HA H 8 4.700 4.675 0.025 1
1 104 . 8 1 1 A 8 8 ASP C C 8 176.100 176.526 -0.426 1
1 105 . 8 1 1 A 8 8 ASP CA C 8 54.100 54.609 -0.509 1
1 106 . 8 1 1 A 8 8 ASP CB C 8 41.200 41.044 0.156 1
1 107 . 8 1 1 A 8 8 ASP N N 8 116.800 119.251 -2.451 1
1 108 . 8 1 1 A 9 9 VAL H H 9 7.240 7.471 -0.231 1
1 109 . 8 1 1 A 9 9 VAL HA H 9 3.710 3.957 -0.247 1
1 117 . 8 1 1 A 9 9 VAL C C 9 174.900 175.434 -0.534 1
1 118 . 8 1 1 A 9 9 VAL CA C 9 64.300 63.420 0.880 1
1 119 . 8 1 1 A 9 9 VAL CB C 9 31.500 31.620 -0.120 1
1 122 . 8 1 1 A 9 9 VAL N N 9 121.800 121.445 0.355 1
1 123 . 8 1 1 A 10 10 SER H H 10 8.600 7.959 0.641 1
1 124 . 8 1 1 A 10 10 SER HA H 10 4.600 4.636 -0.036 1
1 127 . 8 1 1 A 10 10 SER CA C 10 56.700 57.129 -0.429 1
1 128 . 8 1 1 A 10 10 SER CB C 10 66.100 65.593 0.507 1
1 129 . 8 1 1 A 10 10 SER N N 10 122.200 120.790 1.410 1
1 130 . 8 1 1 A 11 11 LEU H H 11 8.660 8.982 -0.322 1
1 131 . 8 1 1 A 11 11 LEU HA H 11 3.900 4.067 -0.167 1
1 141 . 8 1 1 A 11 11 LEU C C 11 178.100 179.100 -1.000 1
1 142 . 8 1 1 A 11 11 LEU CA C 11 56.700 57.171 -0.471 1
1 143 . 8 1 1 A 11 11 LEU CB C 11 41.400 41.636 -0.236 1
1 147 . 8 1 1 A 11 11 LEU N N 11 120.300 122.873 -2.573 1
1 148 . 8 1 1 A 12 12 SER H H 12 8.160 7.925 0.235 1
1 149 . 8 1 1 A 12 12 SER HA H 12 4.270 4.251 0.019 1
1 152 . 8 1 1 A 12 12 SER C C 12 174.200 174.807 -0.607 1
1 153 . 8 1 1 A 12 12 SER CA C 12 59.900 60.610 -0.710 1
1 154 . 8 1 1 A 12 12 SER CB C 12 63.100 62.764 0.336 1
1 155 . 8 1 1 A 12 12 SER N N 12 112.100 113.314 -1.214 1
1 156 . 8 1 1 A 13 13 THR H H 13 7.460 7.632 -0.172 1
1 157 . 8 1 1 A 13 13 THR HA H 13 4.760 4.699 0.061 1
1 162 . 8 1 1 A 13 13 THR CA C 13 56.600 58.966 -2.366 1
1 163 . 8 1 1 A 13 13 THR CB C 13 70.100 68.992 1.108 1
1 165 . 8 1 1 A 13 13 THR N N 13 114.700 108.806 5.894 1
1 166 . 8 1 1 A 14 14 PRO HA H 14 4.050 4.222 -0.172 1
1 173 . 8 1 1 A 14 14 PRO C C 14 175.800 175.941 -0.141 1
1 174 . 8 1 1 A 14 14 PRO CA C 14 65.100 64.778 0.322 1
1 175 . 8 1 1 A 14 14 PRO CB C 14 32.100 31.390 0.710 1
1 178 . 8 1 1 A 15 15 TYR H H 15 7.380 7.607 -0.227 1
1 179 . 8 1 1 A 15 15 TYR HA H 15 5.570 5.638 -0.068 1
1 186 . 8 1 1 A 15 15 TYR C C 15 176.100 175.321 0.779 1
1 187 . 8 1 1 A 15 15 TYR CA C 15 56.400 56.698 -0.298 1
1 188 . 8 1 1 A 15 15 TYR CB C 15 41.500 41.556 -0.056 1
1 193 . 8 1 1 A 15 15 TYR N N 15 113.800 117.148 -3.348 1
1 194 . 8 1 1 A 16 16 VAL H H 16 9.010 9.089 -0.079 1
1 195 . 8 1 1 A 16 16 VAL HA H 16 4.920 5.031 -0.111 1
1 203 . 8 1 1 A 16 16 VAL C C 16 174.300 173.992 0.308 1
1 204 . 8 1 1 A 16 16 VAL CA C 16 59.600 59.612 -0.012 1
1 205 . 8 1 1 A 16 16 VAL CB C 16 36.800 36.379 0.421 1
1 208 . 8 1 1 A 16 16 VAL N N 16 113.800 117.453 -3.653 1
1 209 . 8 1 1 A 17 17 SER H H 17 7.960 8.531 -0.571 1
1 210 . 8 1 1 A 17 17 SER HA H 17 5.860 5.518 0.342 1
1 213 . 8 1 1 A 17 17 SER C C 17 172.700 173.932 -1.232 1
1 214 . 8 1 1 A 17 17 SER CA C 17 57.300 57.711 -0.411 1
1 215 . 8 1 1 A 17 17 SER CB C 17 64.000 64.863 -0.863 1
1 216 . 8 1 1 A 17 17 SER N N 17 117.100 118.159 -1.059 1
1 217 . 8 1 1 A 18 18 VAL H H 18 8.570 8.780 -0.210 1
1 218 . 8 1 1 A 18 18 VAL HA H 18 4.900 5.136 -0.236 1
1 226 . 8 1 1 A 18 18 VAL C C 18 173.700 173.562 0.138 1
1 227 . 8 1 1 A 18 18 VAL CA C 18 58.800 59.086 -0.286 1
1 228 . 8 1 1 A 18 18 VAL CB C 18 36.700 36.082 0.618 1
1 231 . 8 1 1 A 18 18 VAL N N 18 113.500 119.128 -5.628 1
1 232 . 8 1 1 A 19 19 ILE H H 19 8.490 8.615 -0.125 1
1 233 . 8 1 1 A 19 19 ILE HA H 19 5.300 4.899 0.401 1
1 243 . 8 1 1 A 19 19 ILE C C 19 175.800 174.723 1.077 1
1 244 . 8 1 1 A 19 19 ILE CA C 19 59.700 59.276 0.424 1
1 245 . 8 1 1 A 19 19 ILE CB C 19 41.700 42.543 -0.843 1
1 249 . 8 1 1 A 19 19 ILE N N 19 120.600 122.062 -1.462 1
1 250 . 8 1 1 A 20 20 GLY H H 20 8.670 7.838 0.832 1
1 251 . 8 1 1 A 20 20 GLY HA2 H 20 3.760 4.169 -0.409 1
1 252 . 8 1 1 A 20 20 GLY HA3 H 20 4.190 4.173 0.017 1
1 253 . 8 1 1 A 20 20 GLY C C 20 169.900 171.259 -1.359 1
1 254 . 8 1 1 A 20 20 GLY CA C 20 46.000 46.075 -0.075 1
1 255 . 8 1 1 A 20 20 GLY N N 20 110.200 113.661 -3.461 1
1 256 . 8 1 1 A 21 21 LYS H H 21 8.920 8.122 0.798 1
1 257 . 8 1 1 A 21 21 LYS HA H 21 5.210 5.248 -0.038 1
1 266 . 8 1 1 A 21 21 LYS C C 21 176.400 175.083 1.317 1
1 267 . 8 1 1 A 21 21 LYS CA C 21 54.400 54.709 -0.309 1
1 268 . 8 1 1 A 21 21 LYS CB C 21 35.400 35.562 -0.162 1
1 272 . 8 1 1 A 21 21 LYS N N 21 119.100 120.925 -1.825 1
1 273 . 8 1 1 A 22 22 ILE H H 22 8.900 8.870 0.030 1
1 274 . 8 1 1 A 22 22 ILE HA H 22 5.050 5.043 0.007 1
1 284 . 8 1 1 A 22 22 ILE C C 22 176.900 175.493 1.407 1
1 285 . 8 1 1 A 22 22 ILE CA C 22 57.800 60.394 -2.594 1
1 286 . 8 1 1 A 22 22 ILE CB C 22 36.200 38.751 -2.551 1
1 290 . 8 1 1 A 22 22 ILE N N 22 130.000 128.440 1.560 1
1 291 . 8 1 1 A 23 23 THR H H 23 9.020 8.575 0.445 1
1 292 . 8 1 1 A 23 23 THR HA H 23 4.660 5.232 -0.572 1
1 297 . 8 1 1 A 23 23 THR C C 23 174.000 174.066 -0.066 1
1 298 . 8 1 1 A 23 23 THR CA C 23 60.800 59.836 0.964 1
1 299 . 8 1 1 A 23 23 THR CB C 23 73.400 71.823 1.577 1
1 301 . 8 1 1 A 23 23 THR N N 23 118.200 117.891 0.309 1
1 302 . 8 1 1 A 24 24 GLY H H 24 8.430 8.679 -0.249 1
1 303 . 8 1 1 A 24 24 GLY HA2 H 24 3.910 3.966 -0.056 1
1 304 . 8 1 1 A 24 24 GLY HA3 H 24 3.910 4.108 -0.198 1
1 305 . 8 1 1 A 24 24 GLY C C 24 175.400 174.776 0.624 1
1 306 . 8 1 1 A 24 24 GLY CA C 24 47.100 47.087 0.013 1
1 307 . 8 1 1 A 24 24 GLY N N 24 107.200 111.683 -4.483 1
1 308 . 8 1 1 A 25 25 ILE H H 25 9.370 8.071 1.299 1
1 309 . 8 1 1 A 25 25 ILE HA H 25 4.480 4.293 0.187 1
1 319 . 8 1 1 A 25 25 ILE C C 25 178.200 175.715 2.485 1
1 320 . 8 1 1 A 25 25 ILE CA C 25 59.200 61.157 -1.957 1
1 321 . 8 1 1 A 25 25 ILE CB C 25 35.400 38.401 -3.001 1
1 325 . 8 1 1 A 25 25 ILE N N 25 120.600 120.458 0.142 1
1 326 . 8 1 1 A 26 26 HIS H H 26 9.000 9.123 -0.123 1
1 327 . 8 1 1 A 26 26 HIS HA H 26 4.770 5.183 -0.413 1
1 330 . 8 1 1 A 26 26 HIS C C 26 172.700 173.633 -0.933 1
1 331 . 8 1 1 A 26 26 HIS CA C 26 55.000 54.593 0.407 1
1 332 . 8 1 1 A 26 26 HIS CB C 26 31.100 33.551 -2.451 1
1 333 . 8 1 1 A 26 26 HIS N N 26 123.800 125.142 -1.342 1
1 334 . 8 1 1 A 27 27 LYS H H 27 8.930 8.986 -0.056 1
1 335 . 8 1 1 A 27 27 LYS HA H 27 4.770 4.659 0.111 1
1 344 . 8 1 1 A 27 27 LYS C C 27 175.300 175.057 0.243 1
1 345 . 8 1 1 A 27 27 LYS CA C 27 55.100 54.875 0.225 1
1 346 . 8 1 1 A 27 27 LYS CB C 27 34.400 34.414 -0.014 1
1 350 . 8 1 1 A 27 27 LYS N N 27 125.900 123.707 2.193 1
1 351 . 8 1 1 A 28 28 LYS H H 28 8.880 8.582 0.298 1
1 352 . 8 1 1 A 28 28 LYS HA H 28 4.570 4.971 -0.401 1
1 361 . 8 1 1 A 28 28 LYS C C 28 174.500 175.078 -0.578 1
1 362 . 8 1 1 A 28 28 LYS CA C 28 54.600 54.570 0.030 1
1 363 . 8 1 1 A 28 28 LYS CB C 28 35.300 37.011 -1.711 1
1 367 . 8 1 1 A 28 28 LYS N N 28 127.400 124.827 2.573 1
1 368 . 8 1 1 A 29 29 GLU H H 29 8.440 8.445 -0.005 1
1 369 . 8 1 1 A 29 29 GLU HA H 29 5.260 5.262 -0.002 1
1 374 . 8 1 1 A 29 29 GLU C C 29 175.800 175.582 0.218 1
1 375 . 8 1 1 A 29 29 GLU CA C 29 54.800 54.881 -0.081 1
1 376 . 8 1 1 A 29 29 GLU CB C 29 31.500 32.955 -1.455 1
1 378 . 8 1 1 A 29 29 GLU N N 29 122.200 120.581 1.619 1
1 379 . 8 1 1 A 30 30 TYR H H 30 8.960 8.897 0.063 1
1 380 . 8 1 1 A 30 30 TYR HA H 30 4.820 5.339 -0.519 1
1 387 . 8 1 1 A 30 30 TYR C C 30 172.600 172.482 0.118 1
1 388 . 8 1 1 A 30 30 TYR CA C 30 56.300 55.597 0.703 1
1 389 . 8 1 1 A 30 30 TYR CB C 30 40.500 41.560 -1.060 1
1 394 . 8 1 1 A 30 30 TYR N N 30 121.100 118.765 2.335 1
1 395 . 8 1 1 A 31 31 GLU H H 31 8.610 8.713 -0.103 1
1 396 . 8 1 1 A 31 31 GLU HA H 31 4.810 4.566 0.244 1
1 401 . 8 1 1 A 31 31 GLU C C 31 176.100 174.518 1.582 1
1 402 . 8 1 1 A 31 31 GLU CA C 31 55.100 55.737 -0.637 1
1 403 . 8 1 1 A 31 31 GLU CB C 31 30.300 30.460 -0.160 1
1 405 . 8 1 1 A 31 31 GLU N N 31 121.800 120.494 1.306 1
1 406 . 8 1 1 A 32 32 SER H H 32 8.570 9.197 -0.627 1
1 407 . 8 1 1 A 32 32 SER HA H 32 4.520 4.918 -0.398 1
1 410 . 8 1 1 A 32 32 SER C C 32 174.300 173.075 1.225 1
1 411 . 8 1 1 A 32 32 SER CA C 32 57.300 56.657 0.643 1
1 412 . 8 1 1 A 32 32 SER CB C 32 64.100 64.872 -0.772 1
1 413 . 8 1 1 A 32 32 SER N N 32 118.500 120.874 -2.374 1
1 414 . 8 1 1 A 33 33 ASP H H 33 9.290 9.528 -0.238 1
1 415 . 8 1 1 A 33 33 ASP HA H 33 4.340 4.348 -0.008 1
1 418 . 8 1 1 A 33 33 ASP C C 33 175.900 176.150 -0.250 1
1 419 . 8 1 1 A 33 33 ASP CA C 33 55.000 55.373 -0.373 1
1 420 . 8 1 1 A 33 33 ASP CB C 33 39.300 39.458 -0.158 1
1 421 . 8 1 1 A 33 33 ASP N N 33 125.700 129.158 -3.458 1
1 422 . 8 1 1 A 34 34 GLY H H 34 8.690 8.412 0.278 1
1 423 . 8 1 1 A 34 34 GLY HA2 H 34 3.660 3.685 -0.025 1
1 424 . 8 1 1 A 34 34 GLY HA3 H 34 4.140 3.688 0.452 1
1 425 . 8 1 1 A 34 34 GLY C C 34 174.200 173.718 0.482 1
1 426 . 8 1 1 A 34 34 GLY CA C 34 45.600 45.662 -0.062 1
1 427 . 8 1 1 A 34 34 GLY N N 34 104.800 104.860 -0.060 1
1 428 . 8 1 1 A 35 35 THR H H 35 7.840 7.953 -0.113 1
1 429 . 8 1 1 A 35 35 THR HA H 35 4.660 4.766 -0.106 1
1 434 . 8 1 1 A 35 35 THR C C 35 173.000 173.414 -0.414 1
1 435 . 8 1 1 A 35 35 THR CA C 35 60.200 59.927 0.273 1
1 436 . 8 1 1 A 35 35 THR CB C 35 71.200 70.843 0.357 1
1 438 . 8 1 1 A 35 35 THR N N 35 114.800 111.615 3.185 1
1 439 . 8 1 1 A 36 36 THR H H 36 8.480 8.639 -0.159 1
1 440 . 8 1 1 A 36 36 THR HA H 36 4.620 4.513 0.107 1
1 445 . 8 1 1 A 36 36 THR C C 36 173.800 174.388 -0.588 1
1 446 . 8 1 1 A 36 36 THR CA C 36 62.300 63.000 -0.700 1
1 447 . 8 1 1 A 36 36 THR CB C 36 69.500 69.284 0.216 1
1 449 . 8 1 1 A 36 36 THR N N 36 119.400 121.872 -2.472 1
1 450 . 8 1 1 A 37 37 LYS H H 37 8.880 8.667 0.213 1
1 451 . 8 1 1 A 37 37 LYS HA H 37 4.570 4.872 -0.302 1
1 460 . 8 1 1 A 37 37 LYS C C 37 174.500 175.896 -1.396 1
1 461 . 8 1 1 A 37 37 LYS CA C 37 54.600 53.992 0.608 1
1 462 . 8 1 1 A 37 37 LYS CB C 37 35.500 36.135 -0.635 1
1 466 . 8 1 1 A 37 37 LYS N N 37 128.000 125.102 2.898 1
1 467 . 8 1 1 A 38 38 SER H H 38 8.370 8.828 -0.458 1
1 468 . 8 1 1 A 38 38 SER HA H 38 5.250 4.901 0.349 1
1 471 . 8 1 1 A 38 38 SER C C 38 173.200 173.708 -0.508 1
1 472 . 8 1 1 A 38 38 SER CA C 38 57.900 58.558 -0.658 1
1 473 . 8 1 1 A 38 38 SER CB C 38 65.500 63.868 1.632 1
1 474 . 8 1 1 A 38 38 SER N N 38 114.300 118.850 -4.550 1
1 475 . 8 1 1 A 39 39 VAL H H 39 9.020 8.751 0.269 1
1 476 . 8 1 1 A 39 39 VAL HA H 39 4.900 4.911 -0.011 1
1 484 . 8 1 1 A 39 39 VAL C C 39 173.200 172.847 0.353 1
1 485 . 8 1 1 A 39 39 VAL CA C 39 59.200 59.632 -0.432 1
1 486 . 8 1 1 A 39 39 VAL CB C 39 34.600 35.388 -0.788 1
1 489 . 8 1 1 A 39 39 VAL N N 39 123.600 121.528 2.072 1
1 490 . 8 1 1 A 40 40 TYR H H 40 8.900 9.005 -0.105 1
1 491 . 8 1 1 A 40 40 TYR HA H 40 4.730 5.211 -0.481 1
1 498 . 8 1 1 A 40 40 TYR CA C 40 56.500 57.077 -0.577 1
1 499 . 8 1 1 A 40 40 TYR CB C 40 39.000 40.287 -1.287 1
1 504 . 8 1 1 A 40 40 TYR N N 40 126.300 127.246 -0.946 1
1 505 . 8 1 1 A 41 41 GLN H H 41 8.630 8.604 0.026 1
1 506 . 8 1 1 A 41 41 GLN HA H 41 5.330 5.234 0.096 1
1 513 . 8 1 1 A 41 41 GLN C C 41 175.500 175.949 -0.449 1
1 514 . 8 1 1 A 41 41 GLN CA C 41 53.800 54.174 -0.374 1
1 515 . 8 1 1 A 41 41 GLN CB C 41 32.100 31.736 0.364 1
1 518 . 8 1 1 A 41 41 GLN N N 41 122.000 121.826 0.174 1
1 520 . 8 1 1 A 42 42 GLY H H 42 8.560 8.006 0.554 1
1 521 . 8 1 1 A 42 42 GLY HA2 H 42 3.680 4.332 -0.652 1
1 522 . 8 1 1 A 42 42 GLY HA3 H 42 4.020 4.402 -0.382 1
1 523 . 8 1 1 A 42 42 GLY C C 42 171.600 171.028 0.572 1
1 524 . 8 1 1 A 42 42 GLY CA C 42 47.300 46.130 1.170 1
1 525 . 8 1 1 A 42 42 GLY N N 42 113.000 108.762 4.238 1
1 526 . 8 1 1 A 43 43 TYR H H 43 9.320 8.360 0.960 1
1 527 . 8 1 1 A 43 43 TYR HA H 43 5.280 5.413 -0.133 1
1 534 . 8 1 1 A 43 43 TYR C C 43 173.200 173.949 -0.749 1
1 535 . 8 1 1 A 43 43 TYR CA C 43 57.600 56.386 1.214 1
1 536 . 8 1 1 A 43 43 TYR CB C 43 42.400 42.515 -0.115 1
1 541 . 8 1 1 A 43 43 TYR N N 43 126.300 118.786 7.514 1
1 542 . 8 1 1 A 44 44 ILE H H 44 9.160 8.787 0.373 1
1 543 . 8 1 1 A 44 44 ILE HA H 44 5.270 5.393 -0.123 1
1 553 . 8 1 1 A 44 44 ILE C C 44 172.900 173.272 -0.372 1
1 554 . 8 1 1 A 44 44 ILE CA C 44 59.000 59.325 -0.325 1
1 555 . 8 1 1 A 44 44 ILE CB C 44 42.200 40.889 1.311 1
1 559 . 8 1 1 A 44 44 ILE N N 44 117.700 123.728 -6.028 1
1 560 . 8 1 1 A 45 45 GLU H H 45 8.420 8.835 -0.415 1
1 561 . 8 1 1 A 45 45 GLU HA H 45 5.600 5.570 0.030 1
1 566 . 8 1 1 A 45 45 GLU C C 45 174.300 174.597 -0.297 1
1 567 . 8 1 1 A 45 45 GLU CA C 45 54.000 54.648 -0.648 1
1 568 . 8 1 1 A 45 45 GLU CB C 45 34.400 33.381 1.019 1
1 570 . 8 1 1 A 45 45 GLU N N 45 123.600 129.755 -6.155 1
1 571 . 8 1 1 A 46 46 ASP H H 46 8.530 8.499 0.031 1
1 572 . 8 1 1 A 46 46 ASP HA H 46 5.070 4.916 0.154 1
1 575 . 8 1 1 A 46 46 ASP C C 46 175.000 174.734 0.266 1
1 576 . 8 1 1 A 46 46 ASP CA C 46 51.800 52.877 -1.077 1
1 577 . 8 1 1 A 46 46 ASP CB C 46 41.300 44.254 -2.954 1
1 578 . 8 1 1 A 46 46 ASP N N 46 125.500 124.255 1.245 1
1 579 . 8 1 1 A 47 47 ASP H H 47 9.160 8.848 0.312 1
1 580 . 8 1 1 A 47 47 ASP HA H 47 4.430 4.638 -0.208 1
1 583 . 8 1 1 A 47 47 ASP C C 47 176.000 177.339 -1.339 1
1 584 . 8 1 1 A 47 47 ASP CA C 47 55.000 55.886 -0.886 1
1 585 . 8 1 1 A 47 47 ASP CB C 47 38.900 40.368 -1.468 1
1 586 . 8 1 1 A 47 47 ASP N N 47 114.200 121.477 -7.277 1
1 587 . 8 1 1 A 48 48 THR H H 48 9.470 7.820 1.650 1
1 588 . 8 1 1 A 48 48 THR HA H 48 4.520 4.468 0.052 1
1 593 . 8 1 1 A 48 48 THR C C 48 174.500 175.069 -0.569 1
1 594 . 8 1 1 A 48 48 THR CA C 48 62.600 62.364 0.236 1
1 595 . 8 1 1 A 48 48 THR CB C 48 70.400 69.535 0.865 1
1 597 . 8 1 1 A 48 48 THR N N 48 111.800 107.852 3.948 1
1 598 . 8 1 1 A 49 49 ALA H H 49 7.850 7.430 0.420 1
1 599 . 8 1 1 A 49 49 ALA HA H 49 4.440 4.402 0.038 1
1 603 . 8 1 1 A 49 49 ALA C C 49 173.200 174.713 -1.513 1
1 604 . 8 1 1 A 49 49 ALA CA C 49 52.700 51.290 1.410 1
1 605 . 8 1 1 A 49 49 ALA CB C 49 21.300 20.333 0.967 1
1 606 . 8 1 1 A 49 49 ALA N N 49 123.400 120.366 3.034 1
1 607 . 8 1 1 A 50 50 ARG H H 50 8.160 8.488 -0.328 1
1 608 . 8 1 1 A 50 50 ARG HA H 50 5.350 5.507 -0.157 1
1 616 . 8 1 1 A 50 50 ARG C C 50 174.700 174.308 0.392 1
1 617 . 8 1 1 A 50 50 ARG CA C 50 54.000 54.842 -0.842 1
1 618 . 8 1 1 A 50 50 ARG CB C 50 34.500 34.262 0.238 1
1 622 . 8 1 1 A 50 50 ARG N N 50 117.400 117.886 -0.486 1
1 624 . 8 1 1 A 51 51 ILE H H 51 9.390 8.648 0.742 1
1 625 . 8 1 1 A 51 51 ILE HA H 51 4.790 5.029 -0.239 1
1 635 . 8 1 1 A 51 51 ILE C C 51 172.600 173.066 -0.466 1
1 636 . 8 1 1 A 51 51 ILE CA C 51 60.000 59.200 0.800 1
1 637 . 8 1 1 A 51 51 ILE CB C 51 42.800 41.902 0.898 1
1 641 . 8 1 1 A 51 51 ILE N N 51 124.600 123.575 1.025 1
1 642 . 8 1 1 A 52 52 ARG H H 52 7.980 8.583 -0.603 1
1 643 . 8 1 1 A 52 52 ARG HA H 52 4.170 4.034 0.136 1
1 651 . 8 1 1 A 52 52 ARG C C 52 174.600 175.803 -1.203 1
1 652 . 8 1 1 A 52 52 ARG CA C 52 57.100 56.456 0.644 1
1 653 . 8 1 1 A 52 52 ARG CB C 52 31.300 31.017 0.283 1
1 657 . 8 1 1 A 52 52 ARG N N 52 125.900 129.562 -3.662 1
1 659 . 8 1 1 A 53 53 ILE H H 53 8.290 8.760 -0.470 1
1 660 . 8 1 1 A 53 53 ILE HA H 53 5.160 5.166 -0.006 1
1 670 . 8 1 1 A 53 53 ILE C C 53 172.400 174.792 -2.392 1
1 671 . 8 1 1 A 53 53 ILE CA C 53 58.600 59.148 -0.548 1
1 672 . 8 1 1 A 53 53 ILE CB C 53 41.900 42.379 -0.479 1
1 676 . 8 1 1 A 53 53 ILE N N 53 118.500 121.011 -2.511 1
1 677 . 8 1 1 A 54 54 SER H H 54 8.350 8.810 -0.460 1
1 678 . 8 1 1 A 54 54 SER HA H 54 5.070 5.106 -0.036 1
1 681 . 8 1 1 A 54 54 SER C C 54 172.400 172.562 -0.162 1
1 682 . 8 1 1 A 54 54 SER CA C 54 57.000 57.262 -0.262 1
1 683 . 8 1 1 A 54 54 SER CB C 54 65.900 65.670 0.230 1
1 684 . 8 1 1 A 54 54 SER N N 54 120.700 119.163 1.537 1
1 685 . 8 1 1 A 55 55 SER H H 55 9.130 9.316 -0.186 1
1 686 . 8 1 1 A 55 55 SER HA H 55 5.270 5.196 0.074 1
1 690 . 8 1 1 A 55 55 SER C C 55 174.400 172.762 1.638 1
1 691 . 8 1 1 A 55 55 SER CA C 55 55.500 56.577 -1.077 1
1 692 . 8 1 1 A 55 55 SER CB C 55 64.500 64.765 -0.265 1
1 693 . 8 1 1 A 55 55 SER N N 55 117.200 121.552 -4.352 1
1 694 . 8 1 1 A 56 56 PHE H H 56 8.970 8.626 0.344 1
1 695 . 8 1 1 A 56 56 PHE HA H 56 4.600 4.957 -0.357 1
1 703 . 8 1 1 A 56 56 PHE C C 56 176.500 177.108 -0.608 1
1 704 . 8 1 1 A 56 56 PHE CA C 56 58.300 57.230 1.070 1
1 705 . 8 1 1 A 56 56 PHE CB C 56 37.900 40.849 -2.949 1
1 711 . 8 1 1 A 56 56 PHE N N 56 129.400 126.137 3.263 1
1 712 . 8 1 1 A 57 57 GLY H H 57 8.570 8.873 -0.303 1
1 713 . 8 1 1 A 57 57 GLY HA2 H 57 4.020 4.152 -0.132 1
1 714 . 8 1 1 A 57 57 GLY HA3 H 57 4.380 4.183 0.197 1
1 715 . 8 1 1 A 57 57 GLY C C 57 173.700 174.164 -0.464 1
1 716 . 8 1 1 A 57 57 GLY CA C 57 46.300 45.711 0.589 1
1 717 . 8 1 1 A 57 57 GLY N N 57 112.500 112.252 0.248 1
1 718 . 8 1 1 A 58 58 LYS H H 58 6.800 8.000 -1.200 1
1 719 . 8 1 1 A 58 58 LYS HA H 58 4.410 4.394 0.016 1
1 728 . 8 1 1 A 58 58 LYS C C 58 174.800 176.441 -1.641 1
1 729 . 8 1 1 A 58 58 LYS CA C 58 55.200 55.994 -0.794 1
1 730 . 8 1 1 A 58 58 LYS CB C 58 33.300 32.845 0.455 1
1 734 . 8 1 1 A 58 58 LYS N N 58 118.700 121.161 -2.461 1
1 735 . 8 1 1 A 59 59 GLN H H 59 8.390 8.105 0.285 1
1 736 . 8 1 1 A 59 59 GLN HA H 59 1.830 3.415 -1.585 1
1 743 . 8 1 1 A 59 59 GLN C C 59 174.100 174.851 -0.751 1
1 744 . 8 1 1 A 59 59 GLN CA C 59 57.100 54.357 2.743 1
1 745 . 8 1 1 A 59 59 GLN CB C 59 28.900 29.486 -0.586 1
1 748 . 8 1 1 A 59 59 GLN N N 59 124.000 122.327 1.673 1
1 750 . 8 1 1 A 60 60 LEU H H 60 5.320 8.161 -2.841 1
1 751 . 8 1 1 A 60 60 LEU HA H 60 4.370 5.010 -0.640 1
1 761 . 8 1 1 A 60 60 LEU CA C 60 52.800 53.493 -0.693 1
1 762 . 8 1 1 A 60 60 LEU CB C 60 46.700 45.557 1.143 1
1 766 . 8 1 1 A 60 60 LEU N N 60 121.800 121.098 0.702 1
1 767 . 8 1 1 A 61 61 GLN H H 61 8.660 8.749 -0.089 1
1 768 . 8 1 1 A 61 61 GLN HA H 61 4.440 4.648 -0.208 1
1 775 . 8 1 1 A 61 61 GLN C C 61 174.000 175.002 -1.002 1
1 776 . 8 1 1 A 61 61 GLN CA C 61 53.800 54.279 -0.479 1
1 777 . 8 1 1 A 61 61 GLN CB C 61 31.800 31.301 0.499 1
1 780 . 8 1 1 A 61 61 GLN N N 61 120.300 120.282 0.018 1
1 782 . 8 1 1 A 62 62 ASP H H 62 8.450 8.698 -0.248 1
1 783 . 8 1 1 A 62 62 ASP HA H 62 4.130 4.347 -0.217 1
1 786 . 8 1 1 A 62 62 ASP C C 62 177.200 177.013 0.187 1
1 787 . 8 1 1 A 62 62 ASP CA C 62 55.700 55.119 0.581 1
1 788 . 8 1 1 A 62 62 ASP CB C 62 39.400 40.818 -1.418 1
1 789 . 8 1 1 A 62 62 ASP N N 62 122.400 124.447 -2.047 1
1 790 . 8 1 1 A 63 63 SER H H 63 9.210 8.872 0.338 1
1 791 . 8 1 1 A 63 63 SER HA H 63 3.850 3.996 -0.146 1
1 794 . 8 1 1 A 63 63 SER C C 63 173.200 172.441 0.759 1
1 795 . 8 1 1 A 63 63 SER CA C 63 61.700 59.443 2.257 1
1 796 . 8 1 1 A 63 63 SER CB C 63 61.800 61.833 -0.033 1
1 797 . 8 1 1 A 63 63 SER N N 63 114.300 115.909 -1.609 1
1 798 . 8 1 1 A 64 64 ASP H H 64 7.960 7.531 0.429 1
1 799 . 8 1 1 A 64 64 ASP HA H 64 4.540 4.884 -0.344 1
1 802 . 8 1 1 A 64 64 ASP C C 64 174.900 175.378 -0.478 1
1 803 . 8 1 1 A 64 64 ASP CA C 64 54.900 53.774 1.126 1
1 804 . 8 1 1 A 64 64 ASP CB C 64 40.900 42.287 -1.387 1
1 805 . 8 1 1 A 64 64 ASP N N 64 122.600 120.448 2.152 1
1 806 . 8 1 1 A 65 65 VAL H H 65 8.180 8.530 -0.350 1
1 807 . 8 1 1 A 65 65 VAL HA H 65 4.670 4.472 0.198 1
1 815 . 8 1 1 A 65 65 VAL C C 65 175.900 175.548 0.352 1
1 816 . 8 1 1 A 65 65 VAL CA C 65 62.300 62.267 0.033 1
1 817 . 8 1 1 A 65 65 VAL CB C 65 31.700 31.250 0.450 1
1 820 . 8 1 1 A 65 65 VAL N N 65 123.100 125.984 -2.884 1
1 821 . 8 1 1 A 66 66 VAL H H 66 8.770 8.670 0.100 1
1 822 . 8 1 1 A 66 66 VAL HA H 66 5.160 5.119 0.041 1
1 830 . 8 1 1 A 66 66 VAL C C 66 173.600 173.287 0.313 1
1 831 . 8 1 1 A 66 66 VAL CA C 66 58.100 58.795 -0.695 1
1 832 . 8 1 1 A 66 66 VAL CB C 66 35.700 36.123 -0.423 1
1 835 . 8 1 1 A 66 66 VAL N N 66 118.100 120.321 -2.221 1
1 836 . 8 1 1 A 67 67 ARG H H 67 8.880 8.908 -0.028 1
1 837 . 8 1 1 A 67 67 ARG HA H 67 5.110 5.111 -0.001 1
1 845 . 8 1 1 A 67 67 ARG C C 67 175.300 174.533 0.767 1
1 846 . 8 1 1 A 67 67 ARG CA C 67 54.200 54.362 -0.162 1
1 847 . 8 1 1 A 67 67 ARG CB C 67 32.200 33.541 -1.341 1
1 851 . 8 1 1 A 67 67 ARG N N 67 120.200 121.688 -1.488 1
1 853 . 8 1 1 A 68 68 ILE H H 68 9.220 8.948 0.272 1
1 854 . 8 1 1 A 68 68 ILE HA H 68 4.990 4.613 0.377 1
1 864 . 8 1 1 A 68 68 ILE C C 68 174.900 174.666 0.234 1
1 865 . 8 1 1 A 68 68 ILE CA C 68 58.600 59.499 -0.899 1
1 866 . 8 1 1 A 68 68 ILE CB C 68 39.300 38.878 0.422 1
1 870 . 8 1 1 A 68 68 ILE N N 68 127.200 128.322 -1.122 1
1 871 . 8 1 1 A 69 69 ASP H H 69 9.110 8.957 0.153 1
1 872 . 8 1 1 A 69 69 ASP HA H 69 5.370 5.046 0.324 1
1 875 . 8 1 1 A 69 69 ASP C C 69 175.800 176.410 -0.610 1
1 876 . 8 1 1 A 69 69 ASP CA C 69 52.400 52.689 -0.289 1
1 877 . 8 1 1 A 69 69 ASP CB C 69 43.700 43.029 0.671 1
1 878 . 8 1 1 A 69 69 ASP N N 69 123.400 125.704 -2.304 1
1 879 . 8 1 1 A 70 70 ASN H H 70 8.300 8.644 -0.344 1
1 880 . 8 1 1 A 70 70 ASN HA H 70 4.160 4.372 -0.212 1
1 885 . 8 1 1 A 70 70 ASN C C 70 176.300 174.563 1.737 1
1 886 . 8 1 1 A 70 70 ASN CA C 70 54.300 54.177 0.123 1
1 887 . 8 1 1 A 70 70 ASN CB C 70 37.500 37.517 -0.017 1
1 889 . 8 1 1 A 70 70 ASN N N 70 119.800 121.024 -1.224 1
1 891 . 8 1 1 A 71 71 ALA H H 71 9.100 7.953 1.147 1
1 892 . 8 1 1 A 71 71 ALA HA H 71 4.500 4.485 0.015 1
1 896 . 8 1 1 A 71 71 ALA C C 71 175.700 176.723 -1.023 1
1 897 . 8 1 1 A 71 71 ALA CA C 71 51.900 52.349 -0.449 1
1 898 . 8 1 1 A 71 71 ALA CB C 71 19.600 19.655 -0.055 1
1 899 . 8 1 1 A 71 71 ALA N N 71 123.000 121.149 1.851 1
1 900 . 8 1 1 A 72 72 ARG H H 72 8.490 8.519 -0.029 1
1 901 . 8 1 1 A 72 72 ARG HA H 72 4.720 4.798 -0.078 1
1 909 . 8 1 1 A 72 72 ARG C C 72 175.800 175.778 0.022 1
1 910 . 8 1 1 A 72 72 ARG CA C 72 54.400 55.450 -1.050 1
1 911 . 8 1 1 A 72 72 ARG CB C 72 32.700 31.502 1.198 1
1 915 . 8 1 1 A 72 72 ARG N N 72 122.500 124.045 -1.545 1
1 917 . 8 1 1 A 73 73 VAL H H 73 8.310 8.680 -0.370 1
1 918 . 8 1 1 A 73 73 VAL HA H 73 4.250 4.663 -0.413 1
1 926 . 8 1 1 A 73 73 VAL C C 73 174.600 174.985 -0.385 1
1 927 . 8 1 1 A 73 73 VAL CA C 73 62.800 61.184 1.616 1
1 928 . 8 1 1 A 73 73 VAL CB C 73 32.100 32.999 -0.899 1
1 931 . 8 1 1 A 73 73 VAL N N 73 127.100 125.749 1.351 1
1 932 . 8 1 1 A 74 74 ALA H H 74 8.880 8.935 -0.055 1
1 933 . 8 1 1 A 74 74 ALA HA H 74 4.500 5.127 -0.627 1
1 937 . 8 1 1 A 74 74 ALA C C 74 174.800 174.720 0.080 1
1 938 . 8 1 1 A 74 74 ALA CA C 74 50.500 50.399 0.101 1
1 939 . 8 1 1 A 74 74 ALA CB C 74 22.500 23.995 -1.495 1
1 940 . 8 1 1 A 74 74 ALA N N 74 131.000 128.624 2.376 1
1 941 . 8 1 1 A 75 75 GLN H H 75 8.280 8.545 -0.265 1
1 942 . 8 1 1 A 75 75 GLN HA H 75 4.910 4.972 -0.062 1
1 949 . 8 1 1 A 75 75 GLN C C 75 175.100 174.229 0.871 1
1 950 . 8 1 1 A 75 75 GLN CA C 75 54.600 53.871 0.729 1
1 951 . 8 1 1 A 75 75 GLN CB C 75 31.400 31.401 -0.001 1
1 954 . 8 1 1 A 75 75 GLN N N 75 118.800 120.579 -1.779 1
1 956 . 8 1 1 A 76 76 PHE H H 76 8.710 9.116 -0.406 1
1 957 . 8 1 1 A 76 76 PHE HA H 76 4.660 4.914 -0.254 1
1 965 . 8 1 1 A 76 76 PHE C C 76 174.900 175.478 -0.578 1
1 966 . 8 1 1 A 76 76 PHE CA C 76 57.000 56.676 0.324 1
1 967 . 8 1 1 A 76 76 PHE CB C 76 41.000 42.126 -1.126 1
1 973 . 8 1 1 A 76 76 PHE N N 76 125.000 125.530 -0.530 1
1 974 . 8 1 1 A 77 77 ASN H H 77 9.040 9.508 -0.468 1
1 975 . 8 1 1 A 77 77 ASN HA H 77 4.170 4.516 -0.346 1
1 980 . 8 1 1 A 77 77 ASN C C 77 174.200 175.676 -1.476 1
1 981 . 8 1 1 A 77 77 ASN CA C 77 53.800 54.543 -0.743 1
1 982 . 8 1 1 A 77 77 ASN CB C 77 37.400 37.528 -0.128 1
1 984 . 8 1 1 A 77 77 ASN N N 77 123.200 123.569 -0.369 1
1 986 . 8 1 1 A 78 78 GLY H H 78 8.370 8.621 -0.251 1
1 987 . 8 1 1 A 78 78 GLY HA2 H 78 3.410 3.614 -0.204 1
1 988 . 8 1 1 A 78 78 GLY HA3 H 78 3.980 3.713 0.267 1
1 989 . 8 1 1 A 78 78 GLY C C 78 173.800 173.148 0.652 1
1 990 . 8 1 1 A 78 78 GLY CA C 78 45.000 45.280 -0.280 1
1 991 . 8 1 1 A 78 78 GLY N N 78 103.300 104.731 -1.431 1
1 992 . 8 1 1 A 79 79 TYR H H 79 7.670 8.194 -0.524 1
1 993 . 8 1 1 A 79 79 TYR HA H 79 4.860 4.858 0.002 1
1 1000 . 8 1 1 A 79 79 TYR C C 79 174.800 175.625 -0.825 1
1 1001 . 8 1 1 A 79 79 TYR CA C 79 56.300 57.425 -1.125 1
1 1002 . 8 1 1 A 79 79 TYR CB C 79 40.800 40.801 -0.001 1
1 1007 . 8 1 1 A 79 79 TYR N N 79 118.700 119.172 -0.472 1
1 1008 . 8 1 1 A 80 80 LEU H H 80 8.760 8.716 0.044 1
1 1009 . 8 1 1 A 80 80 LEU HA H 80 4.830 4.555 0.275 1
1 1019 . 8 1 1 A 80 80 LEU C C 80 176.200 175.667 0.533 1
1 1020 . 8 1 1 A 80 80 LEU CA C 80 54.700 54.873 -0.173 1
1 1021 . 8 1 1 A 80 80 LEU CB C 80 43.500 42.428 1.072 1
1 1025 . 8 1 1 A 80 80 LEU N N 80 122.600 125.628 -3.028 1
1 1026 . 8 1 1 A 81 81 SER H H 81 8.650 8.790 -0.140 1
1 1027 . 8 1 1 A 81 81 SER HA H 81 4.860 5.202 -0.342 1
1 1030 . 8 1 1 A 81 81 SER C C 81 172.600 172.403 0.197 1
1 1031 . 8 1 1 A 81 81 SER CA C 81 56.600 57.600 -1.000 1
1 1032 . 8 1 1 A 81 81 SER CB C 81 66.300 67.064 -0.764 1
1 1033 . 8 1 1 A 81 81 SER N N 81 114.700 115.734 -1.034 1
1 1034 . 8 1 1 A 82 82 LEU H H 82 8.680 8.548 0.132 1
1 1035 . 8 1 1 A 82 82 LEU HA H 82 5.190 5.234 -0.044 1
1 1045 . 8 1 1 A 82 82 LEU C C 82 177.100 175.676 1.424 1
1 1046 . 8 1 1 A 82 82 LEU CA C 82 53.300 53.732 -0.432 1
1 1047 . 8 1 1 A 82 82 LEU CB C 82 43.800 43.509 0.291 1
1 1051 . 8 1 1 A 82 82 LEU N N 82 119.800 124.039 -4.239 1
1 1052 . 8 1 1 A 83 83 SER H H 83 9.560 9.584 -0.024 1
1 1053 . 8 1 1 A 83 83 SER HA H 83 5.390 5.414 -0.024 1
1 1056 . 8 1 1 A 83 83 SER C C 83 174.200 173.820 0.380 1
1 1057 . 8 1 1 A 83 83 SER CA C 83 57.100 57.899 -0.799 1
1 1058 . 8 1 1 A 83 83 SER CB C 83 64.400 64.472 -0.072 1
1 1059 . 8 1 1 A 83 83 SER N N 83 119.000 122.251 -3.251 1
1 1060 . 8 1 1 A 84 84 VAL H H 84 9.150 8.993 0.157 1
1 1061 . 8 1 1 A 84 84 VAL HA H 84 4.490 4.668 -0.178 1
1 1069 . 8 1 1 A 84 84 VAL C C 84 174.700 176.209 -1.509 1
1 1070 . 8 1 1 A 84 84 VAL CA C 84 61.300 61.302 -0.002 1
1 1071 . 8 1 1 A 84 84 VAL CB C 84 33.000 32.235 0.765 1
1 1074 . 8 1 1 A 84 84 VAL N N 84 128.300 127.046 1.254 1
1 1075 . 8 1 1 A 85 85 GLY H H 85 7.970 8.800 -0.830 1
1 1076 . 8 1 1 A 85 85 GLY HA2 H 85 4.030 4.264 -0.234 1
1 1077 . 8 1 1 A 85 85 GLY HA3 H 85 4.840 4.330 0.510 1
1 1078 . 8 1 1 A 85 85 GLY C C 85 175.800 174.523 1.277 1
1 1079 . 8 1 1 A 85 85 GLY CA C 85 44.800 44.379 0.421 1
1 1080 . 8 1 1 A 85 85 GLY N N 85 114.300 115.157 -0.857 1
1 1081 . 8 1 1 A 86 86 ASP H H 86 8.860 8.922 -0.062 1
1 1082 . 8 1 1 A 86 86 ASP HA H 86 4.370 4.483 -0.113 1
1 1085 . 8 1 1 A 86 86 ASP C C 86 177.400 176.727 0.673 1
1 1086 . 8 1 1 A 86 86 ASP CA C 86 57.400 56.094 1.306 1
1 1087 . 8 1 1 A 86 86 ASP CB C 86 40.600 40.152 0.448 1
1 1088 . 8 1 1 A 86 86 ASP N N 86 122.500 120.034 2.466 1
1 1089 . 8 1 1 A 87 87 SER H H 87 8.540 7.696 0.844 1
1 1090 . 8 1 1 A 87 87 SER HA H 87 4.620 4.385 0.235 1
1 1093 . 8 1 1 A 87 87 SER C C 87 174.700 174.767 -0.067 1
1 1094 . 8 1 1 A 87 87 SER CA C 87 58.200 58.803 -0.603 1
1 1095 . 8 1 1 A 87 87 SER CB C 87 63.300 63.711 -0.411 1
1 1096 . 8 1 1 A 87 87 SER N N 87 112.100 111.895 0.205 1
1 1097 . 8 1 1 A 88 88 SER H H 88 7.880 7.615 0.265 1
1 1098 . 8 1 1 A 88 88 SER HA H 88 5.050 4.652 0.398 1
1 1101 . 8 1 1 A 88 88 SER C C 88 172.700 173.863 -1.163 1
1 1102 . 8 1 1 A 88 88 SER CA C 88 57.600 58.738 -1.138 1
1 1103 . 8 1 1 A 88 88 SER CB C 88 64.300 64.904 -0.604 1
1 1104 . 8 1 1 A 88 88 SER N N 88 119.200 118.938 0.262 1
1 1105 . 8 1 1 A 89 89 ARG H H 89 8.350 8.373 -0.023 1
1 1106 . 8 1 1 A 89 89 ARG HA H 89 4.720 5.198 -0.478 1
1 1114 . 8 1 1 A 89 89 ARG C C 89 174.200 174.235 -0.035 1
1 1115 . 8 1 1 A 89 89 ARG CA C 89 55.000 54.445 0.555 1
1 1116 . 8 1 1 A 89 89 ARG CB C 89 33.500 33.832 -0.332 1
1 1120 . 8 1 1 A 89 89 ARG N N 89 122.800 124.088 -1.288 1
1 1122 . 8 1 1 A 90 90 ILE H H 90 8.530 9.002 -0.472 1
1 1123 . 8 1 1 A 90 90 ILE HA H 90 4.790 4.871 -0.081 1
1 1133 . 8 1 1 A 90 90 ILE C C 90 175.400 175.234 0.166 1
1 1134 . 8 1 1 A 90 90 ILE CA C 90 60.600 60.198 0.402 1
1 1135 . 8 1 1 A 90 90 ILE CB C 90 40.600 40.265 0.335 1
1 1139 . 8 1 1 A 90 90 ILE N N 90 123.100 126.934 -3.834 1
1 1140 . 8 1 1 A 91 91 GLU H H 91 9.000 9.058 -0.058 1
1 1141 . 8 1 1 A 91 91 GLU HA H 91 4.730 4.933 -0.203 1
1 1146 . 8 1 1 A 91 91 GLU C C 91 175.100 175.627 -0.527 1
1 1147 . 8 1 1 A 91 91 GLU CA C 91 54.300 54.546 -0.246 1
1 1148 . 8 1 1 A 91 91 GLU CB C 91 32.400 31.990 0.410 1
1 1150 . 8 1 1 A 91 91 GLU N N 91 126.400 127.075 -0.675 1
1 1151 . 8 1 1 A 92 92 SER H H 92 8.830 8.841 -0.011 1
1 1152 . 8 1 1 A 92 92 SER HA H 92 4.700 4.772 -0.072 1
1 1155 . 8 1 1 A 92 92 SER C C 92 174.600 174.224 0.376 1
1 1156 . 8 1 1 A 92 92 SER CA C 92 59.300 58.642 0.658 1
1 1157 . 8 1 1 A 92 92 SER CB C 92 63.100 63.781 -0.681 1
1 1158 . 8 1 1 A 92 92 SER N N 92 119.800 121.339 -1.539 1
1 1159 . 8 1 1 A 93 93 VAL H H 93 8.350 8.421 -0.071 1
1 1160 . 8 1 1 A 93 93 VAL HA H 93 4.290 4.484 -0.194 1
1 1168 . 8 1 1 A 93 93 VAL C C 93 175.100 174.941 0.159 1
1 1169 . 8 1 1 A 93 93 VAL CA C 93 61.300 61.872 -0.572 1
1 1170 . 8 1 1 A 93 93 VAL CB C 93 33.900 32.898 1.002 1
1 1173 . 8 1 1 A 93 93 VAL N N 93 121.800 124.449 -2.649 1
1 1174 . 8 1 1 A 94 94 ASN H H 94 8.510 8.478 0.032 1
1 1175 . 8 1 1 A 94 94 ASN HA H 94 4.770 4.991 -0.221 1
1 1180 . 8 1 1 A 94 94 ASN C C 94 175.000 173.869 1.131 1
1 1181 . 8 1 1 A 94 94 ASN CA C 94 52.700 54.265 -1.565 1
1 1182 . 8 1 1 A 94 94 ASN CB C 94 38.500 41.931 -3.431 1
1 1184 . 8 1 1 A 94 94 ASN N N 94 121.800 125.448 -3.648 1
1 1186 . 8 1 1 A 95 95 VAL H H 95 7.860 7.850 0.010 1
1 1187 . 8 1 1 A 95 95 VAL HA H 95 4.100 4.657 -0.557 1
1 1195 . 8 1 1 A 95 95 VAL C C 95 175.100 174.491 0.609 1
1 1196 . 8 1 1 A 95 95 VAL CA C 95 61.700 61.047 0.653 1
1 1197 . 8 1 1 A 95 95 VAL CB C 95 33.100 34.380 -1.280 1
1 1200 . 8 1 1 A 95 95 VAL N N 95 119.700 118.508 1.192 1
1 1201 . 8 1 1 A 96 96 ASN H H 96 8.490 9.065 -0.575 1
1 1202 . 8 1 1 A 96 96 ASN HA H 96 4.700 5.500 -0.800 1
1 1207 . 8 1 1 A 96 96 ASN C C 96 174.600 173.681 0.919 1
1 1208 . 8 1 1 A 96 96 ASN CA C 96 53.000 52.171 0.829 1
1 1209 . 8 1 1 A 96 96 ASN CB C 96 39.000 39.674 -0.674 1
1 1211 . 8 1 1 A 96 96 ASN N N 96 122.200 122.992 -0.792 1
1 1213 . 8 1 1 A 97 97 ILE H H 97 8.080 8.756 -0.676 1
1 1214 . 8 1 1 A 97 97 ILE HA H 97 4.370 4.683 -0.313 1
1 1224 . 8 1 1 A 97 97 ILE CA C 97 58.600 58.717 -0.117 1
1 1225 . 8 1 1 A 97 97 ILE CB C 97 38.600 38.924 -0.324 1
1 1229 . 8 1 1 A 97 97 ILE N N 97 123.500 125.176 -1.676 1
1 1230 . 8 1 1 A 98 98 PRO HA H 98 4.360 4.601 -0.241 1
1 1237 . 8 1 1 A 98 98 PRO C C 98 176.600 176.987 -0.387 1
1 1238 . 8 1 1 A 98 98 PRO CA C 98 63.100 62.707 0.393 1
1 1239 . 8 1 1 A 98 98 PRO CB C 98 31.800 32.868 -1.068 1
1 1242 . 8 1 1 A 99 99 LEU H H 99 8.200 8.544 -0.344 1
1 1243 . 8 1 1 A 99 99 LEU HA H 99 4.200 4.376 -0.176 1
1 1253 . 8 1 1 A 99 99 LEU C C 99 177.300 177.238 0.062 1
1 1254 . 8 1 1 A 99 99 LEU CA C 99 55.000 55.899 -0.899 1
1 1255 . 8 1 1 A 99 99 LEU CB C 99 42.400 42.306 0.094 1
1 1259 . 8 1 1 A 99 99 LEU N N 99 122.500 122.504 -0.004 1
1 1260 . 8 1 1 A 100 100 GLU H H 100 8.250 7.538 0.712 1
1 1261 . 8 1 1 A 100 100 GLU HA H 100 4.140 4.387 -0.247 1
1 1266 . 8 1 1 A 100 100 GLU C C 100 176.100 176.951 -0.851 1
1 1267 . 8 1 1 A 100 100 GLU CA C 100 56.100 57.029 -0.929 1
1 1268 . 8 1 1 A 100 100 GLU CB C 100 29.900 29.971 -0.071 1
1 1270 . 8 1 1 A 100 100 GLU N N 100 121.000 119.589 1.411 1
1 1271 . 8 1 1 A 101 101 HIS H H 101 8.540 8.779 -0.239 1
1 1272 . 8 1 1 A 101 101 HIS HA H 101 4.600 4.642 -0.042 1
1 1275 . 8 1 1 A 101 101 HIS C C 101 174.200 175.371 -1.171 1
1 1276 . 8 1 1 A 101 101 HIS CA C 101 55.200 57.343 -2.143 1
1 1277 . 8 1 1 A 101 101 HIS CB C 101 29.000 30.005 -1.005 1
1 1278 . 8 1 1 A 101 101 HIS N N 101 119.400 121.945 -2.545 1
1 1279 . 8 1 1 A 102 102 HIS H H 102 8.660 7.719 0.941 1
1 1280 . 8 1 1 A 102 102 HIS HA H 102 4.630 4.524 0.106 1
1 1283 . 8 1 1 A 102 102 HIS C C 102 174.200 174.476 -0.276 1
1 1284 . 8 1 1 A 102 102 HIS CA C 102 55.200 56.428 -1.228 1
1 1285 . 8 1 1 A 102 102 HIS CB C 102 29.100 30.512 -1.412 1
1 1286 . 8 1 1 A 102 102 HIS N N 102 119.700 120.562 -0.862 1
1 1287 . 8 1 1 A 103 103 HIS H H 103 8.680 8.446 0.234 1
1 1288 . 8 1 1 A 103 103 HIS HA H 103 4.640 4.537 0.103 1
1 1291 . 8 1 1 A 103 103 HIS C C 103 174.200 174.958 -0.758 1
1 1292 . 8 1 1 A 103 103 HIS CA C 103 55.200 55.653 -0.453 1
1 1293 . 8 1 1 A 103 103 HIS CB C 103 29.200 30.243 -1.043 1
1 1294 . 8 1 1 A 103 103 HIS N N 103 120.500 122.987 -2.487 1
1 1295 . 8 1 1 A 104 104 HIS H H 104 8.580 8.737 -0.157 1
1 1296 . 8 1 1 A 104 104 HIS HA H 104 4.590 4.917 -0.327 1
1 1299 . 8 1 1 A 104 104 HIS C C 104 174.200 174.190 0.010 1
1 1300 . 8 1 1 A 104 104 HIS CA C 104 55.200 54.953 0.247 1
1 1301 . 8 1 1 A 104 104 HIS CB C 104 29.300 30.981 -1.681 1
1 1302 . 8 1 1 A 104 104 HIS N N 104 120.700 119.014 1.686 1
1 1303 . 8 1 1 A 105 105 HIS H H 105 8.550 8.770 -0.220 1
1 1304 . 8 1 1 A 105 105 HIS HA H 105 4.610 4.967 -0.357 1
1 1307 . 8 1 1 A 105 105 HIS C C 105 173.500 174.677 -1.177 1
1 1308 . 8 1 1 A 105 105 HIS CA C 105 55.400 54.040 1.360 1
1 1309 . 8 1 1 A 105 105 HIS CB C 105 28.800 32.915 -4.115 1
1 1310 . 8 1 1 A 105 105 HIS N N 105 119.000 121.426 -2.426 1
1 7 . 9 1 1 A 2 2 ASP H H 2 8.890 8.110 0.780 1
1 8 . 9 1 1 A 2 2 ASP HA H 2 4.740 4.575 0.165 1
1 11 . 9 1 1 A 2 2 ASP C C 2 174.600 175.394 -0.794 1
1 12 . 9 1 1 A 2 2 ASP CA C 2 53.800 54.281 -0.481 1
1 13 . 9 1 1 A 2 2 ASP CB C 2 41.500 41.256 0.244 1
1 14 . 9 1 1 A 2 2 ASP N N 2 122.100 123.796 -1.696 1
1 15 . 9 1 1 A 3 3 LEU H H 3 8.280 8.367 -0.087 1
1 16 . 9 1 1 A 3 3 LEU HA H 3 4.420 4.704 -0.284 1
1 26 . 9 1 1 A 3 3 LEU C C 3 176.900 176.012 0.888 1
1 27 . 9 1 1 A 3 3 LEU CA C 3 55.000 55.653 -0.653 1
1 28 . 9 1 1 A 3 3 LEU CB C 3 42.700 42.511 0.189 1
1 32 . 9 1 1 A 3 3 LEU N N 3 122.300 126.816 -4.516 1
1 33 . 9 1 1 A 4 4 VAL H H 4 8.640 8.664 -0.024 1
1 34 . 9 1 1 A 4 4 VAL HA H 4 4.540 4.981 -0.441 1
1 42 . 9 1 1 A 4 4 VAL C C 4 175.800 175.226 0.574 1
1 43 . 9 1 1 A 4 4 VAL CA C 4 59.400 58.619 0.781 1
1 44 . 9 1 1 A 4 4 VAL CB C 4 35.400 35.766 -0.366 1
1 47 . 9 1 1 A 4 4 VAL N N 4 122.600 119.009 3.591 1
1 48 . 9 1 1 A 5 5 LYS H H 5 8.630 8.663 -0.033 1
1 49 . 9 1 1 A 5 5 LYS HA H 5 4.450 4.437 0.013 1
1 58 . 9 1 1 A 5 5 LYS C C 5 179.400 178.489 0.911 1
1 59 . 9 1 1 A 5 5 LYS CA C 5 53.600 55.777 -2.177 1
1 60 . 9 1 1 A 5 5 LYS CB C 5 30.900 33.323 -2.423 1
1 64 . 9 1 1 A 5 5 LYS N N 5 121.100 121.534 -0.434 1
1 65 . 9 1 1 A 6 6 ILE H H 6 10.320 8.849 1.471 1
1 66 . 9 1 1 A 6 6 ILE HA H 6 3.440 3.706 -0.266 1
1 76 . 9 1 1 A 6 6 ILE C C 6 178.300 177.635 0.665 1
1 77 . 9 1 1 A 6 6 ILE CA C 6 65.700 64.996 0.704 1
1 78 . 9 1 1 A 6 6 ILE CB C 6 35.900 37.882 -1.982 1
1 82 . 9 1 1 A 6 6 ILE N N 6 125.400 122.655 2.745 1
1 83 . 9 1 1 A 7 7 ARG H H 7 8.210 8.027 0.183 1
1 84 . 9 1 1 A 7 7 ARG HA H 7 3.850 4.183 -0.333 1
1 92 . 9 1 1 A 7 7 ARG C C 7 175.600 177.056 -1.456 1
1 93 . 9 1 1 A 7 7 ARG CA C 7 57.800 58.872 -1.072 1
1 94 . 9 1 1 A 7 7 ARG CB C 7 30.300 30.062 0.238 1
1 98 . 9 1 1 A 7 7 ARG N N 7 118.800 120.470 -1.670 1
1 100 . 9 1 1 A 8 8 ASP H H 8 7.850 7.796 0.054 1
1 101 . 9 1 1 A 8 8 ASP HA H 8 4.700 4.683 0.017 1
1 104 . 9 1 1 A 8 8 ASP C C 8 176.100 176.482 -0.382 1
1 105 . 9 1 1 A 8 8 ASP CA C 8 54.100 54.345 -0.245 1
1 106 . 9 1 1 A 8 8 ASP CB C 8 41.200 41.111 0.089 1
1 107 . 9 1 1 A 8 8 ASP N N 8 116.800 119.207 -2.407 1
1 108 . 9 1 1 A 9 9 VAL H H 9 7.240 7.544 -0.304 1
1 109 . 9 1 1 A 9 9 VAL HA H 9 3.710 3.966 -0.256 1
1 117 . 9 1 1 A 9 9 VAL C C 9 174.900 175.904 -1.004 1
1 118 . 9 1 1 A 9 9 VAL CA C 9 64.300 63.348 0.952 1
1 119 . 9 1 1 A 9 9 VAL CB C 9 31.500 31.725 -0.225 1
1 122 . 9 1 1 A 9 9 VAL N N 9 121.800 121.473 0.327 1
1 123 . 9 1 1 A 10 10 SER H H 10 8.600 8.272 0.328 1
1 124 . 9 1 1 A 10 10 SER HA H 10 4.600 4.897 -0.297 1
1 127 . 9 1 1 A 10 10 SER CA C 10 56.700 57.104 -0.404 1
1 128 . 9 1 1 A 10 10 SER CB C 10 66.100 67.308 -1.208 1
1 129 . 9 1 1 A 10 10 SER N N 10 122.200 120.385 1.815 1
1 130 . 9 1 1 A 11 11 LEU H H 11 8.660 8.973 -0.313 1
1 131 . 9 1 1 A 11 11 LEU HA H 11 3.900 3.939 -0.039 1
1 141 . 9 1 1 A 11 11 LEU C C 11 178.100 179.047 -0.947 1
1 142 . 9 1 1 A 11 11 LEU CA C 11 56.700 58.031 -1.331 1
1 143 . 9 1 1 A 11 11 LEU CB C 11 41.400 41.205 0.195 1
1 147 . 9 1 1 A 11 11 LEU N N 11 120.300 125.458 -5.158 1
1 148 . 9 1 1 A 12 12 SER H H 12 8.160 8.168 -0.008 1
1 149 . 9 1 1 A 12 12 SER HA H 12 4.270 4.288 -0.018 1
1 152 . 9 1 1 A 12 12 SER C C 12 174.200 174.962 -0.762 1
1 153 . 9 1 1 A 12 12 SER CA C 12 59.900 60.667 -0.767 1
1 154 . 9 1 1 A 12 12 SER CB C 12 63.100 62.830 0.270 1
1 155 . 9 1 1 A 12 12 SER N N 12 112.100 113.677 -1.577 1
1 156 . 9 1 1 A 13 13 THR H H 13 7.460 7.596 -0.136 1
1 157 . 9 1 1 A 13 13 THR HA H 13 4.760 4.669 0.091 1
1 162 . 9 1 1 A 13 13 THR CA C 13 56.600 58.991 -2.391 1
1 163 . 9 1 1 A 13 13 THR CB C 13 70.100 68.899 1.201 1
1 165 . 9 1 1 A 13 13 THR N N 13 114.700 109.529 5.171 1
1 166 . 9 1 1 A 14 14 PRO HA H 14 4.050 4.390 -0.340 1
1 173 . 9 1 1 A 14 14 PRO C C 14 175.800 175.838 -0.038 1
1 174 . 9 1 1 A 14 14 PRO CA C 14 65.100 64.411 0.689 1
1 175 . 9 1 1 A 14 14 PRO CB C 14 32.100 31.757 0.343 1
1 178 . 9 1 1 A 15 15 TYR H H 15 7.380 7.505 -0.125 1
1 179 . 9 1 1 A 15 15 TYR HA H 15 5.570 5.582 -0.012 1
1 186 . 9 1 1 A 15 15 TYR C C 15 176.100 175.048 1.052 1
1 187 . 9 1 1 A 15 15 TYR CA C 15 56.400 56.821 -0.421 1
1 188 . 9 1 1 A 15 15 TYR CB C 15 41.500 40.528 0.972 1
1 193 . 9 1 1 A 15 15 TYR N N 15 113.800 117.720 -3.920 1
1 194 . 9 1 1 A 16 16 VAL H H 16 9.010 8.649 0.361 1
1 195 . 9 1 1 A 16 16 VAL HA H 16 4.920 5.086 -0.166 1
1 203 . 9 1 1 A 16 16 VAL C C 16 174.300 173.410 0.890 1
1 204 . 9 1 1 A 16 16 VAL CA C 16 59.600 59.475 0.125 1
1 205 . 9 1 1 A 16 16 VAL CB C 16 36.800 36.351 0.449 1
1 208 . 9 1 1 A 16 16 VAL N N 16 113.800 118.283 -4.483 1
1 209 . 9 1 1 A 17 17 SER H H 17 7.960 8.895 -0.935 1
1 210 . 9 1 1 A 17 17 SER HA H 17 5.860 5.524 0.336 1
1 213 . 9 1 1 A 17 17 SER C C 17 172.700 173.646 -0.946 1
1 214 . 9 1 1 A 17 17 SER CA C 17 57.300 56.444 0.856 1
1 215 . 9 1 1 A 17 17 SER CB C 17 64.000 65.451 -1.451 1
1 216 . 9 1 1 A 17 17 SER N N 17 117.100 117.336 -0.236 1
1 217 . 9 1 1 A 18 18 VAL H H 18 8.570 8.595 -0.025 1
1 218 . 9 1 1 A 18 18 VAL HA H 18 4.900 5.028 -0.128 1
1 226 . 9 1 1 A 18 18 VAL C C 18 173.700 174.517 -0.817 1
1 227 . 9 1 1 A 18 18 VAL CA C 18 58.800 60.175 -1.375 1
1 228 . 9 1 1 A 18 18 VAL CB C 18 36.700 35.869 0.831 1
1 231 . 9 1 1 A 18 18 VAL N N 18 113.500 123.883 -10.383 1
1 232 . 9 1 1 A 19 19 ILE H H 19 8.490 8.601 -0.111 1
1 233 . 9 1 1 A 19 19 ILE HA H 19 5.300 4.931 0.369 1
1 243 . 9 1 1 A 19 19 ILE C C 19 175.800 174.896 0.904 1
1 244 . 9 1 1 A 19 19 ILE CA C 19 59.700 59.506 0.194 1
1 245 . 9 1 1 A 19 19 ILE CB C 19 41.700 42.343 -0.643 1
1 249 . 9 1 1 A 19 19 ILE N N 19 120.600 124.667 -4.067 1
1 250 . 9 1 1 A 20 20 GLY H H 20 8.670 7.958 0.712 1
1 251 . 9 1 1 A 20 20 GLY HA2 H 20 3.760 4.191 -0.431 1
1 252 . 9 1 1 A 20 20 GLY HA3 H 20 4.190 4.194 -0.004 1
1 253 . 9 1 1 A 20 20 GLY C C 20 169.900 172.287 -2.387 1
1 254 . 9 1 1 A 20 20 GLY CA C 20 46.000 45.978 0.022 1
1 255 . 9 1 1 A 20 20 GLY N N 20 110.200 113.816 -3.616 1
1 256 . 9 1 1 A 21 21 LYS H H 21 8.920 8.382 0.538 1
1 257 . 9 1 1 A 21 21 LYS HA H 21 5.210 5.239 -0.029 1
1 266 . 9 1 1 A 21 21 LYS C C 21 176.400 175.105 1.295 1
1 267 . 9 1 1 A 21 21 LYS CA C 21 54.400 54.773 -0.373 1
1 268 . 9 1 1 A 21 21 LYS CB C 21 35.400 35.385 0.015 1
1 272 . 9 1 1 A 21 21 LYS N N 21 119.100 117.325 1.775 1
1 273 . 9 1 1 A 22 22 ILE H H 22 8.900 8.602 0.298 1
1 274 . 9 1 1 A 22 22 ILE HA H 22 5.050 5.200 -0.150 1
1 284 . 9 1 1 A 22 22 ILE C C 22 176.900 175.265 1.635 1
1 285 . 9 1 1 A 22 22 ILE CA C 22 57.800 60.291 -2.491 1
1 286 . 9 1 1 A 22 22 ILE CB C 22 36.200 39.274 -3.074 1
1 290 . 9 1 1 A 22 22 ILE N N 22 130.000 124.983 5.017 1
1 291 . 9 1 1 A 23 23 THR H H 23 9.020 8.721 0.299 1
1 292 . 9 1 1 A 23 23 THR HA H 23 4.660 4.945 -0.285 1
1 297 . 9 1 1 A 23 23 THR C C 23 174.000 174.018 -0.018 1
1 298 . 9 1 1 A 23 23 THR CA C 23 60.800 59.852 0.948 1
1 299 . 9 1 1 A 23 23 THR CB C 23 73.400 71.859 1.541 1
1 301 . 9 1 1 A 23 23 THR N N 23 118.200 117.671 0.529 1
1 302 . 9 1 1 A 24 24 GLY H H 24 8.430 8.609 -0.179 1
1 303 . 9 1 1 A 24 24 GLY HA2 H 24 3.910 3.796 0.114 1
1 304 . 9 1 1 A 24 24 GLY HA3 H 24 3.910 3.932 -0.022 1
1 305 . 9 1 1 A 24 24 GLY C C 24 175.400 174.559 0.841 1
1 306 . 9 1 1 A 24 24 GLY CA C 24 47.100 46.951 0.149 1
1 307 . 9 1 1 A 24 24 GLY N N 24 107.200 111.937 -4.737 1
1 308 . 9 1 1 A 25 25 ILE H H 25 9.370 7.959 1.411 1
1 309 . 9 1 1 A 25 25 ILE HA H 25 4.480 4.276 0.204 1
1 319 . 9 1 1 A 25 25 ILE C C 25 178.200 175.396 2.804 1
1 320 . 9 1 1 A 25 25 ILE CA C 25 59.200 60.944 -1.744 1
1 321 . 9 1 1 A 25 25 ILE CB C 25 35.400 38.567 -3.167 1
1 325 . 9 1 1 A 25 25 ILE N N 25 120.600 120.445 0.155 1
1 326 . 9 1 1 A 26 26 HIS H H 26 9.000 9.361 -0.361 1
1 327 . 9 1 1 A 26 26 HIS HA H 26 4.770 5.385 -0.615 1
1 330 . 9 1 1 A 26 26 HIS C C 26 172.700 173.919 -1.219 1
1 331 . 9 1 1 A 26 26 HIS CA C 26 55.000 54.435 0.565 1
1 332 . 9 1 1 A 26 26 HIS CB C 26 31.100 32.978 -1.878 1
1 333 . 9 1 1 A 26 26 HIS N N 26 123.800 126.065 -2.265 1
1 334 . 9 1 1 A 27 27 LYS H H 27 8.930 8.942 -0.012 1
1 335 . 9 1 1 A 27 27 LYS HA H 27 4.770 4.653 0.117 1
1 344 . 9 1 1 A 27 27 LYS C C 27 175.300 175.227 0.073 1
1 345 . 9 1 1 A 27 27 LYS CA C 27 55.100 55.041 0.059 1
1 346 . 9 1 1 A 27 27 LYS CB C 27 34.400 34.315 0.085 1
1 350 . 9 1 1 A 27 27 LYS N N 27 125.900 124.206 1.694 1
1 351 . 9 1 1 A 28 28 LYS H H 28 8.880 8.533 0.347 1
1 352 . 9 1 1 A 28 28 LYS HA H 28 4.570 4.982 -0.412 1
1 361 . 9 1 1 A 28 28 LYS C C 28 174.500 175.098 -0.598 1
1 362 . 9 1 1 A 28 28 LYS CA C 28 54.600 54.626 -0.026 1
1 363 . 9 1 1 A 28 28 LYS CB C 28 35.300 37.061 -1.761 1
1 367 . 9 1 1 A 28 28 LYS N N 28 127.400 124.971 2.429 1
1 368 . 9 1 1 A 29 29 GLU H H 29 8.440 8.498 -0.058 1
1 369 . 9 1 1 A 29 29 GLU HA H 29 5.260 5.198 0.062 1
1 374 . 9 1 1 A 29 29 GLU C C 29 175.800 175.284 0.516 1
1 375 . 9 1 1 A 29 29 GLU CA C 29 54.800 54.911 -0.111 1
1 376 . 9 1 1 A 29 29 GLU CB C 29 31.500 33.053 -1.553 1
1 378 . 9 1 1 A 29 29 GLU N N 29 122.200 120.748 1.452 1
1 379 . 9 1 1 A 30 30 TYR H H 30 8.960 8.788 0.172 1
1 380 . 9 1 1 A 30 30 TYR HA H 30 4.820 5.618 -0.798 1
1 387 . 9 1 1 A 30 30 TYR C C 30 172.600 173.121 -0.521 1
1 388 . 9 1 1 A 30 30 TYR CA C 30 56.300 55.189 1.111 1
1 389 . 9 1 1 A 30 30 TYR CB C 30 40.500 41.992 -1.492 1
1 394 . 9 1 1 A 30 30 TYR N N 30 121.100 119.218 1.882 1
1 395 . 9 1 1 A 31 31 GLU H H 31 8.610 8.837 -0.227 1
1 396 . 9 1 1 A 31 31 GLU HA H 31 4.810 4.582 0.228 1
1 401 . 9 1 1 A 31 31 GLU C C 31 176.100 175.309 0.791 1
1 402 . 9 1 1 A 31 31 GLU CA C 31 55.100 56.334 -1.234 1
1 403 . 9 1 1 A 31 31 GLU CB C 31 30.300 30.999 -0.699 1
1 405 . 9 1 1 A 31 31 GLU N N 31 121.800 120.766 1.034 1
1 406 . 9 1 1 A 32 32 SER H H 32 8.570 9.167 -0.597 1
1 407 . 9 1 1 A 32 32 SER HA H 32 4.520 4.886 -0.366 1
1 410 . 9 1 1 A 32 32 SER C C 32 174.300 173.631 0.669 1
1 411 . 9 1 1 A 32 32 SER CA C 32 57.300 57.136 0.164 1
1 412 . 9 1 1 A 32 32 SER CB C 32 64.100 65.501 -1.401 1
1 413 . 9 1 1 A 32 32 SER N N 32 118.500 117.517 0.983 1
1 414 . 9 1 1 A 33 33 ASP H H 33 9.290 9.342 -0.052 1
1 415 . 9 1 1 A 33 33 ASP HA H 33 4.340 4.278 0.062 1
1 418 . 9 1 1 A 33 33 ASP C C 33 175.900 175.348 0.552 1
1 419 . 9 1 1 A 33 33 ASP CA C 33 55.000 55.013 -0.013 1
1 420 . 9 1 1 A 33 33 ASP CB C 33 39.300 39.700 -0.400 1
1 421 . 9 1 1 A 33 33 ASP N N 33 125.700 128.816 -3.116 1
1 422 . 9 1 1 A 34 34 GLY H H 34 8.690 8.604 0.086 1
1 423 . 9 1 1 A 34 34 GLY HA2 H 34 3.660 3.798 -0.138 1
1 424 . 9 1 1 A 34 34 GLY HA3 H 34 4.140 3.802 0.338 1
1 425 . 9 1 1 A 34 34 GLY C C 34 174.200 173.766 0.434 1
1 426 . 9 1 1 A 34 34 GLY CA C 34 45.600 45.557 0.043 1
1 427 . 9 1 1 A 34 34 GLY N N 34 104.800 104.259 0.541 1
1 428 . 9 1 1 A 35 35 THR H H 35 7.840 7.734 0.106 1
1 429 . 9 1 1 A 35 35 THR HA H 35 4.660 4.547 0.113 1
1 434 . 9 1 1 A 35 35 THR C C 35 173.000 173.402 -0.402 1
1 435 . 9 1 1 A 35 35 THR CA C 35 60.200 61.348 -1.148 1
1 436 . 9 1 1 A 35 35 THR CB C 35 71.200 71.163 0.037 1
1 438 . 9 1 1 A 35 35 THR N N 35 114.800 115.916 -1.116 1
1 439 . 9 1 1 A 36 36 THR H H 36 8.480 8.631 -0.151 1
1 440 . 9 1 1 A 36 36 THR HA H 36 4.620 4.398 0.222 1
1 445 . 9 1 1 A 36 36 THR C C 36 173.800 174.285 -0.485 1
1 446 . 9 1 1 A 36 36 THR CA C 36 62.300 62.502 -0.202 1
1 447 . 9 1 1 A 36 36 THR CB C 36 69.500 69.507 -0.007 1
1 449 . 9 1 1 A 36 36 THR N N 36 119.400 122.248 -2.848 1
1 450 . 9 1 1 A 37 37 LYS H H 37 8.880 8.459 0.421 1
1 451 . 9 1 1 A 37 37 LYS HA H 37 4.570 4.838 -0.268 1
1 460 . 9 1 1 A 37 37 LYS C C 37 174.500 175.160 -0.660 1
1 461 . 9 1 1 A 37 37 LYS CA C 37 54.600 54.064 0.536 1
1 462 . 9 1 1 A 37 37 LYS CB C 37 35.500 35.820 -0.320 1
1 466 . 9 1 1 A 37 37 LYS N N 37 128.000 125.745 2.255 1
1 467 . 9 1 1 A 38 38 SER H H 38 8.370 8.863 -0.493 1
1 468 . 9 1 1 A 38 38 SER HA H 38 5.250 4.783 0.467 1
1 471 . 9 1 1 A 38 38 SER C C 38 173.200 173.757 -0.557 1
1 472 . 9 1 1 A 38 38 SER CA C 38 57.900 58.315 -0.415 1
1 473 . 9 1 1 A 38 38 SER CB C 38 65.500 63.791 1.709 1
1 474 . 9 1 1 A 38 38 SER N N 38 114.300 119.989 -5.689 1
1 475 . 9 1 1 A 39 39 VAL H H 39 9.020 8.781 0.239 1
1 476 . 9 1 1 A 39 39 VAL HA H 39 4.900 5.027 -0.127 1
1 484 . 9 1 1 A 39 39 VAL C C 39 173.200 173.035 0.165 1
1 485 . 9 1 1 A 39 39 VAL CA C 39 59.200 59.692 -0.492 1
1 486 . 9 1 1 A 39 39 VAL CB C 39 34.600 35.279 -0.679 1
1 489 . 9 1 1 A 39 39 VAL N N 39 123.600 124.333 -0.733 1
1 490 . 9 1 1 A 40 40 TYR H H 40 8.900 8.646 0.254 1
1 491 . 9 1 1 A 40 40 TYR HA H 40 4.730 5.211 -0.481 1
1 498 . 9 1 1 A 40 40 TYR CA C 40 56.500 57.002 -0.502 1
1 499 . 9 1 1 A 40 40 TYR CB C 40 39.000 40.727 -1.727 1
1 504 . 9 1 1 A 40 40 TYR N N 40 126.300 127.645 -1.345 1
1 505 . 9 1 1 A 41 41 GLN H H 41 8.630 8.543 0.087 1
1 506 . 9 1 1 A 41 41 GLN HA H 41 5.330 5.188 0.142 1
1 513 . 9 1 1 A 41 41 GLN C C 41 175.500 175.456 0.044 1
1 514 . 9 1 1 A 41 41 GLN CA C 41 53.800 54.309 -0.509 1
1 515 . 9 1 1 A 41 41 GLN CB C 41 32.100 32.840 -0.740 1
1 518 . 9 1 1 A 41 41 GLN N N 41 122.000 121.424 0.576 1
1 520 . 9 1 1 A 42 42 GLY H H 42 8.560 7.914 0.646 1
1 521 . 9 1 1 A 42 42 GLY HA2 H 42 3.680 4.313 -0.633 1
1 522 . 9 1 1 A 42 42 GLY HA3 H 42 4.020 4.371 -0.351 1
1 523 . 9 1 1 A 42 42 GLY C C 42 171.600 170.989 0.611 1
1 524 . 9 1 1 A 42 42 GLY CA C 42 47.300 46.125 1.175 1
1 525 . 9 1 1 A 42 42 GLY N N 42 113.000 108.685 4.315 1
1 526 . 9 1 1 A 43 43 TYR H H 43 9.320 8.458 0.862 1
1 527 . 9 1 1 A 43 43 TYR HA H 43 5.280 5.471 -0.191 1
1 534 . 9 1 1 A 43 43 TYR C C 43 173.200 174.100 -0.900 1
1 535 . 9 1 1 A 43 43 TYR CA C 43 57.600 56.480 1.120 1
1 536 . 9 1 1 A 43 43 TYR CB C 43 42.400 43.014 -0.614 1
1 541 . 9 1 1 A 43 43 TYR N N 43 126.300 118.941 7.359 1
1 542 . 9 1 1 A 44 44 ILE H H 44 9.160 8.966 0.194 1
1 543 . 9 1 1 A 44 44 ILE HA H 44 5.270 5.420 -0.150 1
1 553 . 9 1 1 A 44 44 ILE C C 44 172.900 173.594 -0.694 1
1 554 . 9 1 1 A 44 44 ILE CA C 44 59.000 59.353 -0.353 1
1 555 . 9 1 1 A 44 44 ILE CB C 44 42.200 41.599 0.601 1
1 559 . 9 1 1 A 44 44 ILE N N 44 117.700 122.980 -5.280 1
1 560 . 9 1 1 A 45 45 GLU H H 45 8.420 8.807 -0.387 1
1 561 . 9 1 1 A 45 45 GLU HA H 45 5.600 5.137 0.463 1
1 566 . 9 1 1 A 45 45 GLU C C 45 174.300 175.064 -0.764 1
1 567 . 9 1 1 A 45 45 GLU CA C 45 54.000 54.611 -0.611 1
1 568 . 9 1 1 A 45 45 GLU CB C 45 34.400 33.228 1.172 1
1 570 . 9 1 1 A 45 45 GLU N N 45 123.600 127.917 -4.317 1
1 571 . 9 1 1 A 46 46 ASP H H 46 8.530 8.687 -0.157 1
1 572 . 9 1 1 A 46 46 ASP HA H 46 5.070 5.054 0.016 1
1 575 . 9 1 1 A 46 46 ASP C C 46 175.000 175.631 -0.631 1
1 576 . 9 1 1 A 46 46 ASP CA C 46 51.800 52.185 -0.385 1
1 577 . 9 1 1 A 46 46 ASP CB C 46 41.300 44.083 -2.783 1
1 578 . 9 1 1 A 46 46 ASP N N 46 125.500 122.457 3.043 1
1 579 . 9 1 1 A 47 47 ASP H H 47 9.160 8.826 0.334 1
1 580 . 9 1 1 A 47 47 ASP HA H 47 4.430 4.442 -0.012 1
1 583 . 9 1 1 A 47 47 ASP C C 47 176.000 177.080 -1.080 1
1 584 . 9 1 1 A 47 47 ASP CA C 47 55.000 56.286 -1.286 1
1 585 . 9 1 1 A 47 47 ASP CB C 47 38.900 40.648 -1.748 1
1 586 . 9 1 1 A 47 47 ASP N N 47 114.200 119.760 -5.560 1
1 587 . 9 1 1 A 48 48 THR H H 48 9.470 7.689 1.781 1
1 588 . 9 1 1 A 48 48 THR HA H 48 4.520 4.241 0.279 1
1 593 . 9 1 1 A 48 48 THR C C 48 174.500 174.737 -0.237 1
1 594 . 9 1 1 A 48 48 THR CA C 48 62.600 64.735 -2.135 1
1 595 . 9 1 1 A 48 48 THR CB C 48 70.400 69.356 1.044 1
1 597 . 9 1 1 A 48 48 THR N N 48 111.800 112.526 -0.726 1
1 598 . 9 1 1 A 49 49 ALA H H 49 7.850 7.651 0.199 1
1 599 . 9 1 1 A 49 49 ALA HA H 49 4.440 4.444 -0.004 1
1 603 . 9 1 1 A 49 49 ALA C C 49 173.200 175.367 -2.167 1
1 604 . 9 1 1 A 49 49 ALA CA C 49 52.700 50.997 1.703 1
1 605 . 9 1 1 A 49 49 ALA CB C 49 21.300 20.560 0.740 1
1 606 . 9 1 1 A 49 49 ALA N N 49 123.400 118.543 4.857 1
1 607 . 9 1 1 A 50 50 ARG H H 50 8.160 8.940 -0.780 1
1 608 . 9 1 1 A 50 50 ARG HA H 50 5.350 5.595 -0.245 1
1 616 . 9 1 1 A 50 50 ARG C C 50 174.700 174.223 0.477 1
1 617 . 9 1 1 A 50 50 ARG CA C 50 54.000 54.426 -0.426 1
1 618 . 9 1 1 A 50 50 ARG CB C 50 34.500 34.475 0.025 1
1 622 . 9 1 1 A 50 50 ARG N N 50 117.400 114.940 2.460 1
1 624 . 9 1 1 A 51 51 ILE H H 51 9.390 8.677 0.713 1
1 625 . 9 1 1 A 51 51 ILE HA H 51 4.790 4.987 -0.197 1
1 635 . 9 1 1 A 51 51 ILE C C 51 172.600 173.122 -0.522 1
1 636 . 9 1 1 A 51 51 ILE CA C 51 60.000 59.120 0.880 1
1 637 . 9 1 1 A 51 51 ILE CB C 51 42.800 41.947 0.853 1
1 641 . 9 1 1 A 51 51 ILE N N 51 124.600 120.842 3.758 1
1 642 . 9 1 1 A 52 52 ARG H H 52 7.980 8.605 -0.625 1
1 643 . 9 1 1 A 52 52 ARG HA H 52 4.170 4.420 -0.250 1
1 651 . 9 1 1 A 52 52 ARG C C 52 174.600 175.930 -1.330 1
1 652 . 9 1 1 A 52 52 ARG CA C 52 57.100 56.013 1.087 1
1 653 . 9 1 1 A 52 52 ARG CB C 52 31.300 31.168 0.132 1
1 657 . 9 1 1 A 52 52 ARG N N 52 125.900 128.082 -2.182 1
1 659 . 9 1 1 A 53 53 ILE H H 53 8.290 8.443 -0.153 1
1 660 . 9 1 1 A 53 53 ILE HA H 53 5.160 5.214 -0.054 1
1 670 . 9 1 1 A 53 53 ILE C C 53 172.400 174.236 -1.836 1
1 671 . 9 1 1 A 53 53 ILE CA C 53 58.600 58.983 -0.383 1
1 672 . 9 1 1 A 53 53 ILE CB C 53 41.900 42.519 -0.619 1
1 676 . 9 1 1 A 53 53 ILE N N 53 118.500 120.626 -2.126 1
1 677 . 9 1 1 A 54 54 SER H H 54 8.350 8.900 -0.550 1
1 678 . 9 1 1 A 54 54 SER HA H 54 5.070 5.415 -0.345 1
1 681 . 9 1 1 A 54 54 SER C C 54 172.400 172.609 -0.209 1
1 682 . 9 1 1 A 54 54 SER CA C 54 57.000 56.863 0.137 1
1 683 . 9 1 1 A 54 54 SER CB C 54 65.900 66.420 -0.520 1
1 684 . 9 1 1 A 54 54 SER N N 54 120.700 116.575 4.125 1
1 685 . 9 1 1 A 55 55 SER H H 55 9.130 8.679 0.451 1
1 686 . 9 1 1 A 55 55 SER HA H 55 5.270 5.046 0.224 1
1 690 . 9 1 1 A 55 55 SER C C 55 174.400 172.693 1.707 1
1 691 . 9 1 1 A 55 55 SER CA C 55 55.500 56.431 -0.931 1
1 692 . 9 1 1 A 55 55 SER CB C 55 64.500 65.107 -0.607 1
1 693 . 9 1 1 A 55 55 SER N N 55 117.200 116.036 1.164 1
1 694 . 9 1 1 A 56 56 PHE H H 56 8.970 8.465 0.505 1
1 695 . 9 1 1 A 56 56 PHE HA H 56 4.600 4.919 -0.319 1
1 703 . 9 1 1 A 56 56 PHE C C 56 176.500 177.097 -0.597 1
1 704 . 9 1 1 A 56 56 PHE CA C 56 58.300 57.368 0.932 1
1 705 . 9 1 1 A 56 56 PHE CB C 56 37.900 40.727 -2.827 1
1 711 . 9 1 1 A 56 56 PHE N N 56 129.400 125.028 4.372 1
1 712 . 9 1 1 A 57 57 GLY H H 57 8.570 8.817 -0.247 1
1 713 . 9 1 1 A 57 57 GLY HA2 H 57 4.020 4.164 -0.144 1
1 714 . 9 1 1 A 57 57 GLY HA3 H 57 4.380 4.194 0.186 1
1 715 . 9 1 1 A 57 57 GLY C C 57 173.700 174.354 -0.654 1
1 716 . 9 1 1 A 57 57 GLY CA C 57 46.300 45.915 0.385 1
1 717 . 9 1 1 A 57 57 GLY N N 57 112.500 112.265 0.235 1
1 718 . 9 1 1 A 58 58 LYS H H 58 6.800 8.410 -1.610 1
1 719 . 9 1 1 A 58 58 LYS HA H 58 4.410 4.314 0.096 1
1 728 . 9 1 1 A 58 58 LYS C C 58 174.800 175.926 -1.126 1
1 729 . 9 1 1 A 58 58 LYS CA C 58 55.200 56.662 -1.462 1
1 730 . 9 1 1 A 58 58 LYS CB C 58 33.300 33.306 -0.006 1
1 734 . 9 1 1 A 58 58 LYS N N 58 118.700 121.346 -2.646 1
1 735 . 9 1 1 A 59 59 GLN H H 59 8.390 8.650 -0.260 1
1 736 . 9 1 1 A 59 59 GLN HA H 59 1.830 3.536 -1.706 1
1 743 . 9 1 1 A 59 59 GLN C C 59 174.100 174.744 -0.644 1
1 744 . 9 1 1 A 59 59 GLN CA C 59 57.100 55.046 2.054 1
1 745 . 9 1 1 A 59 59 GLN CB C 59 28.900 29.394 -0.494 1
1 748 . 9 1 1 A 59 59 GLN N N 59 124.000 123.946 0.054 1
1 750 . 9 1 1 A 60 60 LEU H H 60 5.320 7.959 -2.639 1
1 751 . 9 1 1 A 60 60 LEU HA H 60 4.370 5.032 -0.662 1
1 761 . 9 1 1 A 60 60 LEU CA C 60 52.800 53.303 -0.503 1
1 762 . 9 1 1 A 60 60 LEU CB C 60 46.700 45.187 1.513 1
1 766 . 9 1 1 A 60 60 LEU N N 60 121.800 123.428 -1.628 1
1 767 . 9 1 1 A 61 61 GLN H H 61 8.660 8.387 0.273 1
1 768 . 9 1 1 A 61 61 GLN HA H 61 4.440 4.792 -0.352 1
1 775 . 9 1 1 A 61 61 GLN C C 61 174.000 175.339 -1.339 1
1 776 . 9 1 1 A 61 61 GLN CA C 61 53.800 54.300 -0.500 1
1 777 . 9 1 1 A 61 61 GLN CB C 61 31.800 32.208 -0.408 1
1 780 . 9 1 1 A 61 61 GLN N N 61 120.300 120.307 -0.007 1
1 782 . 9 1 1 A 62 62 ASP H H 62 8.450 8.742 -0.292 1
1 783 . 9 1 1 A 62 62 ASP HA H 62 4.130 4.722 -0.592 1
1 786 . 9 1 1 A 62 62 ASP C C 62 177.200 176.114 1.086 1
1 787 . 9 1 1 A 62 62 ASP CA C 62 55.700 54.576 1.124 1
1 788 . 9 1 1 A 62 62 ASP CB C 62 39.400 40.742 -1.342 1
1 789 . 9 1 1 A 62 62 ASP N N 62 122.400 124.260 -1.860 1
1 790 . 9 1 1 A 63 63 SER H H 63 9.210 9.315 -0.105 1
1 791 . 9 1 1 A 63 63 SER HA H 63 3.850 4.073 -0.223 1
1 794 . 9 1 1 A 63 63 SER C C 63 173.200 172.874 0.326 1
1 795 . 9 1 1 A 63 63 SER CA C 63 61.700 60.395 1.305 1
1 796 . 9 1 1 A 63 63 SER CB C 63 61.800 61.496 0.304 1
1 797 . 9 1 1 A 63 63 SER N N 63 114.300 112.806 1.494 1
1 798 . 9 1 1 A 64 64 ASP H H 64 7.960 7.769 0.191 1
1 799 . 9 1 1 A 64 64 ASP HA H 64 4.540 4.713 -0.173 1
1 802 . 9 1 1 A 64 64 ASP C C 64 174.900 175.668 -0.768 1
1 803 . 9 1 1 A 64 64 ASP CA C 64 54.900 53.866 1.034 1
1 804 . 9 1 1 A 64 64 ASP CB C 64 40.900 41.620 -0.720 1
1 805 . 9 1 1 A 64 64 ASP N N 64 122.600 120.507 2.093 1
1 806 . 9 1 1 A 65 65 VAL H H 65 8.180 8.815 -0.635 1
1 807 . 9 1 1 A 65 65 VAL HA H 65 4.670 4.656 0.014 1
1 815 . 9 1 1 A 65 65 VAL C C 65 175.900 175.408 0.492 1
1 816 . 9 1 1 A 65 65 VAL CA C 65 62.300 61.968 0.332 1
1 817 . 9 1 1 A 65 65 VAL CB C 65 31.700 31.753 -0.053 1
1 820 . 9 1 1 A 65 65 VAL N N 65 123.100 124.615 -1.515 1
1 821 . 9 1 1 A 66 66 VAL H H 66 8.770 8.728 0.042 1
1 822 . 9 1 1 A 66 66 VAL HA H 66 5.160 5.143 0.017 1
1 830 . 9 1 1 A 66 66 VAL C C 66 173.600 173.278 0.322 1
1 831 . 9 1 1 A 66 66 VAL CA C 66 58.100 58.782 -0.682 1
1 832 . 9 1 1 A 66 66 VAL CB C 66 35.700 36.101 -0.401 1
1 835 . 9 1 1 A 66 66 VAL N N 66 118.100 120.252 -2.152 1
1 836 . 9 1 1 A 67 67 ARG H H 67 8.880 9.130 -0.250 1
1 837 . 9 1 1 A 67 67 ARG HA H 67 5.110 5.234 -0.124 1
1 845 . 9 1 1 A 67 67 ARG C C 67 175.300 174.526 0.774 1
1 846 . 9 1 1 A 67 67 ARG CA C 67 54.200 54.400 -0.200 1
1 847 . 9 1 1 A 67 67 ARG CB C 67 32.200 33.616 -1.416 1
1 851 . 9 1 1 A 67 67 ARG N N 67 120.200 121.646 -1.446 1
1 853 . 9 1 1 A 68 68 ILE H H 68 9.220 9.045 0.175 1
1 854 . 9 1 1 A 68 68 ILE HA H 68 4.990 4.607 0.383 1
1 864 . 9 1 1 A 68 68 ILE C C 68 174.900 174.741 0.159 1
1 865 . 9 1 1 A 68 68 ILE CA C 68 58.600 59.481 -0.881 1
1 866 . 9 1 1 A 68 68 ILE CB C 68 39.300 38.801 0.499 1
1 870 . 9 1 1 A 68 68 ILE N N 68 127.200 128.013 -0.813 1
1 871 . 9 1 1 A 69 69 ASP H H 69 9.110 9.129 -0.019 1
1 872 . 9 1 1 A 69 69 ASP HA H 69 5.370 5.046 0.324 1
1 875 . 9 1 1 A 69 69 ASP C C 69 175.800 176.446 -0.646 1
1 876 . 9 1 1 A 69 69 ASP CA C 69 52.400 52.593 -0.193 1
1 877 . 9 1 1 A 69 69 ASP CB C 69 43.700 42.959 0.741 1
1 878 . 9 1 1 A 69 69 ASP N N 69 123.400 125.519 -2.119 1
1 879 . 9 1 1 A 70 70 ASN H H 70 8.300 9.100 -0.800 1
1 880 . 9 1 1 A 70 70 ASN HA H 70 4.160 4.422 -0.262 1
1 885 . 9 1 1 A 70 70 ASN C C 70 176.300 174.659 1.641 1
1 886 . 9 1 1 A 70 70 ASN CA C 70 54.300 54.175 0.125 1
1 887 . 9 1 1 A 70 70 ASN CB C 70 37.500 37.610 -0.110 1
1 889 . 9 1 1 A 70 70 ASN N N 70 119.800 121.120 -1.320 1
1 891 . 9 1 1 A 71 71 ALA H H 71 9.100 7.728 1.372 1
1 892 . 9 1 1 A 71 71 ALA HA H 71 4.500 4.457 0.043 1
1 896 . 9 1 1 A 71 71 ALA C C 71 175.700 176.642 -0.942 1
1 897 . 9 1 1 A 71 71 ALA CA C 71 51.900 53.013 -1.113 1
1 898 . 9 1 1 A 71 71 ALA CB C 71 19.600 19.886 -0.286 1
1 899 . 9 1 1 A 71 71 ALA N N 71 123.000 121.096 1.904 1
1 900 . 9 1 1 A 72 72 ARG H H 72 8.490 8.402 0.088 1
1 901 . 9 1 1 A 72 72 ARG HA H 72 4.720 4.791 -0.071 1
1 909 . 9 1 1 A 72 72 ARG C C 72 175.800 174.938 0.862 1
1 910 . 9 1 1 A 72 72 ARG CA C 72 54.400 54.805 -0.405 1
1 911 . 9 1 1 A 72 72 ARG CB C 72 32.700 31.675 1.025 1
1 915 . 9 1 1 A 72 72 ARG N N 72 122.500 122.904 -0.404 1
1 917 . 9 1 1 A 73 73 VAL H H 73 8.310 8.088 0.222 1
1 918 . 9 1 1 A 73 73 VAL HA H 73 4.250 4.550 -0.300 1
1 926 . 9 1 1 A 73 73 VAL C C 73 174.600 175.721 -1.121 1
1 927 . 9 1 1 A 73 73 VAL CA C 73 62.800 62.104 0.696 1
1 928 . 9 1 1 A 73 73 VAL CB C 73 32.100 32.015 0.085 1
1 931 . 9 1 1 A 73 73 VAL N N 73 127.100 127.327 -0.227 1
1 932 . 9 1 1 A 74 74 ALA H H 74 8.880 8.885 -0.005 1
1 933 . 9 1 1 A 74 74 ALA HA H 74 4.500 5.004 -0.504 1
1 937 . 9 1 1 A 74 74 ALA C C 74 174.800 174.646 0.154 1
1 938 . 9 1 1 A 74 74 ALA CA C 74 50.500 50.642 -0.142 1
1 939 . 9 1 1 A 74 74 ALA CB C 74 22.500 23.776 -1.276 1
1 940 . 9 1 1 A 74 74 ALA N N 74 131.000 128.575 2.425 1
1 941 . 9 1 1 A 75 75 GLN H H 75 8.280 8.405 -0.125 1
1 942 . 9 1 1 A 75 75 GLN HA H 75 4.910 5.050 -0.140 1
1 949 . 9 1 1 A 75 75 GLN C C 75 175.100 174.164 0.936 1
1 950 . 9 1 1 A 75 75 GLN CA C 75 54.600 54.021 0.579 1
1 951 . 9 1 1 A 75 75 GLN CB C 75 31.400 31.660 -0.260 1
1 954 . 9 1 1 A 75 75 GLN N N 75 118.800 120.637 -1.837 1
1 956 . 9 1 1 A 76 76 PHE H H 76 8.710 9.384 -0.674 1
1 957 . 9 1 1 A 76 76 PHE HA H 76 4.660 4.905 -0.245 1
1 965 . 9 1 1 A 76 76 PHE C C 76 174.900 175.464 -0.564 1
1 966 . 9 1 1 A 76 76 PHE CA C 76 57.000 56.645 0.355 1
1 967 . 9 1 1 A 76 76 PHE CB C 76 41.000 42.058 -1.058 1
1 973 . 9 1 1 A 76 76 PHE N N 76 125.000 125.565 -0.565 1
1 974 . 9 1 1 A 77 77 ASN H H 77 9.040 9.458 -0.418 1
1 975 . 9 1 1 A 77 77 ASN HA H 77 4.170 4.492 -0.322 1
1 980 . 9 1 1 A 77 77 ASN C C 77 174.200 175.639 -1.439 1
1 981 . 9 1 1 A 77 77 ASN CA C 77 53.800 54.513 -0.713 1
1 982 . 9 1 1 A 77 77 ASN CB C 77 37.400 37.475 -0.075 1
1 984 . 9 1 1 A 77 77 ASN N N 77 123.200 123.536 -0.336 1
1 986 . 9 1 1 A 78 78 GLY H H 78 8.370 8.634 -0.264 1
1 987 . 9 1 1 A 78 78 GLY HA2 H 78 3.410 3.550 -0.140 1
1 988 . 9 1 1 A 78 78 GLY HA3 H 78 3.980 3.685 0.295 1
1 989 . 9 1 1 A 78 78 GLY C C 78 173.800 173.139 0.661 1
1 990 . 9 1 1 A 78 78 GLY CA C 78 45.000 45.399 -0.399 1
1 991 . 9 1 1 A 78 78 GLY N N 78 103.300 104.582 -1.282 1
1 992 . 9 1 1 A 79 79 TYR H H 79 7.670 8.205 -0.535 1
1 993 . 9 1 1 A 79 79 TYR HA H 79 4.860 4.989 -0.129 1
1 1000 . 9 1 1 A 79 79 TYR C C 79 174.800 175.455 -0.655 1
1 1001 . 9 1 1 A 79 79 TYR CA C 79 56.300 57.026 -0.726 1
1 1002 . 9 1 1 A 79 79 TYR CB C 79 40.800 41.553 -0.753 1
1 1007 . 9 1 1 A 79 79 TYR N N 79 118.700 118.612 0.088 1
1 1008 . 9 1 1 A 80 80 LEU H H 80 8.760 8.652 0.108 1
1 1009 . 9 1 1 A 80 80 LEU HA H 80 4.830 4.459 0.371 1
1 1019 . 9 1 1 A 80 80 LEU C C 80 176.200 175.642 0.558 1
1 1020 . 9 1 1 A 80 80 LEU CA C 80 54.700 54.935 -0.235 1
1 1021 . 9 1 1 A 80 80 LEU CB C 80 43.500 42.406 1.094 1
1 1025 . 9 1 1 A 80 80 LEU N N 80 122.600 125.674 -3.074 1
1 1026 . 9 1 1 A 81 81 SER H H 81 8.650 8.798 -0.148 1
1 1027 . 9 1 1 A 81 81 SER HA H 81 4.860 5.308 -0.448 1
1 1030 . 9 1 1 A 81 81 SER C C 81 172.600 172.438 0.162 1
1 1031 . 9 1 1 A 81 81 SER CA C 81 56.600 57.453 -0.853 1
1 1032 . 9 1 1 A 81 81 SER CB C 81 66.300 67.195 -0.895 1
1 1033 . 9 1 1 A 81 81 SER N N 81 114.700 115.692 -0.992 1
1 1034 . 9 1 1 A 82 82 LEU H H 82 8.680 8.583 0.097 1
1 1035 . 9 1 1 A 82 82 LEU HA H 82 5.190 5.148 0.042 1
1 1045 . 9 1 1 A 82 82 LEU C C 82 177.100 175.292 1.808 1
1 1046 . 9 1 1 A 82 82 LEU CA C 82 53.300 53.722 -0.422 1
1 1047 . 9 1 1 A 82 82 LEU CB C 82 43.800 43.725 0.075 1
1 1051 . 9 1 1 A 82 82 LEU N N 82 119.800 124.073 -4.273 1
1 1052 . 9 1 1 A 83 83 SER H H 83 9.560 9.377 0.183 1
1 1053 . 9 1 1 A 83 83 SER HA H 83 5.390 5.151 0.239 1
1 1056 . 9 1 1 A 83 83 SER C C 83 174.200 173.059 1.141 1
1 1057 . 9 1 1 A 83 83 SER CA C 83 57.100 56.685 0.415 1
1 1058 . 9 1 1 A 83 83 SER CB C 83 64.400 64.706 -0.306 1
1 1059 . 9 1 1 A 83 83 SER N N 83 119.000 120.479 -1.479 1
1 1060 . 9 1 1 A 84 84 VAL H H 84 9.150 9.136 0.014 1
1 1061 . 9 1 1 A 84 84 VAL HA H 84 4.490 4.648 -0.158 1
1 1069 . 9 1 1 A 84 84 VAL C C 84 174.700 175.940 -1.240 1
1 1070 . 9 1 1 A 84 84 VAL CA C 84 61.300 61.269 0.031 1
1 1071 . 9 1 1 A 84 84 VAL CB C 84 33.000 31.839 1.161 1
1 1074 . 9 1 1 A 84 84 VAL N N 84 128.300 127.178 1.122 1
1 1075 . 9 1 1 A 85 85 GLY H H 85 7.970 8.781 -0.811 1
1 1076 . 9 1 1 A 85 85 GLY HA2 H 85 4.030 4.341 -0.311 1
1 1077 . 9 1 1 A 85 85 GLY HA3 H 85 4.840 4.459 0.381 1
1 1078 . 9 1 1 A 85 85 GLY C C 85 175.800 175.123 0.677 1
1 1079 . 9 1 1 A 85 85 GLY CA C 85 44.800 44.340 0.460 1
1 1080 . 9 1 1 A 85 85 GLY N N 85 114.300 115.302 -1.002 1
1 1081 . 9 1 1 A 86 86 ASP H H 86 8.860 8.901 -0.041 1
1 1082 . 9 1 1 A 86 86 ASP HA H 86 4.370 4.400 -0.030 1
1 1085 . 9 1 1 A 86 86 ASP C C 86 177.400 177.930 -0.530 1
1 1086 . 9 1 1 A 86 86 ASP CA C 86 57.400 56.999 0.401 1
1 1087 . 9 1 1 A 86 86 ASP CB C 86 40.600 40.565 0.035 1
1 1088 . 9 1 1 A 86 86 ASP N N 86 122.500 120.597 1.903 1
1 1089 . 9 1 1 A 87 87 SER H H 87 8.540 7.892 0.648 1
1 1090 . 9 1 1 A 87 87 SER HA H 87 4.620 4.417 0.203 1
1 1093 . 9 1 1 A 87 87 SER C C 87 174.700 174.307 0.393 1
1 1094 . 9 1 1 A 87 87 SER CA C 87 58.200 59.657 -1.457 1
1 1095 . 9 1 1 A 87 87 SER CB C 87 63.300 63.636 -0.336 1
1 1096 . 9 1 1 A 87 87 SER N N 87 112.100 112.657 -0.557 1
1 1097 . 9 1 1 A 88 88 SER H H 88 7.880 7.583 0.297 1
1 1098 . 9 1 1 A 88 88 SER HA H 88 5.050 4.561 0.489 1
1 1101 . 9 1 1 A 88 88 SER C C 88 172.700 173.932 -1.232 1
1 1102 . 9 1 1 A 88 88 SER CA C 88 57.600 57.952 -0.352 1
1 1103 . 9 1 1 A 88 88 SER CB C 88 64.300 64.710 -0.410 1
1 1104 . 9 1 1 A 88 88 SER N N 88 119.200 117.650 1.550 1
1 1105 . 9 1 1 A 89 89 ARG H H 89 8.350 8.446 -0.096 1
1 1106 . 9 1 1 A 89 89 ARG HA H 89 4.720 5.177 -0.457 1
1 1114 . 9 1 1 A 89 89 ARG C C 89 174.200 174.086 0.114 1
1 1115 . 9 1 1 A 89 89 ARG CA C 89 55.000 54.451 0.549 1
1 1116 . 9 1 1 A 89 89 ARG CB C 89 33.500 33.909 -0.409 1
1 1120 . 9 1 1 A 89 89 ARG N N 89 122.800 124.900 -2.100 1
1 1122 . 9 1 1 A 90 90 ILE H H 90 8.530 9.042 -0.512 1
1 1123 . 9 1 1 A 90 90 ILE HA H 90 4.790 4.973 -0.183 1
1 1133 . 9 1 1 A 90 90 ILE C C 90 175.400 174.336 1.064 1
1 1134 . 9 1 1 A 90 90 ILE CA C 90 60.600 60.136 0.464 1
1 1135 . 9 1 1 A 90 90 ILE CB C 90 40.600 40.558 0.042 1
1 1139 . 9 1 1 A 90 90 ILE N N 90 123.100 127.050 -3.950 1
1 1140 . 9 1 1 A 91 91 GLU H H 91 9.000 9.201 -0.201 1
1 1141 . 9 1 1 A 91 91 GLU HA H 91 4.730 5.077 -0.347 1
1 1146 . 9 1 1 A 91 91 GLU C C 91 175.100 176.109 -1.009 1
1 1147 . 9 1 1 A 91 91 GLU CA C 91 54.300 54.522 -0.222 1
1 1148 . 9 1 1 A 91 91 GLU CB C 91 32.400 33.025 -0.625 1
1 1150 . 9 1 1 A 91 91 GLU N N 91 126.400 128.370 -1.970 1
1 1151 . 9 1 1 A 92 92 SER H H 92 8.830 8.790 0.040 1
1 1152 . 9 1 1 A 92 92 SER HA H 92 4.700 4.588 0.112 1
1 1155 . 9 1 1 A 92 92 SER C C 92 174.600 174.384 0.216 1
1 1156 . 9 1 1 A 92 92 SER CA C 92 59.300 58.252 1.048 1
1 1157 . 9 1 1 A 92 92 SER CB C 92 63.100 64.183 -1.083 1
1 1158 . 9 1 1 A 92 92 SER N N 92 119.800 119.257 0.543 1
1 1159 . 9 1 1 A 93 93 VAL H H 93 8.350 8.561 -0.211 1
1 1160 . 9 1 1 A 93 93 VAL HA H 93 4.290 4.514 -0.224 1
1 1168 . 9 1 1 A 93 93 VAL C C 93 175.100 176.288 -1.188 1
1 1169 . 9 1 1 A 93 93 VAL CA C 93 61.300 61.053 0.247 1
1 1170 . 9 1 1 A 93 93 VAL CB C 93 33.900 34.216 -0.316 1
1 1173 . 9 1 1 A 93 93 VAL N N 93 121.800 121.662 0.138 1
1 1174 . 9 1 1 A 94 94 ASN H H 94 8.510 8.989 -0.479 1
1 1175 . 9 1 1 A 94 94 ASN HA H 94 4.770 4.598 0.172 1
1 1180 . 9 1 1 A 94 94 ASN C C 94 175.000 173.941 1.059 1
1 1181 . 9 1 1 A 94 94 ASN CA C 94 52.700 54.767 -2.067 1
1 1182 . 9 1 1 A 94 94 ASN CB C 94 38.500 38.182 0.318 1
1 1184 . 9 1 1 A 94 94 ASN N N 94 121.800 124.301 -2.501 1
1 1186 . 9 1 1 A 95 95 VAL H H 95 7.860 8.772 -0.912 1
1 1187 . 9 1 1 A 95 95 VAL HA H 95 4.100 4.585 -0.485 1
1 1195 . 9 1 1 A 95 95 VAL C C 95 175.100 175.117 -0.017 1
1 1196 . 9 1 1 A 95 95 VAL CA C 95 61.700 61.325 0.375 1
1 1197 . 9 1 1 A 95 95 VAL CB C 95 33.100 34.336 -1.236 1
1 1200 . 9 1 1 A 95 95 VAL N N 95 119.700 118.506 1.194 1
1 1201 . 9 1 1 A 96 96 ASN H H 96 8.490 8.608 -0.118 1
1 1202 . 9 1 1 A 96 96 ASN HA H 96 4.700 5.124 -0.424 1
1 1207 . 9 1 1 A 96 96 ASN C C 96 174.600 173.520 1.080 1
1 1208 . 9 1 1 A 96 96 ASN CA C 96 53.000 52.869 0.131 1
1 1209 . 9 1 1 A 96 96 ASN CB C 96 39.000 38.460 0.540 1
1 1211 . 9 1 1 A 96 96 ASN N N 96 122.200 125.005 -2.805 1
1 1213 . 9 1 1 A 97 97 ILE H H 97 8.080 8.633 -0.553 1
1 1214 . 9 1 1 A 97 97 ILE HA H 97 4.370 4.663 -0.293 1
1 1224 . 9 1 1 A 97 97 ILE CA C 97 58.600 58.313 0.287 1
1 1225 . 9 1 1 A 97 97 ILE CB C 97 38.600 39.331 -0.731 1
1 1229 . 9 1 1 A 97 97 ILE N N 97 123.500 125.192 -1.692 1
1 1230 . 9 1 1 A 98 98 PRO HA H 98 4.360 4.422 -0.062 1
1 1237 . 9 1 1 A 98 98 PRO C C 98 176.600 176.640 -0.040 1
1 1238 . 9 1 1 A 98 98 PRO CA C 98 63.100 63.451 -0.351 1
1 1239 . 9 1 1 A 98 98 PRO CB C 98 31.800 32.050 -0.250 1
1 1242 . 9 1 1 A 99 99 LEU H H 99 8.200 8.925 -0.725 1
1 1243 . 9 1 1 A 99 99 LEU HA H 99 4.200 3.636 0.564 1
1 1253 . 9 1 1 A 99 99 LEU C C 99 177.300 176.911 0.389 1
1 1254 . 9 1 1 A 99 99 LEU CA C 99 55.000 56.622 -1.622 1
1 1255 . 9 1 1 A 99 99 LEU CB C 99 42.400 40.827 1.573 1
1 1259 . 9 1 1 A 99 99 LEU N N 99 122.500 117.981 4.519 1
1 1260 . 9 1 1 A 100 100 GLU H H 100 8.250 8.704 -0.454 1
1 1261 . 9 1 1 A 100 100 GLU HA H 100 4.140 4.028 0.112 1
1 1266 . 9 1 1 A 100 100 GLU C C 100 176.100 176.447 -0.347 1
1 1267 . 9 1 1 A 100 100 GLU CA C 100 56.100 57.291 -1.191 1
1 1268 . 9 1 1 A 100 100 GLU CB C 100 29.900 28.338 1.562 1
1 1270 . 9 1 1 A 100 100 GLU N N 100 121.000 121.293 -0.293 1
1 1271 . 9 1 1 A 101 101 HIS H H 101 8.540 7.821 0.719 1
1 1272 . 9 1 1 A 101 101 HIS HA H 101 4.600 4.250 0.350 1
1 1275 . 9 1 1 A 101 101 HIS C C 101 174.200 174.817 -0.617 1
1 1276 . 9 1 1 A 101 101 HIS CA C 101 55.200 58.948 -3.748 1
1 1277 . 9 1 1 A 101 101 HIS CB C 101 29.000 29.657 -0.657 1
1 1278 . 9 1 1 A 101 101 HIS N N 101 119.400 116.654 2.746 1
1 1279 . 9 1 1 A 102 102 HIS H H 102 8.660 8.170 0.490 1
1 1280 . 9 1 1 A 102 102 HIS HA H 102 4.630 5.075 -0.445 1
1 1283 . 9 1 1 A 102 102 HIS C C 102 174.200 174.854 -0.654 1
1 1284 . 9 1 1 A 102 102 HIS CA C 102 55.200 54.222 0.978 1
1 1285 . 9 1 1 A 102 102 HIS CB C 102 29.100 31.198 -2.098 1
1 1286 . 9 1 1 A 102 102 HIS N N 102 119.700 115.350 4.350 1
1 1287 . 9 1 1 A 103 103 HIS H H 103 8.680 8.677 0.003 1
1 1288 . 9 1 1 A 103 103 HIS HA H 103 4.640 4.738 -0.098 1
1 1291 . 9 1 1 A 103 103 HIS C C 103 174.200 175.913 -1.713 1
1 1292 . 9 1 1 A 103 103 HIS CA C 103 55.200 54.868 0.332 1
1 1293 . 9 1 1 A 103 103 HIS CB C 103 29.200 29.806 -0.606 1
1 1294 . 9 1 1 A 103 103 HIS N N 103 120.500 124.078 -3.578 1
1 1295 . 9 1 1 A 104 104 HIS H H 104 8.580 9.004 -0.424 1
1 1296 . 9 1 1 A 104 104 HIS HA H 104 4.590 4.212 0.378 1
1 1299 . 9 1 1 A 104 104 HIS C C 104 174.200 175.624 -1.424 1
1 1300 . 9 1 1 A 104 104 HIS CA C 104 55.200 59.763 -4.563 1
1 1301 . 9 1 1 A 104 104 HIS CB C 104 29.300 29.778 -0.478 1
1 1302 . 9 1 1 A 104 104 HIS N N 104 120.700 118.679 2.021 1
1 1303 . 9 1 1 A 105 105 HIS H H 105 8.550 7.582 0.968 1
1 1304 . 9 1 1 A 105 105 HIS HA H 105 4.610 4.079 0.531 1
1 1307 . 9 1 1 A 105 105 HIS C C 105 173.500 174.380 -0.880 1
1 1308 . 9 1 1 A 105 105 HIS CA C 105 55.400 58.169 -2.769 1
1 1309 . 9 1 1 A 105 105 HIS CB C 105 28.800 29.265 -0.465 1
1 1310 . 9 1 1 A 105 105 HIS N N 105 119.000 117.855 1.145 1
1 7 . 10 1 1 A 2 2 ASP H H 2 8.890 7.944 0.946 1
1 8 . 10 1 1 A 2 2 ASP HA H 2 4.740 4.715 0.025 1
1 11 . 10 1 1 A 2 2 ASP C C 2 174.600 176.116 -1.516 1
1 12 . 10 1 1 A 2 2 ASP CA C 2 53.800 54.797 -0.997 1
1 13 . 10 1 1 A 2 2 ASP CB C 2 41.500 41.444 0.056 1
1 14 . 10 1 1 A 2 2 ASP N N 2 122.100 122.892 -0.792 1
1 15 . 10 1 1 A 3 3 LEU H H 3 8.280 8.377 -0.097 1
1 16 . 10 1 1 A 3 3 LEU HA H 3 4.420 4.693 -0.273 1
1 26 . 10 1 1 A 3 3 LEU C C 3 176.900 176.052 0.848 1
1 27 . 10 1 1 A 3 3 LEU CA C 3 55.000 55.714 -0.714 1
1 28 . 10 1 1 A 3 3 LEU CB C 3 42.700 42.411 0.289 1
1 32 . 10 1 1 A 3 3 LEU N N 3 122.300 124.850 -2.550 1
1 33 . 10 1 1 A 4 4 VAL H H 4 8.640 8.674 -0.034 1
1 34 . 10 1 1 A 4 4 VAL HA H 4 4.540 4.942 -0.402 1
1 42 . 10 1 1 A 4 4 VAL C C 4 175.800 174.868 0.932 1
1 43 . 10 1 1 A 4 4 VAL CA C 4 59.400 58.605 0.795 1
1 44 . 10 1 1 A 4 4 VAL CB C 4 35.400 35.911 -0.511 1
1 47 . 10 1 1 A 4 4 VAL N N 4 122.600 119.421 3.179 1
1 48 . 10 1 1 A 5 5 LYS H H 5 8.630 9.187 -0.557 1
1 49 . 10 1 1 A 5 5 LYS HA H 5 4.450 4.324 0.126 1
1 58 . 10 1 1 A 5 5 LYS C C 5 179.400 178.434 0.966 1
1 59 . 10 1 1 A 5 5 LYS CA C 5 53.600 56.291 -2.691 1
1 60 . 10 1 1 A 5 5 LYS CB C 5 30.900 32.855 -1.955 1
1 64 . 10 1 1 A 5 5 LYS N N 5 121.100 121.667 -0.567 1
1 65 . 10 1 1 A 6 6 ILE H H 6 10.320 8.783 1.537 1
1 66 . 10 1 1 A 6 6 ILE HA H 6 3.440 3.722 -0.282 1
1 76 . 10 1 1 A 6 6 ILE C C 6 178.300 178.050 0.250 1
1 77 . 10 1 1 A 6 6 ILE CA C 6 65.700 64.911 0.789 1
1 78 . 10 1 1 A 6 6 ILE CB C 6 35.900 37.458 -1.558 1
1 82 . 10 1 1 A 6 6 ILE N N 6 125.400 122.373 3.027 1
1 83 . 10 1 1 A 7 7 ARG H H 7 8.210 8.192 0.018 1
1 84 . 10 1 1 A 7 7 ARG HA H 7 3.850 3.973 -0.123 1
1 92 . 10 1 1 A 7 7 ARG C C 7 175.600 177.902 -2.302 1
1 93 . 10 1 1 A 7 7 ARG CA C 7 57.800 59.424 -1.624 1
1 94 . 10 1 1 A 7 7 ARG CB C 7 30.300 30.032 0.268 1
1 98 . 10 1 1 A 7 7 ARG N N 7 118.800 122.041 -3.241 1
1 100 . 10 1 1 A 8 8 ASP H H 8 7.850 8.002 -0.152 1
1 101 . 10 1 1 A 8 8 ASP HA H 8 4.700 4.609 0.091 1
1 104 . 10 1 1 A 8 8 ASP C C 8 176.100 176.213 -0.113 1
1 105 . 10 1 1 A 8 8 ASP CA C 8 54.100 53.711 0.389 1
1 106 . 10 1 1 A 8 8 ASP CB C 8 41.200 39.622 1.578 1
1 107 . 10 1 1 A 8 8 ASP N N 8 116.800 115.982 0.818 1
1 108 . 10 1 1 A 9 9 VAL H H 9 7.240 7.263 -0.023 1
1 109 . 10 1 1 A 9 9 VAL HA H 9 3.710 3.999 -0.289 1
1 117 . 10 1 1 A 9 9 VAL C C 9 174.900 175.440 -0.540 1
1 118 . 10 1 1 A 9 9 VAL CA C 9 64.300 63.265 1.035 1
1 119 . 10 1 1 A 9 9 VAL CB C 9 31.500 31.710 -0.210 1
1 122 . 10 1 1 A 9 9 VAL N N 9 121.800 122.351 -0.551 1
1 123 . 10 1 1 A 10 10 SER H H 10 8.600 8.465 0.135 1
1 124 . 10 1 1 A 10 10 SER HA H 10 4.600 4.650 -0.050 1
1 127 . 10 1 1 A 10 10 SER CA C 10 56.700 57.034 -0.334 1
1 128 . 10 1 1 A 10 10 SER CB C 10 66.100 65.566 0.534 1
1 129 . 10 1 1 A 10 10 SER N N 10 122.200 120.821 1.379 1
1 130 . 10 1 1 A 11 11 LEU H H 11 8.660 8.986 -0.326 1
1 131 . 10 1 1 A 11 11 LEU HA H 11 3.900 3.989 -0.089 1
1 141 . 10 1 1 A 11 11 LEU C C 11 178.100 178.652 -0.552 1
1 142 . 10 1 1 A 11 11 LEU CA C 11 56.700 57.679 -0.979 1
1 143 . 10 1 1 A 11 11 LEU CB C 11 41.400 41.271 0.129 1
1 147 . 10 1 1 A 11 11 LEU N N 11 120.300 123.218 -2.918 1
1 148 . 10 1 1 A 12 12 SER H H 12 8.160 8.170 -0.010 1
1 149 . 10 1 1 A 12 12 SER HA H 12 4.270 4.313 -0.043 1
1 152 . 10 1 1 A 12 12 SER C C 12 174.200 175.037 -0.837 1
1 153 . 10 1 1 A 12 12 SER CA C 12 59.900 62.127 -2.227 1
1 154 . 10 1 1 A 12 12 SER CB C 12 63.100 63.138 -0.038 1
1 155 . 10 1 1 A 12 12 SER N N 12 112.100 114.012 -1.912 1
1 156 . 10 1 1 A 13 13 THR H H 13 7.460 7.645 -0.185 1
1 157 . 10 1 1 A 13 13 THR HA H 13 4.760 4.570 0.190 1
1 162 . 10 1 1 A 13 13 THR CA C 13 56.600 59.125 -2.525 1
1 163 . 10 1 1 A 13 13 THR CB C 13 70.100 69.695 0.405 1
1 165 . 10 1 1 A 13 13 THR N N 13 114.700 111.251 3.449 1
1 166 . 10 1 1 A 14 14 PRO HA H 14 4.050 4.334 -0.284 1
1 173 . 10 1 1 A 14 14 PRO C C 14 175.800 175.668 0.132 1
1 174 . 10 1 1 A 14 14 PRO CA C 14 65.100 64.124 0.976 1
1 175 . 10 1 1 A 14 14 PRO CB C 14 32.100 31.773 0.327 1
1 178 . 10 1 1 A 15 15 TYR H H 15 7.380 7.484 -0.104 1
1 179 . 10 1 1 A 15 15 TYR HA H 15 5.570 5.634 -0.064 1
1 186 . 10 1 1 A 15 15 TYR C C 15 176.100 174.848 1.252 1
1 187 . 10 1 1 A 15 15 TYR CA C 15 56.400 56.477 -0.077 1
1 188 . 10 1 1 A 15 15 TYR CB C 15 41.500 42.349 -0.849 1
1 193 . 10 1 1 A 15 15 TYR N N 15 113.800 117.730 -3.930 1
1 194 . 10 1 1 A 16 16 VAL H H 16 9.010 9.031 -0.021 1
1 195 . 10 1 1 A 16 16 VAL HA H 16 4.920 4.985 -0.065 1
1 203 . 10 1 1 A 16 16 VAL C C 16 174.300 174.138 0.162 1
1 204 . 10 1 1 A 16 16 VAL CA C 16 59.600 59.494 0.106 1
1 205 . 10 1 1 A 16 16 VAL CB C 16 36.800 36.165 0.635 1
1 208 . 10 1 1 A 16 16 VAL N N 16 113.800 118.246 -4.446 1
1 209 . 10 1 1 A 17 17 SER H H 17 7.960 8.565 -0.605 1
1 210 . 10 1 1 A 17 17 SER HA H 17 5.860 5.675 0.185 1
1 213 . 10 1 1 A 17 17 SER C C 17 172.700 173.479 -0.779 1
1 214 . 10 1 1 A 17 17 SER CA C 17 57.300 56.894 0.406 1
1 215 . 10 1 1 A 17 17 SER CB C 17 64.000 65.833 -1.833 1
1 216 . 10 1 1 A 17 17 SER N N 17 117.100 117.337 -0.237 1
1 217 . 10 1 1 A 18 18 VAL H H 18 8.570 8.712 -0.142 1
1 218 . 10 1 1 A 18 18 VAL HA H 18 4.900 5.088 -0.188 1
1 226 . 10 1 1 A 18 18 VAL C C 18 173.700 174.931 -1.231 1
1 227 . 10 1 1 A 18 18 VAL CA C 18 58.800 59.233 -0.433 1
1 228 . 10 1 1 A 18 18 VAL CB C 18 36.700 36.053 0.647 1
1 231 . 10 1 1 A 18 18 VAL N N 18 113.500 117.341 -3.841 1
1 232 . 10 1 1 A 19 19 ILE H H 19 8.490 8.617 -0.127 1
1 233 . 10 1 1 A 19 19 ILE HA H 19 5.300 5.045 0.255 1
1 243 . 10 1 1 A 19 19 ILE C C 19 175.800 175.634 0.166 1
1 244 . 10 1 1 A 19 19 ILE CA C 19 59.700 59.652 0.048 1
1 245 . 10 1 1 A 19 19 ILE CB C 19 41.700 41.717 -0.017 1
1 249 . 10 1 1 A 19 19 ILE N N 19 120.600 121.117 -0.517 1
1 250 . 10 1 1 A 20 20 GLY H H 20 8.670 7.863 0.807 1
1 251 . 10 1 1 A 20 20 GLY HA2 H 20 3.760 4.200 -0.440 1
1 252 . 10 1 1 A 20 20 GLY HA3 H 20 4.190 4.202 -0.012 1
1 253 . 10 1 1 A 20 20 GLY C C 20 169.900 171.321 -1.421 1
1 254 . 10 1 1 A 20 20 GLY CA C 20 46.000 46.040 -0.040 1
1 255 . 10 1 1 A 20 20 GLY N N 20 110.200 112.270 -2.070 1
1 256 . 10 1 1 A 21 21 LYS H H 21 8.920 8.295 0.625 1
1 257 . 10 1 1 A 21 21 LYS HA H 21 5.210 5.089 0.121 1
1 266 . 10 1 1 A 21 21 LYS C C 21 176.400 175.119 1.281 1
1 267 . 10 1 1 A 21 21 LYS CA C 21 54.400 54.726 -0.326 1
1 268 . 10 1 1 A 21 21 LYS CB C 21 35.400 35.655 -0.255 1
1 272 . 10 1 1 A 21 21 LYS N N 21 119.100 121.086 -1.986 1
1 273 . 10 1 1 A 22 22 ILE H H 22 8.900 8.659 0.241 1
1 274 . 10 1 1 A 22 22 ILE HA H 22 5.050 5.099 -0.049 1
1 284 . 10 1 1 A 22 22 ILE C C 22 176.900 174.954 1.946 1
1 285 . 10 1 1 A 22 22 ILE CA C 22 57.800 60.298 -2.498 1
1 286 . 10 1 1 A 22 22 ILE CB C 22 36.200 39.367 -3.167 1
1 290 . 10 1 1 A 22 22 ILE N N 22 130.000 128.250 1.750 1
1 291 . 10 1 1 A 23 23 THR H H 23 9.020 8.863 0.157 1
1 292 . 10 1 1 A 23 23 THR HA H 23 4.660 4.826 -0.166 1
1 297 . 10 1 1 A 23 23 THR C C 23 174.000 174.813 -0.813 1
1 298 . 10 1 1 A 23 23 THR CA C 23 60.800 60.933 -0.133 1
1 299 . 10 1 1 A 23 23 THR CB C 23 73.400 72.367 1.033 1
1 301 . 10 1 1 A 23 23 THR N N 23 118.200 120.743 -2.543 1
1 302 . 10 1 1 A 24 24 GLY H H 24 8.430 8.572 -0.142 1
1 303 . 10 1 1 A 24 24 GLY HA2 H 24 3.910 3.977 -0.067 1
1 304 . 10 1 1 A 24 24 GLY HA3 H 24 3.910 4.138 -0.228 1
1 305 . 10 1 1 A 24 24 GLY C C 24 175.400 174.733 0.667 1
1 306 . 10 1 1 A 24 24 GLY CA C 24 47.100 46.908 0.192 1
1 307 . 10 1 1 A 24 24 GLY N N 24 107.200 113.475 -6.275 1
1 308 . 10 1 1 A 25 25 ILE H H 25 9.370 7.949 1.421 1
1 309 . 10 1 1 A 25 25 ILE HA H 25 4.480 4.187 0.293 1
1 319 . 10 1 1 A 25 25 ILE C C 25 178.200 175.475 2.725 1
1 320 . 10 1 1 A 25 25 ILE CA C 25 59.200 61.135 -1.935 1
1 321 . 10 1 1 A 25 25 ILE CB C 25 35.400 38.181 -2.781 1
1 325 . 10 1 1 A 25 25 ILE N N 25 120.600 120.581 0.019 1
1 326 . 10 1 1 A 26 26 HIS H H 26 9.000 9.180 -0.180 1
1 327 . 10 1 1 A 26 26 HIS HA H 26 4.770 5.231 -0.461 1
1 330 . 10 1 1 A 26 26 HIS C C 26 172.700 174.273 -1.573 1
1 331 . 10 1 1 A 26 26 HIS CA C 26 55.000 54.327 0.673 1
1 332 . 10 1 1 A 26 26 HIS CB C 26 31.100 31.952 -0.852 1
1 333 . 10 1 1 A 26 26 HIS N N 26 123.800 126.204 -2.404 1
1 334 . 10 1 1 A 27 27 LYS H H 27 8.930 8.907 0.023 1
1 335 . 10 1 1 A 27 27 LYS HA H 27 4.770 4.513 0.257 1
1 344 . 10 1 1 A 27 27 LYS C C 27 175.300 175.426 -0.126 1
1 345 . 10 1 1 A 27 27 LYS CA C 27 55.100 56.034 -0.934 1
1 346 . 10 1 1 A 27 27 LYS CB C 27 34.400 33.456 0.944 1
1 350 . 10 1 1 A 27 27 LYS N N 27 125.900 125.387 0.513 1
1 351 . 10 1 1 A 28 28 LYS H H 28 8.880 8.193 0.687 1
1 352 . 10 1 1 A 28 28 LYS HA H 28 4.570 4.887 -0.317 1
1 361 . 10 1 1 A 28 28 LYS C C 28 174.500 173.773 0.727 1
1 362 . 10 1 1 A 28 28 LYS CA C 28 54.600 55.062 -0.462 1
1 363 . 10 1 1 A 28 28 LYS CB C 28 35.300 36.671 -1.371 1
1 367 . 10 1 1 A 28 28 LYS N N 28 127.400 126.375 1.025 1
1 368 . 10 1 1 A 29 29 GLU H H 29 8.440 8.484 -0.044 1
1 369 . 10 1 1 A 29 29 GLU HA H 29 5.260 5.088 0.172 1
1 374 . 10 1 1 A 29 29 GLU C C 29 175.800 175.536 0.264 1
1 375 . 10 1 1 A 29 29 GLU CA C 29 54.800 55.022 -0.222 1
1 376 . 10 1 1 A 29 29 GLU CB C 29 31.500 32.992 -1.492 1
1 378 . 10 1 1 A 29 29 GLU N N 29 122.200 124.755 -2.555 1
1 379 . 10 1 1 A 30 30 TYR H H 30 8.960 8.803 0.157 1
1 380 . 10 1 1 A 30 30 TYR HA H 30 4.820 5.360 -0.540 1
1 387 . 10 1 1 A 30 30 TYR C C 30 172.600 172.931 -0.331 1
1 388 . 10 1 1 A 30 30 TYR CA C 30 56.300 55.475 0.825 1
1 389 . 10 1 1 A 30 30 TYR CB C 30 40.500 41.635 -1.135 1
1 394 . 10 1 1 A 30 30 TYR N N 30 121.100 118.747 2.353 1
1 395 . 10 1 1 A 31 31 GLU H H 31 8.610 8.756 -0.146 1
1 396 . 10 1 1 A 31 31 GLU HA H 31 4.810 4.452 0.358 1
1 401 . 10 1 1 A 31 31 GLU C C 31 176.100 176.062 0.038 1
1 402 . 10 1 1 A 31 31 GLU CA C 31 55.100 55.581 -0.481 1
1 403 . 10 1 1 A 31 31 GLU CB C 31 30.300 29.634 0.666 1
1 405 . 10 1 1 A 31 31 GLU N N 31 121.800 120.796 1.004 1
1 406 . 10 1 1 A 32 32 SER H H 32 8.570 8.692 -0.122 1
1 407 . 10 1 1 A 32 32 SER HA H 32 4.520 4.546 -0.026 1
1 410 . 10 1 1 A 32 32 SER C C 32 174.300 172.911 1.389 1
1 411 . 10 1 1 A 32 32 SER CA C 32 57.300 56.662 0.638 1
1 412 . 10 1 1 A 32 32 SER CB C 32 64.100 64.815 -0.715 1
1 413 . 10 1 1 A 32 32 SER N N 32 118.500 119.975 -1.475 1
1 414 . 10 1 1 A 33 33 ASP H H 33 9.290 8.488 0.802 1
1 415 . 10 1 1 A 33 33 ASP HA H 33 4.340 4.472 -0.132 1
1 418 . 10 1 1 A 33 33 ASP C C 33 175.900 176.890 -0.990 1
1 419 . 10 1 1 A 33 33 ASP CA C 33 55.000 53.551 1.449 1
1 420 . 10 1 1 A 33 33 ASP CB C 33 39.300 39.441 -0.141 1
1 421 . 10 1 1 A 33 33 ASP N N 33 125.700 122.879 2.821 1
1 422 . 10 1 1 A 34 34 GLY H H 34 8.690 9.086 -0.396 1
1 423 . 10 1 1 A 34 34 GLY HA2 H 34 3.660 3.891 -0.231 1
1 424 . 10 1 1 A 34 34 GLY HA3 H 34 4.140 3.895 0.245 1
1 425 . 10 1 1 A 34 34 GLY C C 34 174.200 173.451 0.749 1
1 426 . 10 1 1 A 34 34 GLY CA C 34 45.600 46.133 -0.533 1
1 427 . 10 1 1 A 34 34 GLY N N 34 104.800 111.561 -6.761 1
1 428 . 10 1 1 A 35 35 THR H H 35 7.840 7.728 0.112 1
1 429 . 10 1 1 A 35 35 THR HA H 35 4.660 4.900 -0.240 1
1 434 . 10 1 1 A 35 35 THR C C 35 173.000 172.168 0.832 1
1 435 . 10 1 1 A 35 35 THR CA C 35 60.200 60.197 0.003 1
1 436 . 10 1 1 A 35 35 THR CB C 35 71.200 71.481 -0.281 1
1 438 . 10 1 1 A 35 35 THR N N 35 114.800 113.620 1.180 1
1 439 . 10 1 1 A 36 36 THR H H 36 8.480 8.868 -0.388 1
1 440 . 10 1 1 A 36 36 THR HA H 36 4.620 4.740 -0.120 1
1 445 . 10 1 1 A 36 36 THR C C 36 173.800 174.057 -0.257 1
1 446 . 10 1 1 A 36 36 THR CA C 36 62.300 61.930 0.370 1
1 447 . 10 1 1 A 36 36 THR CB C 36 69.500 69.350 0.150 1
1 449 . 10 1 1 A 36 36 THR N N 36 119.400 122.678 -3.278 1
1 450 . 10 1 1 A 37 37 LYS H H 37 8.880 8.304 0.576 1
1 451 . 10 1 1 A 37 37 LYS HA H 37 4.570 4.893 -0.323 1
1 460 . 10 1 1 A 37 37 LYS C C 37 174.500 174.892 -0.392 1
1 461 . 10 1 1 A 37 37 LYS CA C 37 54.600 54.034 0.566 1
1 462 . 10 1 1 A 37 37 LYS CB C 37 35.500 36.508 -1.008 1
1 466 . 10 1 1 A 37 37 LYS N N 37 128.000 125.429 2.571 1
1 467 . 10 1 1 A 38 38 SER H H 38 8.370 8.789 -0.419 1
1 468 . 10 1 1 A 38 38 SER HA H 38 5.250 4.951 0.299 1
1 471 . 10 1 1 A 38 38 SER C C 38 173.200 173.486 -0.286 1
1 472 . 10 1 1 A 38 38 SER CA C 38 57.900 58.216 -0.316 1
1 473 . 10 1 1 A 38 38 SER CB C 38 65.500 63.759 1.741 1
1 474 . 10 1 1 A 38 38 SER N N 38 114.300 119.236 -4.936 1
1 475 . 10 1 1 A 39 39 VAL H H 39 9.020 9.008 0.012 1
1 476 . 10 1 1 A 39 39 VAL HA H 39 4.900 5.003 -0.103 1
1 484 . 10 1 1 A 39 39 VAL C C 39 173.200 172.661 0.539 1
1 485 . 10 1 1 A 39 39 VAL CA C 39 59.200 59.558 -0.358 1
1 486 . 10 1 1 A 39 39 VAL CB C 39 34.600 35.213 -0.613 1
1 489 . 10 1 1 A 39 39 VAL N N 39 123.600 123.897 -0.297 1
1 490 . 10 1 1 A 40 40 TYR H H 40 8.900 8.825 0.075 1
1 491 . 10 1 1 A 40 40 TYR HA H 40 4.730 5.413 -0.683 1
1 498 . 10 1 1 A 40 40 TYR CA C 40 56.500 56.625 -0.125 1
1 499 . 10 1 1 A 40 40 TYR CB C 40 39.000 40.566 -1.566 1
1 504 . 10 1 1 A 40 40 TYR N N 40 126.300 127.695 -1.395 1
1 505 . 10 1 1 A 41 41 GLN H H 41 8.630 8.506 0.124 1
1 506 . 10 1 1 A 41 41 GLN HA H 41 5.330 5.372 -0.042 1
1 513 . 10 1 1 A 41 41 GLN C C 41 175.500 175.972 -0.472 1
1 514 . 10 1 1 A 41 41 GLN CA C 41 53.800 54.128 -0.328 1
1 515 . 10 1 1 A 41 41 GLN CB C 41 32.100 31.796 0.304 1
1 518 . 10 1 1 A 41 41 GLN N N 41 122.000 122.213 -0.213 1
1 520 . 10 1 1 A 42 42 GLY H H 42 8.560 7.896 0.664 1
1 521 . 10 1 1 A 42 42 GLY HA2 H 42 3.680 4.312 -0.632 1
1 522 . 10 1 1 A 42 42 GLY HA3 H 42 4.020 4.327 -0.307 1
1 523 . 10 1 1 A 42 42 GLY C C 42 171.600 171.075 0.525 1
1 524 . 10 1 1 A 42 42 GLY CA C 42 47.300 46.084 1.216 1
1 525 . 10 1 1 A 42 42 GLY N N 42 113.000 109.025 3.975 1
1 526 . 10 1 1 A 43 43 TYR H H 43 9.320 8.432 0.888 1
1 527 . 10 1 1 A 43 43 TYR HA H 43 5.280 5.449 -0.169 1
1 534 . 10 1 1 A 43 43 TYR C C 43 173.200 174.144 -0.944 1
1 535 . 10 1 1 A 43 43 TYR CA C 43 57.600 56.500 1.100 1
1 536 . 10 1 1 A 43 43 TYR CB C 43 42.400 42.373 0.027 1
1 541 . 10 1 1 A 43 43 TYR N N 43 126.300 119.034 7.266 1
1 542 . 10 1 1 A 44 44 ILE H H 44 9.160 8.820 0.340 1
1 543 . 10 1 1 A 44 44 ILE HA H 44 5.270 5.429 -0.159 1
1 553 . 10 1 1 A 44 44 ILE C C 44 172.900 174.384 -1.484 1
1 554 . 10 1 1 A 44 44 ILE CA C 44 59.000 59.541 -0.541 1
1 555 . 10 1 1 A 44 44 ILE CB C 44 42.200 41.847 0.353 1
1 559 . 10 1 1 A 44 44 ILE N N 44 117.700 123.007 -5.307 1
1 560 . 10 1 1 A 45 45 GLU H H 45 8.420 8.885 -0.465 1
1 561 . 10 1 1 A 45 45 GLU HA H 45 5.600 5.355 0.245 1
1 566 . 10 1 1 A 45 45 GLU C C 45 174.300 174.042 0.258 1
1 567 . 10 1 1 A 45 45 GLU CA C 45 54.000 54.257 -0.257 1
1 568 . 10 1 1 A 45 45 GLU CB C 45 34.400 34.168 0.232 1
1 570 . 10 1 1 A 45 45 GLU N N 45 123.600 127.584 -3.984 1
1 571 . 10 1 1 A 46 46 ASP H H 46 8.530 8.637 -0.107 1
1 572 . 10 1 1 A 46 46 ASP HA H 46 5.070 5.029 0.041 1
1 575 . 10 1 1 A 46 46 ASP C C 46 175.000 175.022 -0.022 1
1 576 . 10 1 1 A 46 46 ASP CA C 46 51.800 52.788 -0.988 1
1 577 . 10 1 1 A 46 46 ASP CB C 46 41.300 43.779 -2.479 1
1 578 . 10 1 1 A 46 46 ASP N N 46 125.500 119.241 6.259 1
1 579 . 10 1 1 A 47 47 ASP H H 47 9.160 8.830 0.330 1
1 580 . 10 1 1 A 47 47 ASP HA H 47 4.430 4.456 -0.026 1
1 583 . 10 1 1 A 47 47 ASP C C 47 176.000 178.015 -2.015 1
1 584 . 10 1 1 A 47 47 ASP CA C 47 55.000 56.247 -1.247 1
1 585 . 10 1 1 A 47 47 ASP CB C 47 38.900 40.814 -1.914 1
1 586 . 10 1 1 A 47 47 ASP N N 47 114.200 121.297 -7.097 1
1 587 . 10 1 1 A 48 48 THR H H 48 9.470 7.782 1.688 1
1 588 . 10 1 1 A 48 48 THR HA H 48 4.520 4.430 0.090 1
1 593 . 10 1 1 A 48 48 THR C C 48 174.500 174.191 0.309 1
1 594 . 10 1 1 A 48 48 THR CA C 48 62.600 62.051 0.549 1
1 595 . 10 1 1 A 48 48 THR CB C 48 70.400 69.094 1.306 1
1 597 . 10 1 1 A 48 48 THR N N 48 111.800 109.354 2.446 1
1 598 . 10 1 1 A 49 49 ALA H H 49 7.850 7.797 0.053 1
1 599 . 10 1 1 A 49 49 ALA HA H 49 4.440 4.490 -0.050 1
1 603 . 10 1 1 A 49 49 ALA C C 49 173.200 175.727 -2.527 1
1 604 . 10 1 1 A 49 49 ALA CA C 49 52.700 50.805 1.895 1
1 605 . 10 1 1 A 49 49 ALA CB C 49 21.300 20.641 0.659 1
1 606 . 10 1 1 A 49 49 ALA N N 49 123.400 121.420 1.980 1
1 607 . 10 1 1 A 50 50 ARG H H 50 8.160 8.969 -0.809 1
1 608 . 10 1 1 A 50 50 ARG HA H 50 5.350 5.551 -0.201 1
1 616 . 10 1 1 A 50 50 ARG C C 50 174.700 174.398 0.302 1
1 617 . 10 1 1 A 50 50 ARG CA C 50 54.000 54.471 -0.471 1
1 618 . 10 1 1 A 50 50 ARG CB C 50 34.500 34.453 0.047 1
1 622 . 10 1 1 A 50 50 ARG N N 50 117.400 113.972 3.428 1
1 624 . 10 1 1 A 51 51 ILE H H 51 9.390 8.626 0.764 1
1 625 . 10 1 1 A 51 51 ILE HA H 51 4.790 5.005 -0.215 1
1 635 . 10 1 1 A 51 51 ILE C C 51 172.600 173.116 -0.516 1
1 636 . 10 1 1 A 51 51 ILE CA C 51 60.000 59.016 0.984 1
1 637 . 10 1 1 A 51 51 ILE CB C 51 42.800 41.825 0.975 1
1 641 . 10 1 1 A 51 51 ILE N N 51 124.600 120.716 3.884 1
1 642 . 10 1 1 A 52 52 ARG H H 52 7.980 8.556 -0.576 1
1 643 . 10 1 1 A 52 52 ARG HA H 52 4.170 4.400 -0.230 1
1 651 . 10 1 1 A 52 52 ARG C C 52 174.600 175.876 -1.276 1
1 652 . 10 1 1 A 52 52 ARG CA C 52 57.100 55.961 1.139 1
1 653 . 10 1 1 A 52 52 ARG CB C 52 31.300 31.081 0.219 1
1 657 . 10 1 1 A 52 52 ARG N N 52 125.900 127.806 -1.906 1
1 659 . 10 1 1 A 53 53 ILE H H 53 8.290 8.748 -0.458 1
1 660 . 10 1 1 A 53 53 ILE HA H 53 5.160 5.100 0.060 1
1 670 . 10 1 1 A 53 53 ILE C C 53 172.400 174.718 -2.318 1
1 671 . 10 1 1 A 53 53 ILE CA C 53 58.600 59.125 -0.525 1
1 672 . 10 1 1 A 53 53 ILE CB C 53 41.900 42.388 -0.488 1
1 676 . 10 1 1 A 53 53 ILE N N 53 118.500 121.037 -2.537 1
1 677 . 10 1 1 A 54 54 SER H H 54 8.350 8.484 -0.134 1
1 678 . 10 1 1 A 54 54 SER HA H 54 5.070 5.126 -0.056 1
1 681 . 10 1 1 A 54 54 SER C C 54 172.400 173.210 -0.810 1
1 682 . 10 1 1 A 54 54 SER CA C 54 57.000 57.503 -0.503 1
1 683 . 10 1 1 A 54 54 SER CB C 54 65.900 65.482 0.418 1
1 684 . 10 1 1 A 54 54 SER N N 54 120.700 119.103 1.597 1
1 685 . 10 1 1 A 55 55 SER H H 55 9.130 9.133 -0.003 1
1 686 . 10 1 1 A 55 55 SER HA H 55 5.270 5.462 -0.192 1
1 690 . 10 1 1 A 55 55 SER C C 55 174.400 173.436 0.964 1
1 691 . 10 1 1 A 55 55 SER CA C 55 55.500 55.813 -0.313 1
1 692 . 10 1 1 A 55 55 SER CB C 55 64.500 65.850 -1.350 1
1 693 . 10 1 1 A 55 55 SER N N 55 117.200 119.579 -2.379 1
1 694 . 10 1 1 A 56 56 PHE H H 56 8.970 8.648 0.322 1
1 695 . 10 1 1 A 56 56 PHE HA H 56 4.600 4.995 -0.395 1
1 703 . 10 1 1 A 56 56 PHE C C 56 176.500 177.169 -0.669 1
1 704 . 10 1 1 A 56 56 PHE CA C 56 58.300 57.086 1.214 1
1 705 . 10 1 1 A 56 56 PHE CB C 56 37.900 40.941 -3.041 1
1 711 . 10 1 1 A 56 56 PHE N N 56 129.400 122.254 7.146 1
1 712 . 10 1 1 A 57 57 GLY H H 57 8.570 9.063 -0.493 1
1 713 . 10 1 1 A 57 57 GLY HA2 H 57 4.020 4.125 -0.105 1
1 714 . 10 1 1 A 57 57 GLY HA3 H 57 4.380 4.162 0.218 1
1 715 . 10 1 1 A 57 57 GLY C C 57 173.700 174.352 -0.652 1
1 716 . 10 1 1 A 57 57 GLY CA C 57 46.300 45.651 0.649 1
1 717 . 10 1 1 A 57 57 GLY N N 57 112.500 112.512 -0.012 1
1 718 . 10 1 1 A 58 58 LYS H H 58 6.800 8.592 -1.792 1
1 719 . 10 1 1 A 58 58 LYS HA H 58 4.410 4.320 0.090 1
1 728 . 10 1 1 A 58 58 LYS C C 58 174.800 175.598 -0.798 1
1 729 . 10 1 1 A 58 58 LYS CA C 58 55.200 56.086 -0.886 1
1 730 . 10 1 1 A 58 58 LYS CB C 58 33.300 32.870 0.430 1
1 734 . 10 1 1 A 58 58 LYS N N 58 118.700 122.561 -3.861 1
1 735 . 10 1 1 A 59 59 GLN H H 59 8.390 8.736 -0.346 1
1 736 . 10 1 1 A 59 59 GLN HA H 59 1.830 4.259 -2.429 1
1 743 . 10 1 1 A 59 59 GLN C C 59 174.100 174.608 -0.508 1
1 744 . 10 1 1 A 59 59 GLN CA C 59 57.100 55.423 1.677 1
1 745 . 10 1 1 A 59 59 GLN CB C 59 28.900 29.749 -0.849 1
1 748 . 10 1 1 A 59 59 GLN N N 59 124.000 127.262 -3.262 1
1 750 . 10 1 1 A 60 60 LEU H H 60 5.320 8.397 -3.077 1
1 751 . 10 1 1 A 60 60 LEU HA H 60 4.370 4.866 -0.496 1
1 761 . 10 1 1 A 60 60 LEU CA C 60 52.800 53.405 -0.605 1
1 762 . 10 1 1 A 60 60 LEU CB C 60 46.700 45.166 1.534 1
1 766 . 10 1 1 A 60 60 LEU N N 60 121.800 126.486 -4.686 1
1 767 . 10 1 1 A 61 61 GLN H H 61 8.660 8.454 0.206 1
1 768 . 10 1 1 A 61 61 GLN HA H 61 4.440 4.717 -0.277 1
1 775 . 10 1 1 A 61 61 GLN C C 61 174.000 175.438 -1.438 1
1 776 . 10 1 1 A 61 61 GLN CA C 61 53.800 53.767 0.033 1
1 777 . 10 1 1 A 61 61 GLN CB C 61 31.800 31.311 0.489 1
1 780 . 10 1 1 A 61 61 GLN N N 61 120.300 120.577 -0.277 1
1 782 . 10 1 1 A 62 62 ASP H H 62 8.450 8.795 -0.345 1
1 783 . 10 1 1 A 62 62 ASP HA H 62 4.130 4.425 -0.295 1
1 786 . 10 1 1 A 62 62 ASP C C 62 177.200 176.930 0.270 1
1 787 . 10 1 1 A 62 62 ASP CA C 62 55.700 54.906 0.794 1
1 788 . 10 1 1 A 62 62 ASP CB C 62 39.400 41.135 -1.735 1
1 789 . 10 1 1 A 62 62 ASP N N 62 122.400 122.939 -0.539 1
1 790 . 10 1 1 A 63 63 SER H H 63 9.210 8.878 0.332 1
1 791 . 10 1 1 A 63 63 SER HA H 63 3.850 4.197 -0.347 1
1 794 . 10 1 1 A 63 63 SER C C 63 173.200 172.941 0.259 1
1 795 . 10 1 1 A 63 63 SER CA C 63 61.700 59.024 2.676 1
1 796 . 10 1 1 A 63 63 SER CB C 63 61.800 61.638 0.162 1
1 797 . 10 1 1 A 63 63 SER N N 63 114.300 118.109 -3.809 1
1 798 . 10 1 1 A 64 64 ASP H H 64 7.960 7.413 0.547 1
1 799 . 10 1 1 A 64 64 ASP HA H 64 4.540 5.313 -0.773 1
1 802 . 10 1 1 A 64 64 ASP C C 64 174.900 174.817 0.083 1
1 803 . 10 1 1 A 64 64 ASP CA C 64 54.900 52.897 2.003 1
1 804 . 10 1 1 A 64 64 ASP CB C 64 40.900 44.031 -3.131 1
1 805 . 10 1 1 A 64 64 ASP N N 64 122.600 119.370 3.230 1
1 806 . 10 1 1 A 65 65 VAL H H 65 8.180 8.649 -0.469 1
1 807 . 10 1 1 A 65 65 VAL HA H 65 4.670 4.505 0.165 1
1 815 . 10 1 1 A 65 65 VAL C C 65 175.900 175.829 0.071 1
1 816 . 10 1 1 A 65 65 VAL CA C 65 62.300 61.777 0.523 1
1 817 . 10 1 1 A 65 65 VAL CB C 65 31.700 32.219 -0.519 1
1 820 . 10 1 1 A 65 65 VAL N N 65 123.100 122.171 0.929 1
1 821 . 10 1 1 A 66 66 VAL H H 66 8.770 8.744 0.026 1
1 822 . 10 1 1 A 66 66 VAL HA H 66 5.160 5.067 0.093 1
1 830 . 10 1 1 A 66 66 VAL C C 66 173.600 173.340 0.260 1
1 831 . 10 1 1 A 66 66 VAL CA C 66 58.100 58.825 -0.725 1
1 832 . 10 1 1 A 66 66 VAL CB C 66 35.700 36.189 -0.489 1
1 835 . 10 1 1 A 66 66 VAL N N 66 118.100 121.895 -3.795 1
1 836 . 10 1 1 A 67 67 ARG H H 67 8.880 8.748 0.132 1
1 837 . 10 1 1 A 67 67 ARG HA H 67 5.110 5.022 0.088 1
1 845 . 10 1 1 A 67 67 ARG C C 67 175.300 174.801 0.499 1
1 846 . 10 1 1 A 67 67 ARG CA C 67 54.200 54.493 -0.293 1
1 847 . 10 1 1 A 67 67 ARG CB C 67 32.200 33.477 -1.277 1
1 851 . 10 1 1 A 67 67 ARG N N 67 120.200 121.765 -1.565 1
1 853 . 10 1 1 A 68 68 ILE H H 68 9.220 9.087 0.133 1
1 854 . 10 1 1 A 68 68 ILE HA H 68 4.990 4.755 0.235 1
1 864 . 10 1 1 A 68 68 ILE C C 68 174.900 174.975 -0.075 1
1 865 . 10 1 1 A 68 68 ILE CA C 68 58.600 60.006 -1.406 1
1 866 . 10 1 1 A 68 68 ILE CB C 68 39.300 38.417 0.883 1
1 870 . 10 1 1 A 68 68 ILE N N 68 127.200 127.964 -0.764 1
1 871 . 10 1 1 A 69 69 ASP H H 69 9.110 8.771 0.339 1
1 872 . 10 1 1 A 69 69 ASP HA H 69 5.370 5.479 -0.109 1
1 875 . 10 1 1 A 69 69 ASP C C 69 175.800 176.172 -0.372 1
1 876 . 10 1 1 A 69 69 ASP CA C 69 52.400 52.587 -0.187 1
1 877 . 10 1 1 A 69 69 ASP CB C 69 43.700 44.037 -0.337 1
1 878 . 10 1 1 A 69 69 ASP N N 69 123.400 127.080 -3.680 1
1 879 . 10 1 1 A 70 70 ASN H H 70 8.300 8.603 -0.303 1
1 880 . 10 1 1 A 70 70 ASN HA H 70 4.160 4.359 -0.199 1
1 885 . 10 1 1 A 70 70 ASN C C 70 176.300 174.422 1.878 1
1 886 . 10 1 1 A 70 70 ASN CA C 70 54.300 54.170 0.130 1
1 887 . 10 1 1 A 70 70 ASN CB C 70 37.500 37.681 -0.181 1
1 889 . 10 1 1 A 70 70 ASN N N 70 119.800 120.573 -0.773 1
1 891 . 10 1 1 A 71 71 ALA H H 71 9.100 7.655 1.445 1
1 892 . 10 1 1 A 71 71 ALA HA H 71 4.500 4.669 -0.169 1
1 896 . 10 1 1 A 71 71 ALA C C 71 175.700 178.127 -2.427 1
1 897 . 10 1 1 A 71 71 ALA CA C 71 51.900 51.459 0.441 1
1 898 . 10 1 1 A 71 71 ALA CB C 71 19.600 20.491 -0.891 1
1 899 . 10 1 1 A 71 71 ALA N N 71 123.000 120.491 2.509 1
1 900 . 10 1 1 A 72 72 ARG H H 72 8.490 8.533 -0.043 1
1 901 . 10 1 1 A 72 72 ARG HA H 72 4.720 5.150 -0.430 1
1 909 . 10 1 1 A 72 72 ARG C C 72 175.800 175.320 0.480 1
1 910 . 10 1 1 A 72 72 ARG CA C 72 54.400 54.929 -0.529 1
1 911 . 10 1 1 A 72 72 ARG CB C 72 32.700 32.596 0.104 1
1 915 . 10 1 1 A 72 72 ARG N N 72 122.500 120.047 2.453 1
1 917 . 10 1 1 A 73 73 VAL H H 73 8.310 8.023 0.287 1
1 918 . 10 1 1 A 73 73 VAL HA H 73 4.250 4.721 -0.471 1
1 926 . 10 1 1 A 73 73 VAL C C 73 174.600 174.698 -0.098 1
1 927 . 10 1 1 A 73 73 VAL CA C 73 62.800 61.124 1.676 1
1 928 . 10 1 1 A 73 73 VAL CB C 73 32.100 33.151 -1.051 1
1 931 . 10 1 1 A 73 73 VAL N N 73 127.100 122.559 4.541 1
1 932 . 10 1 1 A 74 74 ALA H H 74 8.880 8.722 0.158 1
1 933 . 10 1 1 A 74 74 ALA HA H 74 4.500 4.956 -0.456 1
1 937 . 10 1 1 A 74 74 ALA C C 74 174.800 174.657 0.143 1
1 938 . 10 1 1 A 74 74 ALA CA C 74 50.500 50.586 -0.086 1
1 939 . 10 1 1 A 74 74 ALA CB C 74 22.500 23.592 -1.092 1
1 940 . 10 1 1 A 74 74 ALA N N 74 131.000 128.368 2.632 1
1 941 . 10 1 1 A 75 75 GLN H H 75 8.280 8.390 -0.110 1
1 942 . 10 1 1 A 75 75 GLN HA H 75 4.910 5.028 -0.118 1
1 949 . 10 1 1 A 75 75 GLN C C 75 175.100 174.187 0.913 1
1 950 . 10 1 1 A 75 75 GLN CA C 75 54.600 54.019 0.581 1
1 951 . 10 1 1 A 75 75 GLN CB C 75 31.400 31.694 -0.294 1
1 954 . 10 1 1 A 75 75 GLN N N 75 118.800 120.530 -1.730 1
1 956 . 10 1 1 A 76 76 PHE H H 76 8.710 9.203 -0.493 1
1 957 . 10 1 1 A 76 76 PHE HA H 76 4.660 4.896 -0.236 1
1 965 . 10 1 1 A 76 76 PHE C C 76 174.900 176.189 -1.289 1
1 966 . 10 1 1 A 76 76 PHE CA C 76 57.000 56.578 0.422 1
1 967 . 10 1 1 A 76 76 PHE CB C 76 41.000 41.989 -0.989 1
1 973 . 10 1 1 A 76 76 PHE N N 76 125.000 125.680 -0.680 1
1 974 . 10 1 1 A 77 77 ASN H H 77 9.040 9.569 -0.529 1
1 975 . 10 1 1 A 77 77 ASN HA H 77 4.170 4.502 -0.332 1
1 980 . 10 1 1 A 77 77 ASN C C 77 174.200 174.705 -0.505 1
1 981 . 10 1 1 A 77 77 ASN CA C 77 53.800 54.191 -0.391 1
1 982 . 10 1 1 A 77 77 ASN CB C 77 37.400 37.608 -0.208 1
1 984 . 10 1 1 A 77 77 ASN N N 77 123.200 122.842 0.358 1
1 986 . 10 1 1 A 78 78 GLY H H 78 8.370 8.562 -0.192 1
1 987 . 10 1 1 A 78 78 GLY HA2 H 78 3.410 3.565 -0.155 1
1 988 . 10 1 1 A 78 78 GLY HA3 H 78 3.980 3.668 0.312 1
1 989 . 10 1 1 A 78 78 GLY C C 78 173.800 173.140 0.660 1
1 990 . 10 1 1 A 78 78 GLY CA C 78 45.000 45.264 -0.264 1
1 991 . 10 1 1 A 78 78 GLY N N 78 103.300 104.277 -0.977 1
1 992 . 10 1 1 A 79 79 TYR H H 79 7.670 8.125 -0.455 1
1 993 . 10 1 1 A 79 79 TYR HA H 79 4.860 4.942 -0.082 1
1 1000 . 10 1 1 A 79 79 TYR C C 79 174.800 175.513 -0.713 1
1 1001 . 10 1 1 A 79 79 TYR CA C 79 56.300 57.229 -0.929 1
1 1002 . 10 1 1 A 79 79 TYR CB C 79 40.800 41.276 -0.476 1
1 1007 . 10 1 1 A 79 79 TYR N N 79 118.700 119.044 -0.344 1
1 1008 . 10 1 1 A 80 80 LEU H H 80 8.760 8.693 0.067 1
1 1009 . 10 1 1 A 80 80 LEU HA H 80 4.830 4.409 0.421 1
1 1019 . 10 1 1 A 80 80 LEU C C 80 176.200 176.293 -0.093 1
1 1020 . 10 1 1 A 80 80 LEU CA C 80 54.700 55.113 -0.413 1
1 1021 . 10 1 1 A 80 80 LEU CB C 80 43.500 42.552 0.948 1
1 1025 . 10 1 1 A 80 80 LEU N N 80 122.600 125.653 -3.053 1
1 1026 . 10 1 1 A 81 81 SER H H 81 8.650 8.849 -0.199 1
1 1027 . 10 1 1 A 81 81 SER HA H 81 4.860 5.206 -0.346 1
1 1030 . 10 1 1 A 81 81 SER C C 81 172.600 172.704 -0.104 1
1 1031 . 10 1 1 A 81 81 SER CA C 81 56.600 57.384 -0.784 1
1 1032 . 10 1 1 A 81 81 SER CB C 81 66.300 66.378 -0.078 1
1 1033 . 10 1 1 A 81 81 SER N N 81 114.700 117.185 -2.485 1
1 1034 . 10 1 1 A 82 82 LEU H H 82 8.680 8.687 -0.007 1
1 1035 . 10 1 1 A 82 82 LEU HA H 82 5.190 5.019 0.171 1
1 1045 . 10 1 1 A 82 82 LEU C C 82 177.100 175.630 1.470 1
1 1046 . 10 1 1 A 82 82 LEU CA C 82 53.300 53.847 -0.547 1
1 1047 . 10 1 1 A 82 82 LEU CB C 82 43.800 42.696 1.104 1
1 1051 . 10 1 1 A 82 82 LEU N N 82 119.800 123.216 -3.416 1
1 1052 . 10 1 1 A 83 83 SER H H 83 9.560 8.808 0.752 1
1 1053 . 10 1 1 A 83 83 SER HA H 83 5.390 5.111 0.279 1
1 1056 . 10 1 1 A 83 83 SER C C 83 174.200 173.696 0.504 1
1 1057 . 10 1 1 A 83 83 SER CA C 83 57.100 58.744 -1.644 1
1 1058 . 10 1 1 A 83 83 SER CB C 83 64.400 64.386 0.014 1
1 1059 . 10 1 1 A 83 83 SER N N 83 119.000 121.576 -2.576 1
1 1060 . 10 1 1 A 84 84 VAL H H 84 9.150 8.863 0.287 1
1 1061 . 10 1 1 A 84 84 VAL HA H 84 4.490 4.827 -0.337 1
1 1069 . 10 1 1 A 84 84 VAL C C 84 174.700 176.032 -1.332 1
1 1070 . 10 1 1 A 84 84 VAL CA C 84 61.300 61.032 0.268 1
1 1071 . 10 1 1 A 84 84 VAL CB C 84 33.000 34.583 -1.583 1
1 1074 . 10 1 1 A 84 84 VAL N N 84 128.300 125.647 2.653 1
1 1075 . 10 1 1 A 85 85 GLY H H 85 7.970 9.018 -1.048 1
1 1076 . 10 1 1 A 85 85 GLY HA2 H 85 4.030 4.320 -0.290 1
1 1077 . 10 1 1 A 85 85 GLY HA3 H 85 4.840 4.446 0.394 1
1 1078 . 10 1 1 A 85 85 GLY C C 85 175.800 174.919 0.881 1
1 1079 . 10 1 1 A 85 85 GLY CA C 85 44.800 44.255 0.545 1
1 1080 . 10 1 1 A 85 85 GLY N N 85 114.300 115.279 -0.979 1
1 1081 . 10 1 1 A 86 86 ASP H H 86 8.860 8.813 0.047 1
1 1082 . 10 1 1 A 86 86 ASP HA H 86 4.370 4.397 -0.027 1
1 1085 . 10 1 1 A 86 86 ASP C C 86 177.400 177.434 -0.034 1
1 1086 . 10 1 1 A 86 86 ASP CA C 86 57.400 56.164 1.236 1
1 1087 . 10 1 1 A 86 86 ASP CB C 86 40.600 40.395 0.205 1
1 1088 . 10 1 1 A 86 86 ASP N N 86 122.500 119.890 2.610 1
1 1089 . 10 1 1 A 87 87 SER H H 87 8.540 7.866 0.674 1
1 1090 . 10 1 1 A 87 87 SER HA H 87 4.620 4.484 0.136 1
1 1093 . 10 1 1 A 87 87 SER C C 87 174.700 174.301 0.399 1
1 1094 . 10 1 1 A 87 87 SER CA C 87 58.200 58.779 -0.579 1
1 1095 . 10 1 1 A 87 87 SER CB C 87 63.300 63.650 -0.350 1
1 1096 . 10 1 1 A 87 87 SER N N 87 112.100 113.421 -1.321 1
1 1097 . 10 1 1 A 88 88 SER H H 88 7.880 7.557 0.323 1
1 1098 . 10 1 1 A 88 88 SER HA H 88 5.050 4.508 0.542 1
1 1101 . 10 1 1 A 88 88 SER C C 88 172.700 173.974 -1.274 1
1 1102 . 10 1 1 A 88 88 SER CA C 88 57.600 58.064 -0.464 1
1 1103 . 10 1 1 A 88 88 SER CB C 88 64.300 65.123 -0.823 1
1 1104 . 10 1 1 A 88 88 SER N N 88 119.200 115.804 3.396 1
1 1105 . 10 1 1 A 89 89 ARG H H 89 8.350 8.360 -0.010 1
1 1106 . 10 1 1 A 89 89 ARG HA H 89 4.720 5.102 -0.382 1
1 1114 . 10 1 1 A 89 89 ARG C C 89 174.200 174.727 -0.527 1
1 1115 . 10 1 1 A 89 89 ARG CA C 89 55.000 54.683 0.317 1
1 1116 . 10 1 1 A 89 89 ARG CB C 89 33.500 33.276 0.224 1
1 1120 . 10 1 1 A 89 89 ARG N N 89 122.800 122.347 0.453 1
1 1122 . 10 1 1 A 90 90 ILE H H 90 8.530 9.003 -0.473 1
1 1123 . 10 1 1 A 90 90 ILE HA H 90 4.790 5.163 -0.373 1
1 1133 . 10 1 1 A 90 90 ILE C C 90 175.400 175.180 0.220 1
1 1134 . 10 1 1 A 90 90 ILE CA C 90 60.600 60.196 0.404 1
1 1135 . 10 1 1 A 90 90 ILE CB C 90 40.600 40.809 -0.209 1
1 1139 . 10 1 1 A 90 90 ILE N N 90 123.100 126.617 -3.517 1
1 1140 . 10 1 1 A 91 91 GLU H H 91 9.000 8.690 0.310 1
1 1141 . 10 1 1 A 91 91 GLU HA H 91 4.730 4.982 -0.252 1
1 1146 . 10 1 1 A 91 91 GLU C C 91 175.100 175.507 -0.407 1
1 1147 . 10 1 1 A 91 91 GLU CA C 91 54.300 54.512 -0.212 1
1 1148 . 10 1 1 A 91 91 GLU CB C 91 32.400 32.425 -0.025 1
1 1150 . 10 1 1 A 91 91 GLU N N 91 126.400 127.059 -0.659 1
1 1151 . 10 1 1 A 92 92 SER H H 92 8.830 8.790 0.040 1
1 1152 . 10 1 1 A 92 92 SER HA H 92 4.700 4.693 0.007 1
1 1155 . 10 1 1 A 92 92 SER C C 92 174.600 174.376 0.224 1
1 1156 . 10 1 1 A 92 92 SER CA C 92 59.300 58.609 0.691 1
1 1157 . 10 1 1 A 92 92 SER CB C 92 63.100 63.782 -0.682 1
1 1158 . 10 1 1 A 92 92 SER N N 92 119.800 120.339 -0.539 1
1 1159 . 10 1 1 A 93 93 VAL H H 93 8.350 8.527 -0.177 1
1 1160 . 10 1 1 A 93 93 VAL HA H 93 4.290 4.887 -0.597 1
1 1168 . 10 1 1 A 93 93 VAL C C 93 175.100 174.532 0.568 1
1 1169 . 10 1 1 A 93 93 VAL CA C 93 61.300 59.659 1.641 1
1 1170 . 10 1 1 A 93 93 VAL CB C 93 33.900 34.545 -0.645 1
1 1173 . 10 1 1 A 93 93 VAL N N 93 121.800 119.752 2.048 1
1 1174 . 10 1 1 A 94 94 ASN H H 94 8.510 8.806 -0.296 1
1 1175 . 10 1 1 A 94 94 ASN HA H 94 4.770 4.785 -0.015 1
1 1180 . 10 1 1 A 94 94 ASN C C 94 175.000 175.497 -0.497 1
1 1181 . 10 1 1 A 94 94 ASN CA C 94 52.700 52.857 -0.157 1
1 1182 . 10 1 1 A 94 94 ASN CB C 94 38.500 39.593 -1.093 1
1 1184 . 10 1 1 A 94 94 ASN N N 94 121.800 124.136 -2.336 1
1 1186 . 10 1 1 A 95 95 VAL H H 95 7.860 8.756 -0.896 1
1 1187 . 10 1 1 A 95 95 VAL HA H 95 4.100 3.804 0.296 1
1 1195 . 10 1 1 A 95 95 VAL C C 95 175.100 174.896 0.204 1
1 1196 . 10 1 1 A 95 95 VAL CA C 95 61.700 64.745 -3.045 1
1 1197 . 10 1 1 A 95 95 VAL CB C 95 33.100 30.474 2.626 1
1 1200 . 10 1 1 A 95 95 VAL N N 95 119.700 119.308 0.392 1
1 1201 . 10 1 1 A 96 96 ASN H H 96 8.490 8.343 0.147 1
1 1202 . 10 1 1 A 96 96 ASN HA H 96 4.700 4.922 -0.222 1
1 1207 . 10 1 1 A 96 96 ASN C C 96 174.600 174.161 0.439 1
1 1208 . 10 1 1 A 96 96 ASN CA C 96 53.000 52.686 0.314 1
1 1209 . 10 1 1 A 96 96 ASN CB C 96 39.000 38.915 0.085 1
1 1211 . 10 1 1 A 96 96 ASN N N 96 122.200 120.407 1.793 1
1 1213 . 10 1 1 A 97 97 ILE H H 97 8.080 8.567 -0.487 1
1 1214 . 10 1 1 A 97 97 ILE HA H 97 4.370 3.728 0.642 1
1 1224 . 10 1 1 A 97 97 ILE CA C 97 58.600 61.868 -3.268 1
1 1225 . 10 1 1 A 97 97 ILE CB C 97 38.600 36.770 1.830 1
1 1229 . 10 1 1 A 97 97 ILE N N 97 123.500 124.848 -1.348 1
1 1230 . 10 1 1 A 98 98 PRO HA H 98 4.360 4.530 -0.170 1
1 1237 . 10 1 1 A 98 98 PRO C C 98 176.600 176.394 0.206 1
1 1238 . 10 1 1 A 98 98 PRO CA C 98 63.100 62.877 0.223 1
1 1239 . 10 1 1 A 98 98 PRO CB C 98 31.800 31.882 -0.082 1
1 1242 . 10 1 1 A 99 99 LEU H H 99 8.200 8.362 -0.162 1
1 1243 . 10 1 1 A 99 99 LEU HA H 99 4.200 4.359 -0.159 1
1 1253 . 10 1 1 A 99 99 LEU C C 99 177.300 177.152 0.148 1
1 1254 . 10 1 1 A 99 99 LEU CA C 99 55.000 55.515 -0.515 1
1 1255 . 10 1 1 A 99 99 LEU CB C 99 42.400 43.001 -0.601 1
1 1259 . 10 1 1 A 99 99 LEU N N 99 122.500 123.426 -0.926 1
1 1260 . 10 1 1 A 100 100 GLU H H 100 8.250 8.630 -0.380 1
1 1261 . 10 1 1 A 100 100 GLU HA H 100 4.140 4.496 -0.356 1
1 1266 . 10 1 1 A 100 100 GLU C C 100 176.100 175.813 0.287 1
1 1267 . 10 1 1 A 100 100 GLU CA C 100 56.100 56.587 -0.487 1
1 1268 . 10 1 1 A 100 100 GLU CB C 100 29.900 30.008 -0.108 1
1 1270 . 10 1 1 A 100 100 GLU N N 100 121.000 125.411 -4.411 1
1 1271 . 10 1 1 A 101 101 HIS H H 101 8.540 8.571 -0.031 1
1 1272 . 10 1 1 A 101 101 HIS HA H 101 4.600 5.113 -0.513 1
1 1275 . 10 1 1 A 101 101 HIS C C 101 174.200 172.577 1.623 1
1 1276 . 10 1 1 A 101 101 HIS CA C 101 55.200 55.695 -0.495 1
1 1277 . 10 1 1 A 101 101 HIS CB C 101 29.000 33.526 -4.526 1
1 1278 . 10 1 1 A 101 101 HIS N N 101 119.400 123.090 -3.690 1
1 1279 . 10 1 1 A 102 102 HIS H H 102 8.660 8.250 0.410 1
1 1280 . 10 1 1 A 102 102 HIS HA H 102 4.630 4.914 -0.284 1
1 1283 . 10 1 1 A 102 102 HIS C C 102 174.200 173.528 0.672 1
1 1284 . 10 1 1 A 102 102 HIS CA C 102 55.200 54.402 0.798 1
1 1285 . 10 1 1 A 102 102 HIS CB C 102 29.100 31.429 -2.329 1
1 1286 . 10 1 1 A 102 102 HIS N N 102 119.700 124.222 -4.522 1
1 1287 . 10 1 1 A 103 103 HIS H H 103 8.680 8.769 -0.089 1
1 1288 . 10 1 1 A 103 103 HIS HA H 103 4.640 4.662 -0.022 1
1 1291 . 10 1 1 A 103 103 HIS C C 103 174.200 174.305 -0.105 1
1 1292 . 10 1 1 A 103 103 HIS CA C 103 55.200 55.517 -0.317 1
1 1293 . 10 1 1 A 103 103 HIS CB C 103 29.200 32.590 -3.390 1
1 1294 . 10 1 1 A 103 103 HIS N N 103 120.500 121.710 -1.210 1
1 1295 . 10 1 1 A 104 104 HIS H H 104 8.580 8.028 0.552 1
1 1296 . 10 1 1 A 104 104 HIS HA H 104 4.590 3.758 0.832 1
1 1299 . 10 1 1 A 104 104 HIS C C 104 174.200 174.479 -0.279 1
1 1300 . 10 1 1 A 104 104 HIS CA C 104 55.200 56.699 -1.499 1
1 1301 . 10 1 1 A 104 104 HIS CB C 104 29.300 28.501 0.799 1
1 1302 . 10 1 1 A 104 104 HIS N N 104 120.700 123.425 -2.725 1
1 1303 . 10 1 1 A 105 105 HIS H H 105 8.550 8.417 0.133 1
1 1304 . 10 1 1 A 105 105 HIS HA H 105 4.610 4.333 0.277 1
1 1307 . 10 1 1 A 105 105 HIS C C 105 173.500 173.504 -0.004 1
1 1308 . 10 1 1 A 105 105 HIS CA C 105 55.400 56.343 -0.943 1
1 1309 . 10 1 1 A 105 105 HIS CB C 105 28.800 28.990 -0.190 1
1 1310 . 10 1 1 A 105 105 HIS N N 105 119.000 122.843 -3.843 1
1 7 . 11 1 1 A 2 2 ASP H H 2 8.890 8.755 0.135 1
1 8 . 11 1 1 A 2 2 ASP HA H 2 4.740 5.054 -0.314 1
1 11 . 11 1 1 A 2 2 ASP C C 2 174.600 174.328 0.272 1
1 12 . 11 1 1 A 2 2 ASP CA C 2 53.800 53.921 -0.121 1
1 13 . 11 1 1 A 2 2 ASP CB C 2 41.500 45.239 -3.739 1
1 14 . 11 1 1 A 2 2 ASP N N 2 122.100 121.278 0.822 1
1 15 . 11 1 1 A 3 3 LEU H H 3 8.280 8.503 -0.223 1
1 16 . 11 1 1 A 3 3 LEU HA H 3 4.420 4.794 -0.374 1
1 26 . 11 1 1 A 3 3 LEU C C 3 176.900 175.960 0.940 1
1 27 . 11 1 1 A 3 3 LEU CA C 3 55.000 55.777 -0.777 1
1 28 . 11 1 1 A 3 3 LEU CB C 3 42.700 42.383 0.317 1
1 32 . 11 1 1 A 3 3 LEU N N 3 122.300 126.699 -4.399 1
1 33 . 11 1 1 A 4 4 VAL H H 4 8.640 8.662 -0.022 1
1 34 . 11 1 1 A 4 4 VAL HA H 4 4.540 4.936 -0.396 1
1 42 . 11 1 1 A 4 4 VAL C C 4 175.800 174.851 0.949 1
1 43 . 11 1 1 A 4 4 VAL CA C 4 59.400 58.598 0.802 1
1 44 . 11 1 1 A 4 4 VAL CB C 4 35.400 35.820 -0.420 1
1 47 . 11 1 1 A 4 4 VAL N N 4 122.600 119.438 3.162 1
1 48 . 11 1 1 A 5 5 LYS H H 5 8.630 8.632 -0.002 1
1 49 . 11 1 1 A 5 5 LYS HA H 5 4.450 4.360 0.090 1
1 58 . 11 1 1 A 5 5 LYS C C 5 179.400 178.460 0.940 1
1 59 . 11 1 1 A 5 5 LYS CA C 5 53.600 56.010 -2.410 1
1 60 . 11 1 1 A 5 5 LYS CB C 5 30.900 33.246 -2.346 1
1 64 . 11 1 1 A 5 5 LYS N N 5 121.100 121.912 -0.812 1
1 65 . 11 1 1 A 6 6 ILE H H 6 10.320 8.400 1.920 1
1 66 . 11 1 1 A 6 6 ILE HA H 6 3.440 3.706 -0.266 1
1 76 . 11 1 1 A 6 6 ILE C C 6 178.300 177.971 0.329 1
1 77 . 11 1 1 A 6 6 ILE CA C 6 65.700 64.993 0.707 1
1 78 . 11 1 1 A 6 6 ILE CB C 6 35.900 37.701 -1.801 1
1 82 . 11 1 1 A 6 6 ILE N N 6 125.400 122.406 2.994 1
1 83 . 11 1 1 A 7 7 ARG H H 7 8.210 8.037 0.173 1
1 84 . 11 1 1 A 7 7 ARG HA H 7 3.850 4.087 -0.237 1
1 92 . 11 1 1 A 7 7 ARG C C 7 175.600 177.197 -1.597 1
1 93 . 11 1 1 A 7 7 ARG CA C 7 57.800 58.883 -1.083 1
1 94 . 11 1 1 A 7 7 ARG CB C 7 30.300 29.781 0.519 1
1 98 . 11 1 1 A 7 7 ARG N N 7 118.800 121.391 -2.591 1
1 100 . 11 1 1 A 8 8 ASP H H 8 7.850 7.614 0.236 1
1 101 . 11 1 1 A 8 8 ASP HA H 8 4.700 4.745 -0.045 1
1 104 . 11 1 1 A 8 8 ASP C C 8 176.100 176.346 -0.246 1
1 105 . 11 1 1 A 8 8 ASP CA C 8 54.100 54.248 -0.148 1
1 106 . 11 1 1 A 8 8 ASP CB C 8 41.200 41.501 -0.301 1
1 107 . 11 1 1 A 8 8 ASP N N 8 116.800 117.292 -0.492 1
1 108 . 11 1 1 A 9 9 VAL H H 9 7.240 7.293 -0.053 1
1 109 . 11 1 1 A 9 9 VAL HA H 9 3.710 3.960 -0.250 1
1 117 . 11 1 1 A 9 9 VAL C C 9 174.900 175.642 -0.742 1
1 118 . 11 1 1 A 9 9 VAL CA C 9 64.300 63.188 1.112 1
1 119 . 11 1 1 A 9 9 VAL CB C 9 31.500 31.847 -0.347 1
1 122 . 11 1 1 A 9 9 VAL N N 9 121.800 122.231 -0.431 1
1 123 . 11 1 1 A 10 10 SER H H 10 8.600 8.492 0.108 1
1 124 . 11 1 1 A 10 10 SER HA H 10 4.600 4.675 -0.075 1
1 127 . 11 1 1 A 10 10 SER CA C 10 56.700 56.907 -0.207 1
1 128 . 11 1 1 A 10 10 SER CB C 10 66.100 65.525 0.575 1
1 129 . 11 1 1 A 10 10 SER N N 10 122.200 120.877 1.323 1
1 130 . 11 1 1 A 11 11 LEU H H 11 8.660 8.993 -0.333 1
1 131 . 11 1 1 A 11 11 LEU HA H 11 3.900 4.061 -0.161 1
1 141 . 11 1 1 A 11 11 LEU C C 11 178.100 179.035 -0.935 1
1 142 . 11 1 1 A 11 11 LEU CA C 11 56.700 57.276 -0.576 1
1 143 . 11 1 1 A 11 11 LEU CB C 11 41.400 41.518 -0.118 1
1 147 . 11 1 1 A 11 11 LEU N N 11 120.300 123.234 -2.934 1
1 148 . 11 1 1 A 12 12 SER H H 12 8.160 8.102 0.058 1
1 149 . 11 1 1 A 12 12 SER HA H 12 4.270 4.283 -0.013 1
1 152 . 11 1 1 A 12 12 SER C C 12 174.200 174.892 -0.692 1
1 153 . 11 1 1 A 12 12 SER CA C 12 59.900 60.625 -0.725 1
1 154 . 11 1 1 A 12 12 SER CB C 12 63.100 62.805 0.295 1
1 155 . 11 1 1 A 12 12 SER N N 12 112.100 113.842 -1.742 1
1 156 . 11 1 1 A 13 13 THR H H 13 7.460 7.601 -0.141 1
1 157 . 11 1 1 A 13 13 THR HA H 13 4.760 4.714 0.046 1
1 162 . 11 1 1 A 13 13 THR CA C 13 56.600 58.962 -2.362 1
1 163 . 11 1 1 A 13 13 THR CB C 13 70.100 68.981 1.119 1
1 165 . 11 1 1 A 13 13 THR N N 13 114.700 108.797 5.903 1
1 166 . 11 1 1 A 14 14 PRO HA H 14 4.050 4.273 -0.223 1
1 173 . 11 1 1 A 14 14 PRO C C 14 175.800 175.917 -0.117 1
1 174 . 11 1 1 A 14 14 PRO CA C 14 65.100 64.770 0.330 1
1 175 . 11 1 1 A 14 14 PRO CB C 14 32.100 31.450 0.650 1
1 178 . 11 1 1 A 15 15 TYR H H 15 7.380 7.702 -0.322 1
1 179 . 11 1 1 A 15 15 TYR HA H 15 5.570 5.589 -0.019 1
1 186 . 11 1 1 A 15 15 TYR C C 15 176.100 175.198 0.902 1
1 187 . 11 1 1 A 15 15 TYR CA C 15 56.400 56.892 -0.492 1
1 188 . 11 1 1 A 15 15 TYR CB C 15 41.500 41.229 0.271 1
1 193 . 11 1 1 A 15 15 TYR N N 15 113.800 117.306 -3.506 1
1 194 . 11 1 1 A 16 16 VAL H H 16 9.010 8.754 0.256 1
1 195 . 11 1 1 A 16 16 VAL HA H 16 4.920 5.005 -0.085 1
1 203 . 11 1 1 A 16 16 VAL C C 16 174.300 174.239 0.061 1
1 204 . 11 1 1 A 16 16 VAL CA C 16 59.600 59.431 0.169 1
1 205 . 11 1 1 A 16 16 VAL CB C 16 36.800 36.188 0.612 1
1 208 . 11 1 1 A 16 16 VAL N N 16 113.800 117.478 -3.678 1
1 209 . 11 1 1 A 17 17 SER H H 17 7.960 8.517 -0.557 1
1 210 . 11 1 1 A 17 17 SER HA H 17 5.860 5.550 0.310 1
1 213 . 11 1 1 A 17 17 SER C C 17 172.700 173.848 -1.148 1
1 214 . 11 1 1 A 17 17 SER CA C 17 57.300 57.364 -0.064 1
1 215 . 11 1 1 A 17 17 SER CB C 17 64.000 65.319 -1.319 1
1 216 . 11 1 1 A 17 17 SER N N 17 117.100 117.255 -0.155 1
1 217 . 11 1 1 A 18 18 VAL H H 18 8.570 8.953 -0.383 1
1 218 . 11 1 1 A 18 18 VAL HA H 18 4.900 5.172 -0.272 1
1 226 . 11 1 1 A 18 18 VAL C C 18 173.700 173.824 -0.124 1
1 227 . 11 1 1 A 18 18 VAL CA C 18 58.800 59.056 -0.256 1
1 228 . 11 1 1 A 18 18 VAL CB C 18 36.700 36.097 0.603 1
1 231 . 11 1 1 A 18 18 VAL N N 18 113.500 119.382 -5.882 1
1 232 . 11 1 1 A 19 19 ILE H H 19 8.490 8.628 -0.138 1
1 233 . 11 1 1 A 19 19 ILE HA H 19 5.300 4.948 0.352 1
1 243 . 11 1 1 A 19 19 ILE C C 19 175.800 174.725 1.075 1
1 244 . 11 1 1 A 19 19 ILE CA C 19 59.700 59.319 0.381 1
1 245 . 11 1 1 A 19 19 ILE CB C 19 41.700 42.329 -0.629 1
1 249 . 11 1 1 A 19 19 ILE N N 19 120.600 121.433 -0.833 1
1 250 . 11 1 1 A 20 20 GLY H H 20 8.670 8.226 0.444 1
1 251 . 11 1 1 A 20 20 GLY HA2 H 20 3.760 4.192 -0.432 1
1 252 . 11 1 1 A 20 20 GLY HA3 H 20 4.190 4.196 -0.006 1
1 253 . 11 1 1 A 20 20 GLY C C 20 169.900 171.647 -1.747 1
1 254 . 11 1 1 A 20 20 GLY CA C 20 46.000 45.959 0.041 1
1 255 . 11 1 1 A 20 20 GLY N N 20 110.200 112.806 -2.606 1
1 256 . 11 1 1 A 21 21 LYS H H 21 8.920 8.165 0.755 1
1 257 . 11 1 1 A 21 21 LYS HA H 21 5.210 4.975 0.235 1
1 266 . 11 1 1 A 21 21 LYS C C 21 176.400 175.413 0.987 1
1 267 . 11 1 1 A 21 21 LYS CA C 21 54.400 54.538 -0.138 1
1 268 . 11 1 1 A 21 21 LYS CB C 21 35.400 34.756 0.644 1
1 272 . 11 1 1 A 21 21 LYS N N 21 119.100 120.846 -1.746 1
1 273 . 11 1 1 A 22 22 ILE H H 22 8.900 8.329 0.571 1
1 274 . 11 1 1 A 22 22 ILE HA H 22 5.050 4.953 0.097 1
1 284 . 11 1 1 A 22 22 ILE C C 22 176.900 175.257 1.643 1
1 285 . 11 1 1 A 22 22 ILE CA C 22 57.800 60.310 -2.510 1
1 286 . 11 1 1 A 22 22 ILE CB C 22 36.200 39.359 -3.159 1
1 290 . 11 1 1 A 22 22 ILE N N 22 130.000 122.776 7.224 1
1 291 . 11 1 1 A 23 23 THR H H 23 9.020 8.873 0.147 1
1 292 . 11 1 1 A 23 23 THR HA H 23 4.660 5.109 -0.449 1
1 297 . 11 1 1 A 23 23 THR C C 23 174.000 174.522 -0.522 1
1 298 . 11 1 1 A 23 23 THR CA C 23 60.800 59.884 0.916 1
1 299 . 11 1 1 A 23 23 THR CB C 23 73.400 71.637 1.763 1
1 301 . 11 1 1 A 23 23 THR N N 23 118.200 117.670 0.530 1
1 302 . 11 1 1 A 24 24 GLY H H 24 8.430 8.480 -0.050 1
1 303 . 11 1 1 A 24 24 GLY HA2 H 24 3.910 4.058 -0.148 1
1 304 . 11 1 1 A 24 24 GLY HA3 H 24 3.910 4.218 -0.308 1
1 305 . 11 1 1 A 24 24 GLY C C 24 175.400 174.586 0.814 1
1 306 . 11 1 1 A 24 24 GLY CA C 24 47.100 45.685 1.415 1
1 307 . 11 1 1 A 24 24 GLY N N 24 107.200 109.463 -2.263 1
1 308 . 11 1 1 A 25 25 ILE H H 25 9.370 8.104 1.266 1
1 309 . 11 1 1 A 25 25 ILE HA H 25 4.480 3.867 0.613 1
1 319 . 11 1 1 A 25 25 ILE C C 25 178.200 174.574 3.626 1
1 320 . 11 1 1 A 25 25 ILE CA C 25 59.200 61.794 -2.594 1
1 321 . 11 1 1 A 25 25 ILE CB C 25 35.400 36.838 -1.438 1
1 325 . 11 1 1 A 25 25 ILE N N 25 120.600 119.733 0.867 1
1 326 . 11 1 1 A 26 26 HIS H H 26 9.000 9.010 -0.010 1
1 327 . 11 1 1 A 26 26 HIS HA H 26 4.770 4.930 -0.160 1
1 330 . 11 1 1 A 26 26 HIS C C 26 172.700 173.675 -0.975 1
1 331 . 11 1 1 A 26 26 HIS CA C 26 55.000 54.390 0.610 1
1 332 . 11 1 1 A 26 26 HIS CB C 26 31.100 33.364 -2.264 1
1 333 . 11 1 1 A 26 26 HIS N N 26 123.800 125.213 -1.413 1
1 334 . 11 1 1 A 27 27 LYS H H 27 8.930 8.958 -0.028 1
1 335 . 11 1 1 A 27 27 LYS HA H 27 4.770 4.445 0.325 1
1 344 . 11 1 1 A 27 27 LYS C C 27 175.300 175.342 -0.042 1
1 345 . 11 1 1 A 27 27 LYS CA C 27 55.100 55.688 -0.588 1
1 346 . 11 1 1 A 27 27 LYS CB C 27 34.400 33.488 0.912 1
1 350 . 11 1 1 A 27 27 LYS N N 27 125.900 124.253 1.647 1
1 351 . 11 1 1 A 28 28 LYS H H 28 8.880 8.145 0.735 1
1 352 . 11 1 1 A 28 28 LYS HA H 28 4.570 4.881 -0.311 1
1 361 . 11 1 1 A 28 28 LYS C C 28 174.500 173.791 0.709 1
1 362 . 11 1 1 A 28 28 LYS CA C 28 54.600 54.972 -0.372 1
1 363 . 11 1 1 A 28 28 LYS CB C 28 35.300 36.700 -1.400 1
1 367 . 11 1 1 A 28 28 LYS N N 28 127.400 126.376 1.024 1
1 368 . 11 1 1 A 29 29 GLU H H 29 8.440 8.502 -0.062 1
1 369 . 11 1 1 A 29 29 GLU HA H 29 5.260 5.171 0.089 1
1 374 . 11 1 1 A 29 29 GLU C C 29 175.800 175.794 0.006 1
1 375 . 11 1 1 A 29 29 GLU CA C 29 54.800 55.055 -0.255 1
1 376 . 11 1 1 A 29 29 GLU CB C 29 31.500 32.919 -1.419 1
1 378 . 11 1 1 A 29 29 GLU N N 29 122.200 124.748 -2.548 1
1 379 . 11 1 1 A 30 30 TYR H H 30 8.960 8.663 0.297 1
1 380 . 11 1 1 A 30 30 TYR HA H 30 4.820 5.240 -0.420 1
1 387 . 11 1 1 A 30 30 TYR C C 30 172.600 173.152 -0.552 1
1 388 . 11 1 1 A 30 30 TYR CA C 30 56.300 55.759 0.541 1
1 389 . 11 1 1 A 30 30 TYR CB C 30 40.500 41.273 -0.773 1
1 394 . 11 1 1 A 30 30 TYR N N 30 121.100 118.795 2.305 1
1 395 . 11 1 1 A 31 31 GLU H H 31 8.610 8.601 0.009 1
1 396 . 11 1 1 A 31 31 GLU HA H 31 4.810 4.516 0.294 1
1 401 . 11 1 1 A 31 31 GLU C C 31 176.100 175.358 0.742 1
1 402 . 11 1 1 A 31 31 GLU CA C 31 55.100 55.965 -0.865 1
1 403 . 11 1 1 A 31 31 GLU CB C 31 30.300 30.421 -0.121 1
1 405 . 11 1 1 A 31 31 GLU N N 31 121.800 120.110 1.690 1
1 406 . 11 1 1 A 32 32 SER H H 32 8.570 8.998 -0.428 1
1 407 . 11 1 1 A 32 32 SER HA H 32 4.520 4.817 -0.297 1
1 410 . 11 1 1 A 32 32 SER C C 32 174.300 172.980 1.320 1
1 411 . 11 1 1 A 32 32 SER CA C 32 57.300 57.420 -0.120 1
1 412 . 11 1 1 A 32 32 SER CB C 32 64.100 65.830 -1.730 1
1 413 . 11 1 1 A 32 32 SER N N 32 118.500 116.409 2.091 1
1 414 . 11 1 1 A 33 33 ASP H H 33 9.290 9.421 -0.131 1
1 415 . 11 1 1 A 33 33 ASP HA H 33 4.340 4.342 -0.002 1
1 418 . 11 1 1 A 33 33 ASP C C 33 175.900 176.320 -0.420 1
1 419 . 11 1 1 A 33 33 ASP CA C 33 55.000 55.353 -0.353 1
1 420 . 11 1 1 A 33 33 ASP CB C 33 39.300 39.509 -0.209 1
1 421 . 11 1 1 A 33 33 ASP N N 33 125.700 128.979 -3.279 1
1 422 . 11 1 1 A 34 34 GLY H H 34 8.690 8.601 0.089 1
1 423 . 11 1 1 A 34 34 GLY HA2 H 34 3.660 3.810 -0.150 1
1 424 . 11 1 1 A 34 34 GLY HA3 H 34 4.140 3.813 0.327 1
1 425 . 11 1 1 A 34 34 GLY C C 34 174.200 173.574 0.626 1
1 426 . 11 1 1 A 34 34 GLY CA C 34 45.600 45.711 -0.111 1
1 427 . 11 1 1 A 34 34 GLY N N 34 104.800 104.765 0.035 1
1 428 . 11 1 1 A 35 35 THR H H 35 7.840 7.775 0.065 1
1 429 . 11 1 1 A 35 35 THR HA H 35 4.660 4.946 -0.286 1
1 434 . 11 1 1 A 35 35 THR C C 35 173.000 172.997 0.003 1
1 435 . 11 1 1 A 35 35 THR CA C 35 60.200 59.261 0.939 1
1 436 . 11 1 1 A 35 35 THR CB C 35 71.200 72.445 -1.245 1
1 438 . 11 1 1 A 35 35 THR N N 35 114.800 109.868 4.932 1
1 439 . 11 1 1 A 36 36 THR H H 36 8.480 8.609 -0.129 1
1 440 . 11 1 1 A 36 36 THR HA H 36 4.620 4.596 0.024 1
1 445 . 11 1 1 A 36 36 THR C C 36 173.800 174.153 -0.353 1
1 446 . 11 1 1 A 36 36 THR CA C 36 62.300 62.349 -0.049 1
1 447 . 11 1 1 A 36 36 THR CB C 36 69.500 69.365 0.135 1
1 449 . 11 1 1 A 36 36 THR N N 36 119.400 120.391 -0.991 1
1 450 . 11 1 1 A 37 37 LYS H H 37 8.880 8.407 0.473 1
1 451 . 11 1 1 A 37 37 LYS HA H 37 4.570 4.844 -0.274 1
1 460 . 11 1 1 A 37 37 LYS C C 37 174.500 176.275 -1.775 1
1 461 . 11 1 1 A 37 37 LYS CA C 37 54.600 54.015 0.585 1
1 462 . 11 1 1 A 37 37 LYS CB C 37 35.500 36.136 -0.636 1
1 466 . 11 1 1 A 37 37 LYS N N 37 128.000 125.044 2.956 1
1 467 . 11 1 1 A 38 38 SER H H 38 8.370 8.783 -0.413 1
1 468 . 11 1 1 A 38 38 SER HA H 38 5.250 5.060 0.190 1
1 471 . 11 1 1 A 38 38 SER C C 38 173.200 173.782 -0.582 1
1 472 . 11 1 1 A 38 38 SER CA C 38 57.900 57.677 0.223 1
1 473 . 11 1 1 A 38 38 SER CB C 38 65.500 64.617 0.883 1
1 474 . 11 1 1 A 38 38 SER N N 38 114.300 117.518 -3.218 1
1 475 . 11 1 1 A 39 39 VAL H H 39 9.020 8.745 0.275 1
1 476 . 11 1 1 A 39 39 VAL HA H 39 4.900 4.866 0.034 1
1 484 . 11 1 1 A 39 39 VAL C C 39 173.200 172.941 0.259 1
1 485 . 11 1 1 A 39 39 VAL CA C 39 59.200 59.822 -0.622 1
1 486 . 11 1 1 A 39 39 VAL CB C 39 34.600 35.564 -0.964 1
1 489 . 11 1 1 A 39 39 VAL N N 39 123.600 120.399 3.201 1
1 490 . 11 1 1 A 40 40 TYR H H 40 8.900 8.806 0.094 1
1 491 . 11 1 1 A 40 40 TYR HA H 40 4.730 5.398 -0.668 1
1 498 . 11 1 1 A 40 40 TYR CA C 40 56.500 56.889 -0.389 1
1 499 . 11 1 1 A 40 40 TYR CB C 40 39.000 40.481 -1.481 1
1 504 . 11 1 1 A 40 40 TYR N N 40 126.300 126.741 -0.441 1
1 505 . 11 1 1 A 41 41 GLN H H 41 8.630 8.556 0.074 1
1 506 . 11 1 1 A 41 41 GLN HA H 41 5.330 5.130 0.200 1
1 513 . 11 1 1 A 41 41 GLN C C 41 175.500 175.701 -0.201 1
1 514 . 11 1 1 A 41 41 GLN CA C 41 53.800 54.156 -0.356 1
1 515 . 11 1 1 A 41 41 GLN CB C 41 32.100 31.920 0.180 1
1 518 . 11 1 1 A 41 41 GLN N N 41 122.000 121.816 0.184 1
1 520 . 11 1 1 A 42 42 GLY H H 42 8.560 7.923 0.637 1
1 521 . 11 1 1 A 42 42 GLY HA2 H 42 3.680 4.382 -0.702 1
1 522 . 11 1 1 A 42 42 GLY HA3 H 42 4.020 4.479 -0.459 1
1 523 . 11 1 1 A 42 42 GLY C C 42 171.600 171.047 0.553 1
1 524 . 11 1 1 A 42 42 GLY CA C 42 47.300 46.184 1.116 1
1 525 . 11 1 1 A 42 42 GLY N N 42 113.000 108.913 4.087 1
1 526 . 11 1 1 A 43 43 TYR H H 43 9.320 8.867 0.453 1
1 527 . 11 1 1 A 43 43 TYR HA H 43 5.280 5.412 -0.132 1
1 534 . 11 1 1 A 43 43 TYR C C 43 173.200 174.206 -1.006 1
1 535 . 11 1 1 A 43 43 TYR CA C 43 57.600 56.455 1.145 1
1 536 . 11 1 1 A 43 43 TYR CB C 43 42.400 42.984 -0.584 1
1 541 . 11 1 1 A 43 43 TYR N N 43 126.300 118.250 8.050 1
1 542 . 11 1 1 A 44 44 ILE H H 44 9.160 8.875 0.285 1
1 543 . 11 1 1 A 44 44 ILE HA H 44 5.270 5.411 -0.141 1
1 553 . 11 1 1 A 44 44 ILE C C 44 172.900 173.147 -0.247 1
1 554 . 11 1 1 A 44 44 ILE CA C 44 59.000 59.265 -0.265 1
1 555 . 11 1 1 A 44 44 ILE CB C 44 42.200 40.743 1.457 1
1 559 . 11 1 1 A 44 44 ILE N N 44 117.700 123.656 -5.956 1
1 560 . 11 1 1 A 45 45 GLU H H 45 8.420 8.693 -0.273 1
1 561 . 11 1 1 A 45 45 GLU HA H 45 5.600 5.423 0.177 1
1 566 . 11 1 1 A 45 45 GLU C C 45 174.300 174.661 -0.361 1
1 567 . 11 1 1 A 45 45 GLU CA C 45 54.000 54.505 -0.505 1
1 568 . 11 1 1 A 45 45 GLU CB C 45 34.400 33.414 0.986 1
1 570 . 11 1 1 A 45 45 GLU N N 45 123.600 130.470 -6.870 1
1 571 . 11 1 1 A 46 46 ASP H H 46 8.530 8.569 -0.039 1
1 572 . 11 1 1 A 46 46 ASP HA H 46 5.070 4.949 0.121 1
1 575 . 11 1 1 A 46 46 ASP C C 46 175.000 175.792 -0.792 1
1 576 . 11 1 1 A 46 46 ASP CA C 46 51.800 53.029 -1.229 1
1 577 . 11 1 1 A 46 46 ASP CB C 46 41.300 41.313 -0.013 1
1 578 . 11 1 1 A 46 46 ASP N N 46 125.500 123.442 2.058 1
1 579 . 11 1 1 A 47 47 ASP H H 47 9.160 8.727 0.433 1
1 580 . 11 1 1 A 47 47 ASP HA H 47 4.430 4.634 -0.204 1
1 583 . 11 1 1 A 47 47 ASP C C 47 176.000 177.045 -1.045 1
1 584 . 11 1 1 A 47 47 ASP CA C 47 55.000 55.861 -0.861 1
1 585 . 11 1 1 A 47 47 ASP CB C 47 38.900 40.766 -1.866 1
1 586 . 11 1 1 A 47 47 ASP N N 47 114.200 116.940 -2.740 1
1 587 . 11 1 1 A 48 48 THR H H 48 9.470 8.354 1.116 1
1 588 . 11 1 1 A 48 48 THR HA H 48 4.520 4.571 -0.051 1
1 593 . 11 1 1 A 48 48 THR C C 48 174.500 174.142 0.358 1
1 594 . 11 1 1 A 48 48 THR CA C 48 62.600 61.863 0.737 1
1 595 . 11 1 1 A 48 48 THR CB C 48 70.400 69.429 0.971 1
1 597 . 11 1 1 A 48 48 THR N N 48 111.800 107.753 4.047 1
1 598 . 11 1 1 A 49 49 ALA H H 49 7.850 7.861 -0.011 1
1 599 . 11 1 1 A 49 49 ALA HA H 49 4.440 4.662 -0.222 1
1 603 . 11 1 1 A 49 49 ALA C C 49 173.200 175.681 -2.481 1
1 604 . 11 1 1 A 49 49 ALA CA C 49 52.700 50.782 1.918 1
1 605 . 11 1 1 A 49 49 ALA CB C 49 21.300 20.667 0.633 1
1 606 . 11 1 1 A 49 49 ALA N N 49 123.400 121.657 1.743 1
1 607 . 11 1 1 A 50 50 ARG H H 50 8.160 9.026 -0.866 1
1 608 . 11 1 1 A 50 50 ARG HA H 50 5.350 5.564 -0.214 1
1 616 . 11 1 1 A 50 50 ARG C C 50 174.700 174.081 0.619 1
1 617 . 11 1 1 A 50 50 ARG CA C 50 54.000 54.504 -0.504 1
1 618 . 11 1 1 A 50 50 ARG CB C 50 34.500 34.299 0.201 1
1 622 . 11 1 1 A 50 50 ARG N N 50 117.400 114.493 2.907 1
1 624 . 11 1 1 A 51 51 ILE H H 51 9.390 8.735 0.655 1
1 625 . 11 1 1 A 51 51 ILE HA H 51 4.790 5.051 -0.261 1
1 635 . 11 1 1 A 51 51 ILE C C 51 172.600 173.261 -0.661 1
1 636 . 11 1 1 A 51 51 ILE CA C 51 60.000 59.185 0.815 1
1 637 . 11 1 1 A 51 51 ILE CB C 51 42.800 42.205 0.595 1
1 641 . 11 1 1 A 51 51 ILE N N 51 124.600 120.998 3.602 1
1 642 . 11 1 1 A 52 52 ARG H H 52 7.980 8.617 -0.637 1
1 643 . 11 1 1 A 52 52 ARG HA H 52 4.170 4.108 0.062 1
1 651 . 11 1 1 A 52 52 ARG C C 52 174.600 175.874 -1.274 1
1 652 . 11 1 1 A 52 52 ARG CA C 52 57.100 56.309 0.791 1
1 653 . 11 1 1 A 52 52 ARG CB C 52 31.300 30.874 0.426 1
1 657 . 11 1 1 A 52 52 ARG N N 52 125.900 129.711 -3.811 1
1 659 . 11 1 1 A 53 53 ILE H H 53 8.290 8.401 -0.111 1
1 660 . 11 1 1 A 53 53 ILE HA H 53 5.160 5.055 0.105 1
1 670 . 11 1 1 A 53 53 ILE C C 53 172.400 174.108 -1.708 1
1 671 . 11 1 1 A 53 53 ILE CA C 53 58.600 58.782 -0.182 1
1 672 . 11 1 1 A 53 53 ILE CB C 53 41.900 42.544 -0.644 1
1 676 . 11 1 1 A 53 53 ILE N N 53 118.500 120.528 -2.028 1
1 677 . 11 1 1 A 54 54 SER H H 54 8.350 8.538 -0.188 1
1 678 . 11 1 1 A 54 54 SER HA H 54 5.070 5.312 -0.242 1
1 681 . 11 1 1 A 54 54 SER C C 54 172.400 172.896 -0.496 1
1 682 . 11 1 1 A 54 54 SER CA C 54 57.000 57.017 -0.017 1
1 683 . 11 1 1 A 54 54 SER CB C 54 65.900 66.412 -0.512 1
1 684 . 11 1 1 A 54 54 SER N N 54 120.700 116.164 4.536 1
1 685 . 11 1 1 A 55 55 SER H H 55 9.130 8.620 0.510 1
1 686 . 11 1 1 A 55 55 SER HA H 55 5.270 5.431 -0.161 1
1 690 . 11 1 1 A 55 55 SER C C 55 174.400 172.688 1.712 1
1 691 . 11 1 1 A 55 55 SER CA C 55 55.500 56.618 -1.118 1
1 692 . 11 1 1 A 55 55 SER CB C 55 64.500 66.050 -1.550 1
1 693 . 11 1 1 A 55 55 SER N N 55 117.200 115.633 1.567 1
1 694 . 11 1 1 A 56 56 PHE H H 56 8.970 8.719 0.251 1
1 695 . 11 1 1 A 56 56 PHE HA H 56 4.600 4.637 -0.037 1
1 703 . 11 1 1 A 56 56 PHE C C 56 176.500 177.150 -0.650 1
1 704 . 11 1 1 A 56 56 PHE CA C 56 58.300 57.716 0.584 1
1 705 . 11 1 1 A 56 56 PHE CB C 56 37.900 39.875 -1.975 1
1 711 . 11 1 1 A 56 56 PHE N N 56 129.400 123.801 5.599 1
1 712 . 11 1 1 A 57 57 GLY H H 57 8.570 8.758 -0.188 1
1 713 . 11 1 1 A 57 57 GLY HA2 H 57 4.020 4.144 -0.124 1
1 714 . 11 1 1 A 57 57 GLY HA3 H 57 4.380 4.164 0.216 1
1 715 . 11 1 1 A 57 57 GLY C C 57 173.700 174.270 -0.570 1
1 716 . 11 1 1 A 57 57 GLY CA C 57 46.300 45.695 0.605 1
1 717 . 11 1 1 A 57 57 GLY N N 57 112.500 112.040 0.460 1
1 718 . 11 1 1 A 58 58 LYS H H 58 6.800 8.423 -1.623 1
1 719 . 11 1 1 A 58 58 LYS HA H 58 4.410 4.366 0.044 1
1 728 . 11 1 1 A 58 58 LYS C C 58 174.800 175.581 -0.781 1
1 729 . 11 1 1 A 58 58 LYS CA C 58 55.200 56.498 -1.298 1
1 730 . 11 1 1 A 58 58 LYS CB C 58 33.300 33.451 -0.151 1
1 734 . 11 1 1 A 58 58 LYS N N 58 118.700 121.182 -2.482 1
1 735 . 11 1 1 A 59 59 GLN H H 59 8.390 8.545 -0.155 1
1 736 . 11 1 1 A 59 59 GLN HA H 59 1.830 3.730 -1.900 1
1 743 . 11 1 1 A 59 59 GLN C C 59 174.100 174.216 -0.116 1
1 744 . 11 1 1 A 59 59 GLN CA C 59 57.100 54.290 2.810 1
1 745 . 11 1 1 A 59 59 GLN CB C 59 28.900 30.002 -1.102 1
1 748 . 11 1 1 A 59 59 GLN N N 59 124.000 123.037 0.963 1
1 750 . 11 1 1 A 60 60 LEU H H 60 5.320 8.113 -2.793 1
1 751 . 11 1 1 A 60 60 LEU HA H 60 4.370 4.953 -0.583 1
1 761 . 11 1 1 A 60 60 LEU CA C 60 52.800 53.528 -0.728 1
1 762 . 11 1 1 A 60 60 LEU CB C 60 46.700 45.626 1.074 1
1 766 . 11 1 1 A 60 60 LEU N N 60 121.800 124.017 -2.217 1
1 767 . 11 1 1 A 61 61 GLN H H 61 8.660 8.806 -0.146 1
1 768 . 11 1 1 A 61 61 GLN HA H 61 4.440 4.836 -0.396 1
1 775 . 11 1 1 A 61 61 GLN C C 61 174.000 174.638 -0.638 1
1 776 . 11 1 1 A 61 61 GLN CA C 61 53.800 54.059 -0.259 1
1 777 . 11 1 1 A 61 61 GLN CB C 61 31.800 31.944 -0.144 1
1 780 . 11 1 1 A 61 61 GLN N N 61 120.300 120.285 0.015 1
1 782 . 11 1 1 A 62 62 ASP H H 62 8.450 8.767 -0.317 1
1 783 . 11 1 1 A 62 62 ASP HA H 62 4.130 4.528 -0.398 1
1 786 . 11 1 1 A 62 62 ASP C C 62 177.200 176.847 0.353 1
1 787 . 11 1 1 A 62 62 ASP CA C 62 55.700 55.454 0.246 1
1 788 . 11 1 1 A 62 62 ASP CB C 62 39.400 40.730 -1.330 1
1 789 . 11 1 1 A 62 62 ASP N N 62 122.400 124.182 -1.782 1
1 790 . 11 1 1 A 63 63 SER H H 63 9.210 9.522 -0.312 1
1 791 . 11 1 1 A 63 63 SER HA H 63 3.850 4.108 -0.258 1
1 794 . 11 1 1 A 63 63 SER C C 63 173.200 173.334 -0.134 1
1 795 . 11 1 1 A 63 63 SER CA C 63 61.700 60.628 1.072 1
1 796 . 11 1 1 A 63 63 SER CB C 63 61.800 61.851 -0.051 1
1 797 . 11 1 1 A 63 63 SER N N 63 114.300 115.457 -1.157 1
1 798 . 11 1 1 A 64 64 ASP H H 64 7.960 7.718 0.242 1
1 799 . 11 1 1 A 64 64 ASP HA H 64 4.540 4.778 -0.238 1
1 802 . 11 1 1 A 64 64 ASP C C 64 174.900 175.940 -1.040 1
1 803 . 11 1 1 A 64 64 ASP CA C 64 54.900 54.478 0.422 1
1 804 . 11 1 1 A 64 64 ASP CB C 64 40.900 41.804 -0.904 1
1 805 . 11 1 1 A 64 64 ASP N N 64 122.600 121.389 1.211 1
1 806 . 11 1 1 A 65 65 VAL H H 65 8.180 8.639 -0.459 1
1 807 . 11 1 1 A 65 65 VAL HA H 65 4.670 4.484 0.186 1
1 815 . 11 1 1 A 65 65 VAL C C 65 175.900 175.629 0.271 1
1 816 . 11 1 1 A 65 65 VAL CA C 65 62.300 62.199 0.101 1
1 817 . 11 1 1 A 65 65 VAL CB C 65 31.700 31.688 0.012 1
1 820 . 11 1 1 A 65 65 VAL N N 65 123.100 122.877 0.223 1
1 821 . 11 1 1 A 66 66 VAL H H 66 8.770 8.853 -0.083 1
1 822 . 11 1 1 A 66 66 VAL HA H 66 5.160 5.117 0.043 1
1 830 . 11 1 1 A 66 66 VAL C C 66 173.600 173.331 0.269 1
1 831 . 11 1 1 A 66 66 VAL CA C 66 58.100 58.843 -0.743 1
1 832 . 11 1 1 A 66 66 VAL CB C 66 35.700 35.922 -0.222 1
1 835 . 11 1 1 A 66 66 VAL N N 66 118.100 121.068 -2.968 1
1 836 . 11 1 1 A 67 67 ARG H H 67 8.880 8.693 0.187 1
1 837 . 11 1 1 A 67 67 ARG HA H 67 5.110 5.177 -0.067 1
1 845 . 11 1 1 A 67 67 ARG C C 67 175.300 174.477 0.823 1
1 846 . 11 1 1 A 67 67 ARG CA C 67 54.200 54.416 -0.216 1
1 847 . 11 1 1 A 67 67 ARG CB C 67 32.200 33.371 -1.171 1
1 851 . 11 1 1 A 67 67 ARG N N 67 120.200 121.809 -1.609 1
1 853 . 11 1 1 A 68 68 ILE H H 68 9.220 9.072 0.148 1
1 854 . 11 1 1 A 68 68 ILE HA H 68 4.990 4.824 0.166 1
1 864 . 11 1 1 A 68 68 ILE C C 68 174.900 174.753 0.147 1
1 865 . 11 1 1 A 68 68 ILE CA C 68 58.600 59.783 -1.183 1
1 866 . 11 1 1 A 68 68 ILE CB C 68 39.300 39.366 -0.066 1
1 870 . 11 1 1 A 68 68 ILE N N 68 127.200 128.141 -0.941 1
1 871 . 11 1 1 A 69 69 ASP H H 69 9.110 8.808 0.302 1
1 872 . 11 1 1 A 69 69 ASP HA H 69 5.370 5.330 0.040 1
1 875 . 11 1 1 A 69 69 ASP C C 69 175.800 176.392 -0.592 1
1 876 . 11 1 1 A 69 69 ASP CA C 69 52.400 52.681 -0.281 1
1 877 . 11 1 1 A 69 69 ASP CB C 69 43.700 43.181 0.519 1
1 878 . 11 1 1 A 69 69 ASP N N 69 123.400 125.819 -2.419 1
1 879 . 11 1 1 A 70 70 ASN H H 70 8.300 8.706 -0.406 1
1 880 . 11 1 1 A 70 70 ASN HA H 70 4.160 4.435 -0.275 1
1 885 . 11 1 1 A 70 70 ASN C C 70 176.300 174.681 1.619 1
1 886 . 11 1 1 A 70 70 ASN CA C 70 54.300 54.221 0.079 1
1 887 . 11 1 1 A 70 70 ASN CB C 70 37.500 37.590 -0.090 1
1 889 . 11 1 1 A 70 70 ASN N N 70 119.800 121.185 -1.385 1
1 891 . 11 1 1 A 71 71 ALA H H 71 9.100 8.257 0.843 1
1 892 . 11 1 1 A 71 71 ALA HA H 71 4.500 4.396 0.104 1
1 896 . 11 1 1 A 71 71 ALA C C 71 175.700 176.756 -1.056 1
1 897 . 11 1 1 A 71 71 ALA CA C 71 51.900 52.818 -0.918 1
1 898 . 11 1 1 A 71 71 ALA CB C 71 19.600 19.688 -0.088 1
1 899 . 11 1 1 A 71 71 ALA N N 71 123.000 121.328 1.672 1
1 900 . 11 1 1 A 72 72 ARG H H 72 8.490 8.271 0.219 1
1 901 . 11 1 1 A 72 72 ARG HA H 72 4.720 4.786 -0.066 1
1 909 . 11 1 1 A 72 72 ARG C C 72 175.800 175.125 0.675 1
1 910 . 11 1 1 A 72 72 ARG CA C 72 54.400 55.056 -0.656 1
1 911 . 11 1 1 A 72 72 ARG CB C 72 32.700 31.578 1.122 1
1 915 . 11 1 1 A 72 72 ARG N N 72 122.500 123.505 -1.005 1
1 917 . 11 1 1 A 73 73 VAL H H 73 8.310 8.341 -0.031 1
1 918 . 11 1 1 A 73 73 VAL HA H 73 4.250 4.526 -0.276 1
1 926 . 11 1 1 A 73 73 VAL C C 73 174.600 175.793 -1.193 1
1 927 . 11 1 1 A 73 73 VAL CA C 73 62.800 62.188 0.612 1
1 928 . 11 1 1 A 73 73 VAL CB C 73 32.100 31.934 0.166 1
1 931 . 11 1 1 A 73 73 VAL N N 73 127.100 127.017 0.083 1
1 932 . 11 1 1 A 74 74 ALA H H 74 8.880 8.964 -0.084 1
1 933 . 11 1 1 A 74 74 ALA HA H 74 4.500 5.059 -0.559 1
1 937 . 11 1 1 A 74 74 ALA C C 74 174.800 174.669 0.131 1
1 938 . 11 1 1 A 74 74 ALA CA C 74 50.500 50.490 0.010 1
1 939 . 11 1 1 A 74 74 ALA CB C 74 22.500 23.961 -1.461 1
1 940 . 11 1 1 A 74 74 ALA N N 74 131.000 128.611 2.389 1
1 941 . 11 1 1 A 75 75 GLN H H 75 8.280 8.411 -0.131 1
1 942 . 11 1 1 A 75 75 GLN HA H 75 4.910 5.006 -0.096 1
1 949 . 11 1 1 A 75 75 GLN C C 75 175.100 174.231 0.869 1
1 950 . 11 1 1 A 75 75 GLN CA C 75 54.600 54.008 0.592 1
1 951 . 11 1 1 A 75 75 GLN CB C 75 31.400 31.587 -0.187 1
1 954 . 11 1 1 A 75 75 GLN N N 75 118.800 120.643 -1.843 1
1 956 . 11 1 1 A 76 76 PHE H H 76 8.710 9.190 -0.480 1
1 957 . 11 1 1 A 76 76 PHE HA H 76 4.660 4.908 -0.248 1
1 965 . 11 1 1 A 76 76 PHE C C 76 174.900 175.470 -0.570 1
1 966 . 11 1 1 A 76 76 PHE CA C 76 57.000 56.675 0.325 1
1 967 . 11 1 1 A 76 76 PHE CB C 76 41.000 42.085 -1.085 1
1 973 . 11 1 1 A 76 76 PHE N N 76 125.000 125.564 -0.564 1
1 974 . 11 1 1 A 77 77 ASN H H 77 9.040 9.490 -0.450 1
1 975 . 11 1 1 A 77 77 ASN HA H 77 4.170 4.508 -0.338 1
1 980 . 11 1 1 A 77 77 ASN C C 77 174.200 175.676 -1.476 1
1 981 . 11 1 1 A 77 77 ASN CA C 77 53.800 54.536 -0.736 1
1 982 . 11 1 1 A 77 77 ASN CB C 77 37.400 37.511 -0.111 1
1 984 . 11 1 1 A 77 77 ASN N N 77 123.200 123.550 -0.350 1
1 986 . 11 1 1 A 78 78 GLY H H 78 8.370 8.613 -0.243 1
1 987 . 11 1 1 A 78 78 GLY HA2 H 78 3.410 3.609 -0.199 1
1 988 . 11 1 1 A 78 78 GLY HA3 H 78 3.980 3.708 0.272 1
1 989 . 11 1 1 A 78 78 GLY C C 78 173.800 173.134 0.666 1
1 990 . 11 1 1 A 78 78 GLY CA C 78 45.000 45.298 -0.298 1
1 991 . 11 1 1 A 78 78 GLY N N 78 103.300 104.726 -1.426 1
1 992 . 11 1 1 A 79 79 TYR H H 79 7.670 8.267 -0.597 1
1 993 . 11 1 1 A 79 79 TYR HA H 79 4.860 4.854 0.006 1
1 1000 . 11 1 1 A 79 79 TYR C C 79 174.800 175.561 -0.761 1
1 1001 . 11 1 1 A 79 79 TYR CA C 79 56.300 57.414 -1.114 1
1 1002 . 11 1 1 A 79 79 TYR CB C 79 40.800 40.719 0.081 1
1 1007 . 11 1 1 A 79 79 TYR N N 79 118.700 119.169 -0.469 1
1 1008 . 11 1 1 A 80 80 LEU H H 80 8.760 8.682 0.078 1
1 1009 . 11 1 1 A 80 80 LEU HA H 80 4.830 4.411 0.419 1
1 1019 . 11 1 1 A 80 80 LEU C C 80 176.200 176.273 -0.073 1
1 1020 . 11 1 1 A 80 80 LEU CA C 80 54.700 55.107 -0.407 1
1 1021 . 11 1 1 A 80 80 LEU CB C 80 43.500 42.569 0.931 1
1 1025 . 11 1 1 A 80 80 LEU N N 80 122.600 125.713 -3.113 1
1 1026 . 11 1 1 A 81 81 SER H H 81 8.650 8.966 -0.316 1
1 1027 . 11 1 1 A 81 81 SER HA H 81 4.860 5.365 -0.505 1
1 1030 . 11 1 1 A 81 81 SER C C 81 172.600 172.292 0.308 1
1 1031 . 11 1 1 A 81 81 SER CA C 81 56.600 57.308 -0.708 1
1 1032 . 11 1 1 A 81 81 SER CB C 81 66.300 66.546 -0.246 1
1 1033 . 11 1 1 A 81 81 SER N N 81 114.700 117.203 -2.503 1
1 1034 . 11 1 1 A 82 82 LEU H H 82 8.680 8.568 0.112 1
1 1035 . 11 1 1 A 82 82 LEU HA H 82 5.190 5.138 0.052 1
1 1045 . 11 1 1 A 82 82 LEU C C 82 177.100 175.602 1.498 1
1 1046 . 11 1 1 A 82 82 LEU CA C 82 53.300 53.752 -0.452 1
1 1047 . 11 1 1 A 82 82 LEU CB C 82 43.800 43.735 0.065 1
1 1051 . 11 1 1 A 82 82 LEU N N 82 119.800 121.938 -2.138 1
1 1052 . 11 1 1 A 83 83 SER H H 83 9.560 9.545 0.015 1
1 1053 . 11 1 1 A 83 83 SER HA H 83 5.390 5.131 0.259 1
1 1056 . 11 1 1 A 83 83 SER C C 83 174.200 174.068 0.132 1
1 1057 . 11 1 1 A 83 83 SER CA C 83 57.100 58.042 -0.942 1
1 1058 . 11 1 1 A 83 83 SER CB C 83 64.400 64.432 -0.032 1
1 1059 . 11 1 1 A 83 83 SER N N 83 119.000 121.901 -2.901 1
1 1060 . 11 1 1 A 84 84 VAL H H 84 9.150 8.853 0.297 1
1 1061 . 11 1 1 A 84 84 VAL HA H 84 4.490 5.241 -0.751 1
1 1069 . 11 1 1 A 84 84 VAL C C 84 174.700 175.823 -1.123 1
1 1070 . 11 1 1 A 84 84 VAL CA C 84 61.300 60.603 0.697 1
1 1071 . 11 1 1 A 84 84 VAL CB C 84 33.000 34.032 -1.032 1
1 1074 . 11 1 1 A 84 84 VAL N N 84 128.300 126.228 2.072 1
1 1075 . 11 1 1 A 85 85 GLY H H 85 7.970 9.137 -1.167 1
1 1076 . 11 1 1 A 85 85 GLY HA2 H 85 4.030 4.385 -0.355 1
1 1077 . 11 1 1 A 85 85 GLY HA3 H 85 4.840 4.397 0.443 1
1 1078 . 11 1 1 A 85 85 GLY C C 85 175.800 174.107 1.693 1
1 1079 . 11 1 1 A 85 85 GLY CA C 85 44.800 45.773 -0.973 1
1 1080 . 11 1 1 A 85 85 GLY N N 85 114.300 113.081 1.219 1
1 1081 . 11 1 1 A 86 86 ASP H H 86 8.860 8.870 -0.010 1
1 1082 . 11 1 1 A 86 86 ASP HA H 86 4.370 4.383 -0.013 1
1 1085 . 11 1 1 A 86 86 ASP C C 86 177.400 178.417 -1.017 1
1 1086 . 11 1 1 A 86 86 ASP CA C 86 57.400 57.196 0.204 1
1 1087 . 11 1 1 A 86 86 ASP CB C 86 40.600 40.583 0.017 1
1 1088 . 11 1 1 A 86 86 ASP N N 86 122.500 120.230 2.270 1
1 1089 . 11 1 1 A 87 87 SER H H 87 8.540 8.160 0.380 1
1 1090 . 11 1 1 A 87 87 SER HA H 87 4.620 4.179 0.441 1
1 1093 . 11 1 1 A 87 87 SER C C 87 174.700 175.036 -0.336 1
1 1094 . 11 1 1 A 87 87 SER CA C 87 58.200 61.791 -3.591 1
1 1095 . 11 1 1 A 87 87 SER CB C 87 63.300 63.067 0.233 1
1 1096 . 11 1 1 A 87 87 SER N N 87 112.100 116.279 -4.179 1
1 1097 . 11 1 1 A 88 88 SER H H 88 7.880 7.584 0.296 1
1 1098 . 11 1 1 A 88 88 SER HA H 88 5.050 4.540 0.510 1
1 1101 . 11 1 1 A 88 88 SER C C 88 172.700 174.073 -1.373 1
1 1102 . 11 1 1 A 88 88 SER CA C 88 57.600 57.961 -0.361 1
1 1103 . 11 1 1 A 88 88 SER CB C 88 64.300 65.228 -0.928 1
1 1104 . 11 1 1 A 88 88 SER N N 88 119.200 114.832 4.368 1
1 1105 . 11 1 1 A 89 89 ARG H H 89 8.350 8.452 -0.102 1
1 1106 . 11 1 1 A 89 89 ARG HA H 89 4.720 5.209 -0.489 1
1 1114 . 11 1 1 A 89 89 ARG C C 89 174.200 174.276 -0.076 1
1 1115 . 11 1 1 A 89 89 ARG CA C 89 55.000 54.459 0.541 1
1 1116 . 11 1 1 A 89 89 ARG CB C 89 33.500 33.797 -0.297 1
1 1120 . 11 1 1 A 89 89 ARG N N 89 122.800 122.042 0.758 1
1 1122 . 11 1 1 A 90 90 ILE H H 90 8.530 8.978 -0.448 1
1 1123 . 11 1 1 A 90 90 ILE HA H 90 4.790 4.899 -0.109 1
1 1133 . 11 1 1 A 90 90 ILE C C 90 175.400 174.657 0.743 1
1 1134 . 11 1 1 A 90 90 ILE CA C 90 60.600 60.151 0.449 1
1 1135 . 11 1 1 A 90 90 ILE CB C 90 40.600 40.176 0.424 1
1 1139 . 11 1 1 A 90 90 ILE N N 90 123.100 126.991 -3.891 1
1 1140 . 11 1 1 A 91 91 GLU H H 91 9.000 8.919 0.081 1
1 1141 . 11 1 1 A 91 91 GLU HA H 91 4.730 5.150 -0.420 1
1 1146 . 11 1 1 A 91 91 GLU C C 91 175.100 176.046 -0.946 1
1 1147 . 11 1 1 A 91 91 GLU CA C 91 54.300 54.492 -0.192 1
1 1148 . 11 1 1 A 91 91 GLU CB C 91 32.400 33.499 -1.099 1
1 1150 . 11 1 1 A 91 91 GLU N N 91 126.400 128.388 -1.988 1
1 1151 . 11 1 1 A 92 92 SER H H 92 8.830 8.911 -0.081 1
1 1152 . 11 1 1 A 92 92 SER HA H 92 4.700 4.807 -0.107 1
1 1155 . 11 1 1 A 92 92 SER C C 92 174.600 174.777 -0.177 1
1 1156 . 11 1 1 A 92 92 SER CA C 92 59.300 57.767 1.533 1
1 1157 . 11 1 1 A 92 92 SER CB C 92 63.100 64.757 -1.657 1
1 1158 . 11 1 1 A 92 92 SER N N 92 119.800 118.823 0.977 1
1 1159 . 11 1 1 A 93 93 VAL H H 93 8.350 8.251 0.099 1
1 1160 . 11 1 1 A 93 93 VAL HA H 93 4.290 4.549 -0.259 1
1 1168 . 11 1 1 A 93 93 VAL C C 93 175.100 176.239 -1.139 1
1 1169 . 11 1 1 A 93 93 VAL CA C 93 61.300 61.023 0.277 1
1 1170 . 11 1 1 A 93 93 VAL CB C 93 33.900 32.632 1.268 1
1 1173 . 11 1 1 A 93 93 VAL N N 93 121.800 117.950 3.850 1
1 1174 . 11 1 1 A 94 94 ASN H H 94 8.510 8.222 0.288 1
1 1175 . 11 1 1 A 94 94 ASN HA H 94 4.770 4.768 0.002 1
1 1180 . 11 1 1 A 94 94 ASN C C 94 175.000 174.778 0.222 1
1 1181 . 11 1 1 A 94 94 ASN CA C 94 52.700 52.828 -0.128 1
1 1182 . 11 1 1 A 94 94 ASN CB C 94 38.500 38.986 -0.486 1
1 1184 . 11 1 1 A 94 94 ASN N N 94 121.800 119.819 1.981 1
1 1186 . 11 1 1 A 95 95 VAL H H 95 7.860 7.439 0.421 1
1 1187 . 11 1 1 A 95 95 VAL HA H 95 4.100 4.678 -0.578 1
1 1195 . 11 1 1 A 95 95 VAL C C 95 175.100 173.705 1.395 1
1 1196 . 11 1 1 A 95 95 VAL CA C 95 61.700 59.809 1.891 1
1 1197 . 11 1 1 A 95 95 VAL CB C 95 33.100 34.733 -1.633 1
1 1200 . 11 1 1 A 95 95 VAL N N 95 119.700 118.719 0.981 1
1 1201 . 11 1 1 A 96 96 ASN H H 96 8.490 8.817 -0.327 1
1 1202 . 11 1 1 A 96 96 ASN HA H 96 4.700 4.793 -0.093 1
1 1207 . 11 1 1 A 96 96 ASN C C 96 174.600 175.413 -0.813 1
1 1208 . 11 1 1 A 96 96 ASN CA C 96 53.000 53.545 -0.545 1
1 1209 . 11 1 1 A 96 96 ASN CB C 96 39.000 39.060 -0.060 1
1 1211 . 11 1 1 A 96 96 ASN N N 96 122.200 126.004 -3.804 1
1 1213 . 11 1 1 A 97 97 ILE H H 97 8.080 8.732 -0.652 1
1 1214 . 11 1 1 A 97 97 ILE HA H 97 4.370 4.560 -0.190 1
1 1224 . 11 1 1 A 97 97 ILE CA C 97 58.600 57.814 0.786 1
1 1225 . 11 1 1 A 97 97 ILE CB C 97 38.600 38.207 0.393 1
1 1229 . 11 1 1 A 97 97 ILE N N 97 123.500 121.178 2.322 1
1 1230 . 11 1 1 A 98 98 PRO HA H 98 4.360 4.594 -0.234 1
1 1237 . 11 1 1 A 98 98 PRO C C 98 176.600 176.612 -0.012 1
1 1238 . 11 1 1 A 98 98 PRO CA C 98 63.100 62.444 0.656 1
1 1239 . 11 1 1 A 98 98 PRO CB C 98 31.800 32.339 -0.539 1
1 1242 . 11 1 1 A 99 99 LEU H H 99 8.200 8.447 -0.247 1
1 1243 . 11 1 1 A 99 99 LEU HA H 99 4.200 4.155 0.045 1
1 1253 . 11 1 1 A 99 99 LEU C C 99 177.300 177.610 -0.310 1
1 1254 . 11 1 1 A 99 99 LEU CA C 99 55.000 54.960 0.040 1
1 1255 . 11 1 1 A 99 99 LEU CB C 99 42.400 42.879 -0.479 1
1 1259 . 11 1 1 A 99 99 LEU N N 99 122.500 122.781 -0.281 1
1 1260 . 11 1 1 A 100 100 GLU H H 100 8.250 9.124 -0.874 1
1 1261 . 11 1 1 A 100 100 GLU HA H 100 4.140 4.035 0.105 1
1 1266 . 11 1 1 A 100 100 GLU C C 100 176.100 176.117 -0.017 1
1 1267 . 11 1 1 A 100 100 GLU CA C 100 56.100 57.295 -1.195 1
1 1268 . 11 1 1 A 100 100 GLU CB C 100 29.900 28.326 1.574 1
1 1270 . 11 1 1 A 100 100 GLU N N 100 121.000 123.117 -2.117 1
1 1271 . 11 1 1 A 101 101 HIS H H 101 8.540 7.964 0.576 1
1 1272 . 11 1 1 A 101 101 HIS HA H 101 4.600 4.971 -0.371 1
1 1275 . 11 1 1 A 101 101 HIS C C 101 174.200 174.806 -0.606 1
1 1276 . 11 1 1 A 101 101 HIS CA C 101 55.200 55.233 -0.033 1
1 1277 . 11 1 1 A 101 101 HIS CB C 101 29.000 31.787 -2.787 1
1 1278 . 11 1 1 A 101 101 HIS N N 101 119.400 119.649 -0.249 1
1 1279 . 11 1 1 A 102 102 HIS H H 102 8.660 8.843 -0.183 1
1 1280 . 11 1 1 A 102 102 HIS HA H 102 4.630 3.972 0.658 1
1 1283 . 11 1 1 A 102 102 HIS C C 102 174.200 174.320 -0.120 1
1 1284 . 11 1 1 A 102 102 HIS CA C 102 55.200 56.781 -1.581 1
1 1285 . 11 1 1 A 102 102 HIS CB C 102 29.100 28.079 1.021 1
1 1286 . 11 1 1 A 102 102 HIS N N 102 119.700 125.045 -5.345 1
1 1287 . 11 1 1 A 103 103 HIS H H 103 8.680 7.840 0.840 1
1 1288 . 11 1 1 A 103 103 HIS HA H 103 4.640 4.925 -0.285 1
1 1291 . 11 1 1 A 103 103 HIS C C 103 174.200 173.130 1.070 1
1 1292 . 11 1 1 A 103 103 HIS CA C 103 55.200 55.486 -0.286 1
1 1293 . 11 1 1 A 103 103 HIS CB C 103 29.200 33.557 -4.357 1
1 1294 . 11 1 1 A 103 103 HIS N N 103 120.500 121.384 -0.884 1
1 1295 . 11 1 1 A 104 104 HIS H H 104 8.580 8.387 0.193 1
1 1296 . 11 1 1 A 104 104 HIS HA H 104 4.590 4.504 0.086 1
1 1299 . 11 1 1 A 104 104 HIS C C 104 174.200 174.185 0.015 1
1 1300 . 11 1 1 A 104 104 HIS CA C 104 55.200 54.934 0.266 1
1 1301 . 11 1 1 A 104 104 HIS CB C 104 29.300 30.277 -0.977 1
1 1302 . 11 1 1 A 104 104 HIS N N 104 120.700 125.026 -4.326 1
1 1303 . 11 1 1 A 105 105 HIS H H 105 8.550 7.394 1.156 1
1 1304 . 11 1 1 A 105 105 HIS HA H 105 4.610 3.786 0.824 1
1 1307 . 11 1 1 A 105 105 HIS C C 105 173.500 173.370 0.130 1
1 1308 . 11 1 1 A 105 105 HIS CA C 105 55.400 56.522 -1.122 1
1 1309 . 11 1 1 A 105 105 HIS CB C 105 28.800 28.732 0.068 1
1 1310 . 11 1 1 A 105 105 HIS N N 105 119.000 118.131 0.869 1
1 7 . 12 1 1 A 2 2 ASP H H 2 8.890 7.657 1.233 1
1 8 . 12 1 1 A 2 2 ASP HA H 2 4.740 4.687 0.053 1
1 11 . 12 1 1 A 2 2 ASP C C 2 174.600 175.320 -0.720 1
1 12 . 12 1 1 A 2 2 ASP CA C 2 53.800 52.894 0.906 1
1 13 . 12 1 1 A 2 2 ASP CB C 2 41.500 42.956 -1.456 1
1 14 . 12 1 1 A 2 2 ASP N N 2 122.100 121.368 0.732 1
1 15 . 12 1 1 A 3 3 LEU H H 3 8.280 8.298 -0.018 1
1 16 . 12 1 1 A 3 3 LEU HA H 3 4.420 4.846 -0.426 1
1 26 . 12 1 1 A 3 3 LEU C C 3 176.900 176.183 0.717 1
1 27 . 12 1 1 A 3 3 LEU CA C 3 55.000 54.907 0.093 1
1 28 . 12 1 1 A 3 3 LEU CB C 3 42.700 42.781 -0.081 1
1 32 . 12 1 1 A 3 3 LEU N N 3 122.300 122.667 -0.367 1
1 33 . 12 1 1 A 4 4 VAL H H 4 8.640 8.576 0.064 1
1 34 . 12 1 1 A 4 4 VAL HA H 4 4.540 4.944 -0.404 1
1 42 . 12 1 1 A 4 4 VAL C C 4 175.800 174.858 0.942 1
1 43 . 12 1 1 A 4 4 VAL CA C 4 59.400 58.656 0.744 1
1 44 . 12 1 1 A 4 4 VAL CB C 4 35.400 35.834 -0.434 1
1 47 . 12 1 1 A 4 4 VAL N N 4 122.600 119.114 3.486 1
1 48 . 12 1 1 A 5 5 LYS H H 5 8.630 8.661 -0.031 1
1 49 . 12 1 1 A 5 5 LYS HA H 5 4.450 4.329 0.121 1
1 58 . 12 1 1 A 5 5 LYS C C 5 179.400 178.456 0.944 1
1 59 . 12 1 1 A 5 5 LYS CA C 5 53.600 56.172 -2.572 1
1 60 . 12 1 1 A 5 5 LYS CB C 5 30.900 33.138 -2.238 1
1 64 . 12 1 1 A 5 5 LYS N N 5 121.100 121.954 -0.854 1
1 65 . 12 1 1 A 6 6 ILE H H 6 10.320 8.844 1.476 1
1 66 . 12 1 1 A 6 6 ILE HA H 6 3.440 3.720 -0.280 1
1 76 . 12 1 1 A 6 6 ILE C C 6 178.300 177.655 0.645 1
1 77 . 12 1 1 A 6 6 ILE CA C 6 65.700 64.970 0.730 1
1 78 . 12 1 1 A 6 6 ILE CB C 6 35.900 37.675 -1.775 1
1 82 . 12 1 1 A 6 6 ILE N N 6 125.400 122.381 3.019 1
1 83 . 12 1 1 A 7 7 ARG H H 7 8.210 8.108 0.102 1
1 84 . 12 1 1 A 7 7 ARG HA H 7 3.850 4.222 -0.372 1
1 92 . 12 1 1 A 7 7 ARG C C 7 175.600 176.763 -1.163 1
1 93 . 12 1 1 A 7 7 ARG CA C 7 57.800 58.823 -1.023 1
1 94 . 12 1 1 A 7 7 ARG CB C 7 30.300 30.109 0.191 1
1 98 . 12 1 1 A 7 7 ARG N N 7 118.800 120.397 -1.597 1
1 100 . 12 1 1 A 8 8 ASP H H 8 7.850 7.708 0.142 1
1 101 . 12 1 1 A 8 8 ASP HA H 8 4.700 4.638 0.062 1
1 104 . 12 1 1 A 8 8 ASP C C 8 176.100 176.652 -0.552 1
1 105 . 12 1 1 A 8 8 ASP CA C 8 54.100 54.742 -0.642 1
1 106 . 12 1 1 A 8 8 ASP CB C 8 41.200 41.751 -0.551 1
1 107 . 12 1 1 A 8 8 ASP N N 8 116.800 117.565 -0.765 1
1 108 . 12 1 1 A 9 9 VAL H H 9 7.240 7.037 0.203 1
1 109 . 12 1 1 A 9 9 VAL HA H 9 3.710 3.922 -0.212 1
1 117 . 12 1 1 A 9 9 VAL C C 9 174.900 175.663 -0.763 1
1 118 . 12 1 1 A 9 9 VAL CA C 9 64.300 63.764 0.536 1
1 119 . 12 1 1 A 9 9 VAL CB C 9 31.500 31.653 -0.153 1
1 122 . 12 1 1 A 9 9 VAL N N 9 121.800 121.726 0.074 1
1 123 . 12 1 1 A 10 10 SER H H 10 8.600 8.658 -0.058 1
1 124 . 12 1 1 A 10 10 SER HA H 10 4.600 4.665 -0.065 1
1 127 . 12 1 1 A 10 10 SER CA C 10 56.700 56.886 -0.186 1
1 128 . 12 1 1 A 10 10 SER CB C 10 66.100 65.879 0.221 1
1 129 . 12 1 1 A 10 10 SER N N 10 122.200 120.432 1.768 1
1 130 . 12 1 1 A 11 11 LEU H H 11 8.660 8.961 -0.301 1
1 131 . 12 1 1 A 11 11 LEU HA H 11 3.900 4.096 -0.196 1
1 141 . 12 1 1 A 11 11 LEU C C 11 178.100 179.090 -0.990 1
1 142 . 12 1 1 A 11 11 LEU CA C 11 56.700 57.005 -0.305 1
1 143 . 12 1 1 A 11 11 LEU CB C 11 41.400 41.590 -0.190 1
1 147 . 12 1 1 A 11 11 LEU N N 11 120.300 122.646 -2.346 1
1 148 . 12 1 1 A 12 12 SER H H 12 8.160 7.915 0.245 1
1 149 . 12 1 1 A 12 12 SER HA H 12 4.270 4.267 0.003 1
1 152 . 12 1 1 A 12 12 SER C C 12 174.200 174.486 -0.286 1
1 153 . 12 1 1 A 12 12 SER CA C 12 59.900 61.608 -1.708 1
1 154 . 12 1 1 A 12 12 SER CB C 12 63.100 62.947 0.153 1
1 155 . 12 1 1 A 12 12 SER N N 12 112.100 113.642 -1.542 1
1 156 . 12 1 1 A 13 13 THR H H 13 7.460 7.457 0.003 1
1 157 . 12 1 1 A 13 13 THR HA H 13 4.760 4.727 0.033 1
1 162 . 12 1 1 A 13 13 THR CA C 13 56.600 59.049 -2.449 1
1 163 . 12 1 1 A 13 13 THR CB C 13 70.100 69.858 0.242 1
1 165 . 12 1 1 A 13 13 THR N N 13 114.700 115.546 -0.846 1
1 166 . 12 1 1 A 14 14 PRO HA H 14 4.050 4.271 -0.221 1
1 173 . 12 1 1 A 14 14 PRO C C 14 175.800 175.917 -0.117 1
1 174 . 12 1 1 A 14 14 PRO CA C 14 65.100 64.982 0.118 1
1 175 . 12 1 1 A 14 14 PRO CB C 14 32.100 31.296 0.804 1
1 178 . 12 1 1 A 15 15 TYR H H 15 7.380 7.704 -0.324 1
1 179 . 12 1 1 A 15 15 TYR HA H 15 5.570 5.420 0.150 1
1 186 . 12 1 1 A 15 15 TYR C C 15 176.100 175.421 0.679 1
1 187 . 12 1 1 A 15 15 TYR CA C 15 56.400 56.936 -0.536 1
1 188 . 12 1 1 A 15 15 TYR CB C 15 41.500 40.859 0.641 1
1 193 . 12 1 1 A 15 15 TYR N N 15 113.800 117.483 -3.683 1
1 194 . 12 1 1 A 16 16 VAL H H 16 9.010 8.816 0.194 1
1 195 . 12 1 1 A 16 16 VAL HA H 16 4.920 5.061 -0.141 1
1 203 . 12 1 1 A 16 16 VAL C C 16 174.300 174.335 -0.035 1
1 204 . 12 1 1 A 16 16 VAL CA C 16 59.600 59.414 0.186 1
1 205 . 12 1 1 A 16 16 VAL CB C 16 36.800 36.225 0.575 1
1 208 . 12 1 1 A 16 16 VAL N N 16 113.800 117.645 -3.845 1
1 209 . 12 1 1 A 17 17 SER H H 17 7.960 8.448 -0.488 1
1 210 . 12 1 1 A 17 17 SER HA H 17 5.860 5.584 0.276 1
1 213 . 12 1 1 A 17 17 SER C C 17 172.700 173.417 -0.717 1
1 214 . 12 1 1 A 17 17 SER CA C 17 57.300 57.217 0.083 1
1 215 . 12 1 1 A 17 17 SER CB C 17 64.000 66.196 -2.196 1
1 216 . 12 1 1 A 17 17 SER N N 17 117.100 117.015 0.085 1
1 217 . 12 1 1 A 18 18 VAL H H 18 8.570 8.751 -0.181 1
1 218 . 12 1 1 A 18 18 VAL HA H 18 4.900 5.107 -0.207 1
1 226 . 12 1 1 A 18 18 VAL C C 18 173.700 174.567 -0.867 1
1 227 . 12 1 1 A 18 18 VAL CA C 18 58.800 59.078 -0.278 1
1 228 . 12 1 1 A 18 18 VAL CB C 18 36.700 36.155 0.545 1
1 231 . 12 1 1 A 18 18 VAL N N 18 113.500 118.605 -5.105 1
1 232 . 12 1 1 A 19 19 ILE H H 19 8.490 8.556 -0.066 1
1 233 . 12 1 1 A 19 19 ILE HA H 19 5.300 5.101 0.199 1
1 243 . 12 1 1 A 19 19 ILE C C 19 175.800 176.011 -0.211 1
1 244 . 12 1 1 A 19 19 ILE CA C 19 59.700 59.660 0.040 1
1 245 . 12 1 1 A 19 19 ILE CB C 19 41.700 41.160 0.540 1
1 249 . 12 1 1 A 19 19 ILE N N 19 120.600 121.582 -0.982 1
1 250 . 12 1 1 A 20 20 GLY H H 20 8.670 7.710 0.960 1
1 251 . 12 1 1 A 20 20 GLY HA2 H 20 3.760 4.142 -0.382 1
1 252 . 12 1 1 A 20 20 GLY HA3 H 20 4.190 4.145 0.045 1
1 253 . 12 1 1 A 20 20 GLY C C 20 169.900 171.460 -1.560 1
1 254 . 12 1 1 A 20 20 GLY CA C 20 46.000 45.961 0.039 1
1 255 . 12 1 1 A 20 20 GLY N N 20 110.200 112.241 -2.041 1
1 256 . 12 1 1 A 21 21 LYS H H 21 8.920 8.223 0.697 1
1 257 . 12 1 1 A 21 21 LYS HA H 21 5.210 5.218 -0.008 1
1 266 . 12 1 1 A 21 21 LYS C C 21 176.400 175.139 1.261 1
1 267 . 12 1 1 A 21 21 LYS CA C 21 54.400 54.645 -0.245 1
1 268 . 12 1 1 A 21 21 LYS CB C 21 35.400 35.357 0.043 1
1 272 . 12 1 1 A 21 21 LYS N N 21 119.100 120.255 -1.155 1
1 273 . 12 1 1 A 22 22 ILE H H 22 8.900 8.469 0.431 1
1 274 . 12 1 1 A 22 22 ILE HA H 22 5.050 5.044 0.006 1
1 284 . 12 1 1 A 22 22 ILE C C 22 176.900 175.345 1.555 1
1 285 . 12 1 1 A 22 22 ILE CA C 22 57.800 60.380 -2.580 1
1 286 . 12 1 1 A 22 22 ILE CB C 22 36.200 39.273 -3.073 1
1 290 . 12 1 1 A 22 22 ILE N N 22 130.000 123.443 6.557 1
1 291 . 12 1 1 A 23 23 THR H H 23 9.020 9.024 -0.004 1
1 292 . 12 1 1 A 23 23 THR HA H 23 4.660 5.122 -0.462 1
1 297 . 12 1 1 A 23 23 THR C C 23 174.000 174.376 -0.376 1
1 298 . 12 1 1 A 23 23 THR CA C 23 60.800 59.816 0.984 1
1 299 . 12 1 1 A 23 23 THR CB C 23 73.400 71.439 1.961 1
1 301 . 12 1 1 A 23 23 THR N N 23 118.200 117.778 0.422 1
1 302 . 12 1 1 A 24 24 GLY H H 24 8.430 8.337 0.093 1
1 303 . 12 1 1 A 24 24 GLY HA2 H 24 3.910 4.045 -0.135 1
1 304 . 12 1 1 A 24 24 GLY HA3 H 24 3.910 4.199 -0.289 1
1 305 . 12 1 1 A 24 24 GLY C C 24 175.400 174.461 0.939 1
1 306 . 12 1 1 A 24 24 GLY CA C 24 47.100 45.795 1.305 1
1 307 . 12 1 1 A 24 24 GLY N N 24 107.200 108.953 -1.753 1
1 308 . 12 1 1 A 25 25 ILE H H 25 9.370 8.453 0.917 1
1 309 . 12 1 1 A 25 25 ILE HA H 25 4.480 3.978 0.502 1
1 319 . 12 1 1 A 25 25 ILE C C 25 178.200 174.255 3.945 1
1 320 . 12 1 1 A 25 25 ILE CA C 25 59.200 62.064 -2.864 1
1 321 . 12 1 1 A 25 25 ILE CB C 25 35.400 36.962 -1.562 1
1 325 . 12 1 1 A 25 25 ILE N N 25 120.600 118.250 2.350 1
1 326 . 12 1 1 A 26 26 HIS H H 26 9.000 9.020 -0.020 1
1 327 . 12 1 1 A 26 26 HIS HA H 26 4.770 5.002 -0.232 1
1 330 . 12 1 1 A 26 26 HIS C C 26 172.700 173.582 -0.882 1
1 331 . 12 1 1 A 26 26 HIS CA C 26 55.000 54.569 0.431 1
1 332 . 12 1 1 A 26 26 HIS CB C 26 31.100 33.626 -2.526 1
1 333 . 12 1 1 A 26 26 HIS N N 26 123.800 124.845 -1.045 1
1 334 . 12 1 1 A 27 27 LYS H H 27 8.930 8.862 0.068 1
1 335 . 12 1 1 A 27 27 LYS HA H 27 4.770 4.569 0.201 1
1 344 . 12 1 1 A 27 27 LYS C C 27 175.300 175.218 0.082 1
1 345 . 12 1 1 A 27 27 LYS CA C 27 55.100 55.403 -0.303 1
1 346 . 12 1 1 A 27 27 LYS CB C 27 34.400 34.276 0.124 1
1 350 . 12 1 1 A 27 27 LYS N N 27 125.900 123.750 2.150 1
1 351 . 12 1 1 A 28 28 LYS H H 28 8.880 8.636 0.244 1
1 352 . 12 1 1 A 28 28 LYS HA H 28 4.570 5.016 -0.446 1
1 361 . 12 1 1 A 28 28 LYS C C 28 174.500 175.086 -0.586 1
1 362 . 12 1 1 A 28 28 LYS CA C 28 54.600 54.510 0.090 1
1 363 . 12 1 1 A 28 28 LYS CB C 28 35.300 37.101 -1.801 1
1 367 . 12 1 1 A 28 28 LYS N N 28 127.400 125.335 2.065 1
1 368 . 12 1 1 A 29 29 GLU H H 29 8.440 8.444 -0.004 1
1 369 . 12 1 1 A 29 29 GLU HA H 29 5.260 5.254 0.006 1
1 374 . 12 1 1 A 29 29 GLU C C 29 175.800 175.588 0.212 1
1 375 . 12 1 1 A 29 29 GLU CA C 29 54.800 54.823 -0.023 1
1 376 . 12 1 1 A 29 29 GLU CB C 29 31.500 33.069 -1.569 1
1 378 . 12 1 1 A 29 29 GLU N N 29 122.200 120.771 1.429 1
1 379 . 12 1 1 A 30 30 TYR H H 30 8.960 8.926 0.034 1
1 380 . 12 1 1 A 30 30 TYR HA H 30 4.820 5.343 -0.523 1
1 387 . 12 1 1 A 30 30 TYR C C 30 172.600 172.712 -0.112 1
1 388 . 12 1 1 A 30 30 TYR CA C 30 56.300 55.552 0.748 1
1 389 . 12 1 1 A 30 30 TYR CB C 30 40.500 41.511 -1.011 1
1 394 . 12 1 1 A 30 30 TYR N N 30 121.100 118.758 2.342 1
1 395 . 12 1 1 A 31 31 GLU H H 31 8.610 8.715 -0.105 1
1 396 . 12 1 1 A 31 31 GLU HA H 31 4.810 4.540 0.270 1
1 401 . 12 1 1 A 31 31 GLU C C 31 176.100 174.712 1.388 1
1 402 . 12 1 1 A 31 31 GLU CA C 31 55.100 55.911 -0.811 1
1 403 . 12 1 1 A 31 31 GLU CB C 31 30.300 30.498 -0.198 1
1 405 . 12 1 1 A 31 31 GLU N N 31 121.800 120.338 1.462 1
1 406 . 12 1 1 A 32 32 SER H H 32 8.570 9.214 -0.644 1
1 407 . 12 1 1 A 32 32 SER HA H 32 4.520 4.864 -0.344 1
1 410 . 12 1 1 A 32 32 SER C C 32 174.300 173.105 1.195 1
1 411 . 12 1 1 A 32 32 SER CA C 32 57.300 56.395 0.905 1
1 412 . 12 1 1 A 32 32 SER CB C 32 64.100 64.933 -0.833 1
1 413 . 12 1 1 A 32 32 SER N N 32 118.500 120.383 -1.883 1
1 414 . 12 1 1 A 33 33 ASP H H 33 9.290 9.496 -0.206 1
1 415 . 12 1 1 A 33 33 ASP HA H 33 4.340 4.334 0.006 1
1 418 . 12 1 1 A 33 33 ASP C C 33 175.900 176.184 -0.284 1
1 419 . 12 1 1 A 33 33 ASP CA C 33 55.000 55.344 -0.344 1
1 420 . 12 1 1 A 33 33 ASP CB C 33 39.300 39.464 -0.164 1
1 421 . 12 1 1 A 33 33 ASP N N 33 125.700 129.054 -3.354 1
1 422 . 12 1 1 A 34 34 GLY H H 34 8.690 8.462 0.228 1
1 423 . 12 1 1 A 34 34 GLY HA2 H 34 3.660 3.695 -0.035 1
1 424 . 12 1 1 A 34 34 GLY HA3 H 34 4.140 3.699 0.441 1
1 425 . 12 1 1 A 34 34 GLY C C 34 174.200 173.561 0.639 1
1 426 . 12 1 1 A 34 34 GLY CA C 34 45.600 45.376 0.224 1
1 427 . 12 1 1 A 34 34 GLY N N 34 104.800 104.893 -0.093 1
1 428 . 12 1 1 A 35 35 THR H H 35 7.840 8.070 -0.230 1
1 429 . 12 1 1 A 35 35 THR HA H 35 4.660 4.493 0.167 1
1 434 . 12 1 1 A 35 35 THR C C 35 173.000 173.411 -0.411 1
1 435 . 12 1 1 A 35 35 THR CA C 35 60.200 61.160 -0.960 1
1 436 . 12 1 1 A 35 35 THR CB C 35 71.200 71.014 0.186 1
1 438 . 12 1 1 A 35 35 THR N N 35 114.800 117.107 -2.307 1
1 439 . 12 1 1 A 36 36 THR H H 36 8.480 8.662 -0.182 1
1 440 . 12 1 1 A 36 36 THR HA H 36 4.620 4.428 0.192 1
1 445 . 12 1 1 A 36 36 THR C C 36 173.800 174.376 -0.576 1
1 446 . 12 1 1 A 36 36 THR CA C 36 62.300 63.572 -1.272 1
1 447 . 12 1 1 A 36 36 THR CB C 36 69.500 68.775 0.725 1
1 449 . 12 1 1 A 36 36 THR N N 36 119.400 121.087 -1.687 1
1 450 . 12 1 1 A 37 37 LYS H H 37 8.880 8.643 0.237 1
1 451 . 12 1 1 A 37 37 LYS HA H 37 4.570 4.827 -0.257 1
1 460 . 12 1 1 A 37 37 LYS C C 37 174.500 175.880 -1.380 1
1 461 . 12 1 1 A 37 37 LYS CA C 37 54.600 54.030 0.570 1
1 462 . 12 1 1 A 37 37 LYS CB C 37 35.500 35.908 -0.408 1
1 466 . 12 1 1 A 37 37 LYS N N 37 128.000 125.955 2.045 1
1 467 . 12 1 1 A 38 38 SER H H 38 8.370 8.828 -0.458 1
1 468 . 12 1 1 A 38 38 SER HA H 38 5.250 4.951 0.299 1
1 471 . 12 1 1 A 38 38 SER C C 38 173.200 173.752 -0.552 1
1 472 . 12 1 1 A 38 38 SER CA C 38 57.900 58.558 -0.658 1
1 473 . 12 1 1 A 38 38 SER CB C 38 65.500 63.724 1.776 1
1 474 . 12 1 1 A 38 38 SER N N 38 114.300 118.919 -4.619 1
1 475 . 12 1 1 A 39 39 VAL H H 39 9.020 8.901 0.119 1
1 476 . 12 1 1 A 39 39 VAL HA H 39 4.900 5.064 -0.164 1
1 484 . 12 1 1 A 39 39 VAL C C 39 173.200 172.765 0.435 1
1 485 . 12 1 1 A 39 39 VAL CA C 39 59.200 59.660 -0.460 1
1 486 . 12 1 1 A 39 39 VAL CB C 39 34.600 35.494 -0.894 1
1 489 . 12 1 1 A 39 39 VAL N N 39 123.600 121.647 1.953 1
1 490 . 12 1 1 A 40 40 TYR H H 40 8.900 8.944 -0.044 1
1 491 . 12 1 1 A 40 40 TYR HA H 40 4.730 5.390 -0.660 1
1 498 . 12 1 1 A 40 40 TYR CA C 40 56.500 56.828 -0.328 1
1 499 . 12 1 1 A 40 40 TYR CB C 40 39.000 40.509 -1.509 1
1 504 . 12 1 1 A 40 40 TYR N N 40 126.300 127.519 -1.219 1
1 505 . 12 1 1 A 41 41 GLN H H 41 8.630 8.529 0.101 1
1 506 . 12 1 1 A 41 41 GLN HA H 41 5.330 5.333 -0.003 1
1 513 . 12 1 1 A 41 41 GLN C C 41 175.500 175.670 -0.170 1
1 514 . 12 1 1 A 41 41 GLN CA C 41 53.800 54.181 -0.381 1
1 515 . 12 1 1 A 41 41 GLN CB C 41 32.100 32.107 -0.007 1
1 518 . 12 1 1 A 41 41 GLN N N 41 122.000 121.837 0.163 1
1 520 . 12 1 1 A 42 42 GLY H H 42 8.560 7.903 0.657 1
1 521 . 12 1 1 A 42 42 GLY HA2 H 42 3.680 4.320 -0.640 1
1 522 . 12 1 1 A 42 42 GLY HA3 H 42 4.020 4.351 -0.331 1
1 523 . 12 1 1 A 42 42 GLY C C 42 171.600 171.043 0.557 1
1 524 . 12 1 1 A 42 42 GLY CA C 42 47.300 46.157 1.143 1
1 525 . 12 1 1 A 42 42 GLY N N 42 113.000 108.666 4.334 1
1 526 . 12 1 1 A 43 43 TYR H H 43 9.320 8.803 0.517 1
1 527 . 12 1 1 A 43 43 TYR HA H 43 5.280 5.424 -0.144 1
1 534 . 12 1 1 A 43 43 TYR C C 43 173.200 173.954 -0.754 1
1 535 . 12 1 1 A 43 43 TYR CA C 43 57.600 56.374 1.226 1
1 536 . 12 1 1 A 43 43 TYR CB C 43 42.400 42.526 -0.126 1
1 541 . 12 1 1 A 43 43 TYR N N 43 126.300 118.167 8.133 1
1 542 . 12 1 1 A 44 44 ILE H H 44 9.160 8.724 0.436 1
1 543 . 12 1 1 A 44 44 ILE HA H 44 5.270 5.415 -0.145 1
1 553 . 12 1 1 A 44 44 ILE C C 44 172.900 173.783 -0.883 1
1 554 . 12 1 1 A 44 44 ILE CA C 44 59.000 59.343 -0.343 1
1 555 . 12 1 1 A 44 44 ILE CB C 44 42.200 41.386 0.814 1
1 559 . 12 1 1 A 44 44 ILE N N 44 117.700 123.643 -5.943 1
1 560 . 12 1 1 A 45 45 GLU H H 45 8.420 8.779 -0.359 1
1 561 . 12 1 1 A 45 45 GLU HA H 45 5.600 5.486 0.114 1
1 566 . 12 1 1 A 45 45 GLU C C 45 174.300 174.533 -0.233 1
1 567 . 12 1 1 A 45 45 GLU CA C 45 54.000 54.691 -0.691 1
1 568 . 12 1 1 A 45 45 GLU CB C 45 34.400 33.790 0.610 1
1 570 . 12 1 1 A 45 45 GLU N N 45 123.600 128.512 -4.912 1
1 571 . 12 1 1 A 46 46 ASP H H 46 8.530 8.577 -0.047 1
1 572 . 12 1 1 A 46 46 ASP HA H 46 5.070 4.912 0.158 1
1 575 . 12 1 1 A 46 46 ASP C C 46 175.000 175.701 -0.701 1
1 576 . 12 1 1 A 46 46 ASP CA C 46 51.800 53.136 -1.336 1
1 577 . 12 1 1 A 46 46 ASP CB C 46 41.300 41.386 -0.086 1
1 578 . 12 1 1 A 46 46 ASP N N 46 125.500 123.462 2.038 1
1 579 . 12 1 1 A 47 47 ASP H H 47 9.160 9.121 0.039 1
1 580 . 12 1 1 A 47 47 ASP HA H 47 4.430 4.534 -0.104 1
1 583 . 12 1 1 A 47 47 ASP C C 47 176.000 177.053 -1.053 1
1 584 . 12 1 1 A 47 47 ASP CA C 47 55.000 55.317 -0.317 1
1 585 . 12 1 1 A 47 47 ASP CB C 47 38.900 39.728 -0.828 1
1 586 . 12 1 1 A 47 47 ASP N N 47 114.200 118.037 -3.837 1
1 587 . 12 1 1 A 48 48 THR H H 48 9.470 8.277 1.193 1
1 588 . 12 1 1 A 48 48 THR HA H 48 4.520 4.519 0.001 1
1 593 . 12 1 1 A 48 48 THR C C 48 174.500 175.029 -0.529 1
1 594 . 12 1 1 A 48 48 THR CA C 48 62.600 62.277 0.323 1
1 595 . 12 1 1 A 48 48 THR CB C 48 70.400 69.672 0.728 1
1 597 . 12 1 1 A 48 48 THR N N 48 111.800 108.739 3.061 1
1 598 . 12 1 1 A 49 49 ALA H H 49 7.850 7.576 0.274 1
1 599 . 12 1 1 A 49 49 ALA HA H 49 4.440 4.389 0.051 1
1 603 . 12 1 1 A 49 49 ALA C C 49 173.200 175.453 -2.253 1
1 604 . 12 1 1 A 49 49 ALA CA C 49 52.700 51.282 1.418 1
1 605 . 12 1 1 A 49 49 ALA CB C 49 21.300 20.218 1.082 1
1 606 . 12 1 1 A 49 49 ALA N N 49 123.400 120.802 2.598 1
1 607 . 12 1 1 A 50 50 ARG H H 50 8.160 8.727 -0.567 1
1 608 . 12 1 1 A 50 50 ARG HA H 50 5.350 5.562 -0.212 1
1 616 . 12 1 1 A 50 50 ARG C C 50 174.700 174.444 0.256 1
1 617 . 12 1 1 A 50 50 ARG CA C 50 54.000 54.428 -0.428 1
1 618 . 12 1 1 A 50 50 ARG CB C 50 34.500 34.286 0.214 1
1 622 . 12 1 1 A 50 50 ARG N N 50 117.400 115.718 1.682 1
1 624 . 12 1 1 A 51 51 ILE H H 51 9.390 8.707 0.683 1
1 625 . 12 1 1 A 51 51 ILE HA H 51 4.790 5.041 -0.251 1
1 635 . 12 1 1 A 51 51 ILE C C 51 172.600 174.840 -2.240 1
1 636 . 12 1 1 A 51 51 ILE CA C 51 60.000 59.016 0.984 1
1 637 . 12 1 1 A 51 51 ILE CB C 51 42.800 41.860 0.940 1
1 641 . 12 1 1 A 51 51 ILE N N 51 124.600 121.012 3.588 1
1 642 . 12 1 1 A 52 52 ARG H H 52 7.980 8.365 -0.385 1
1 643 . 12 1 1 A 52 52 ARG HA H 52 4.170 4.215 -0.045 1
1 651 . 12 1 1 A 52 52 ARG C C 52 174.600 176.179 -1.579 1
1 652 . 12 1 1 A 52 52 ARG CA C 52 57.100 56.192 0.908 1
1 653 . 12 1 1 A 52 52 ARG CB C 52 31.300 30.888 0.412 1
1 657 . 12 1 1 A 52 52 ARG N N 52 125.900 125.605 0.295 1
1 659 . 12 1 1 A 53 53 ILE H H 53 8.290 8.485 -0.195 1
1 660 . 12 1 1 A 53 53 ILE HA H 53 5.160 5.164 -0.004 1
1 670 . 12 1 1 A 53 53 ILE C C 53 172.400 174.026 -1.626 1
1 671 . 12 1 1 A 53 53 ILE CA C 53 58.600 59.207 -0.607 1
1 672 . 12 1 1 A 53 53 ILE CB C 53 41.900 42.559 -0.659 1
1 676 . 12 1 1 A 53 53 ILE N N 53 118.500 119.012 -0.512 1
1 677 . 12 1 1 A 54 54 SER H H 54 8.350 8.748 -0.398 1
1 678 . 12 1 1 A 54 54 SER HA H 54 5.070 5.186 -0.116 1
1 681 . 12 1 1 A 54 54 SER C C 54 172.400 172.410 -0.010 1
1 682 . 12 1 1 A 54 54 SER CA C 54 57.000 56.576 0.424 1
1 683 . 12 1 1 A 54 54 SER CB C 54 65.900 65.111 0.789 1
1 684 . 12 1 1 A 54 54 SER N N 54 120.700 119.742 0.958 1
1 685 . 12 1 1 A 55 55 SER H H 55 9.130 8.805 0.325 1
1 686 . 12 1 1 A 55 55 SER HA H 55 5.270 4.983 0.287 1
1 690 . 12 1 1 A 55 55 SER C C 55 174.400 172.723 1.677 1
1 691 . 12 1 1 A 55 55 SER CA C 55 55.500 56.318 -0.818 1
1 692 . 12 1 1 A 55 55 SER CB C 55 64.500 65.141 -0.641 1
1 693 . 12 1 1 A 55 55 SER N N 55 117.200 120.188 -2.988 1
1 694 . 12 1 1 A 56 56 PHE H H 56 8.970 8.343 0.627 1
1 695 . 12 1 1 A 56 56 PHE HA H 56 4.600 4.858 -0.258 1
1 703 . 12 1 1 A 56 56 PHE C C 56 176.500 177.073 -0.573 1
1 704 . 12 1 1 A 56 56 PHE CA C 56 58.300 57.356 0.944 1
1 705 . 12 1 1 A 56 56 PHE CB C 56 37.900 40.382 -2.482 1
1 711 . 12 1 1 A 56 56 PHE N N 56 129.400 125.050 4.350 1
1 712 . 12 1 1 A 57 57 GLY H H 57 8.570 8.956 -0.386 1
1 713 . 12 1 1 A 57 57 GLY HA2 H 57 4.020 4.171 -0.151 1
1 714 . 12 1 1 A 57 57 GLY HA3 H 57 4.380 4.213 0.167 1
1 715 . 12 1 1 A 57 57 GLY C C 57 173.700 174.425 -0.725 1
1 716 . 12 1 1 A 57 57 GLY CA C 57 46.300 45.861 0.439 1
1 717 . 12 1 1 A 57 57 GLY N N 57 112.500 112.151 0.349 1
1 718 . 12 1 1 A 58 58 LYS H H 58 6.800 8.227 -1.427 1
1 719 . 12 1 1 A 58 58 LYS HA H 58 4.410 4.350 0.060 1
1 728 . 12 1 1 A 58 58 LYS C C 58 174.800 176.301 -1.501 1
1 729 . 12 1 1 A 58 58 LYS CA C 58 55.200 56.566 -1.366 1
1 730 . 12 1 1 A 58 58 LYS CB C 58 33.300 33.308 -0.008 1
1 734 . 12 1 1 A 58 58 LYS N N 58 118.700 121.185 -2.485 1
1 735 . 12 1 1 A 59 59 GLN H H 59 8.390 8.167 0.223 1
1 736 . 12 1 1 A 59 59 GLN HA H 59 1.830 3.637 -1.807 1
1 743 . 12 1 1 A 59 59 GLN C C 59 174.100 174.640 -0.540 1
1 744 . 12 1 1 A 59 59 GLN CA C 59 57.100 54.516 2.584 1
1 745 . 12 1 1 A 59 59 GLN CB C 59 28.900 29.394 -0.494 1
1 748 . 12 1 1 A 59 59 GLN N N 59 124.000 122.830 1.170 1
1 750 . 12 1 1 A 60 60 LEU H H 60 5.320 8.426 -3.106 1
1 751 . 12 1 1 A 60 60 LEU HA H 60 4.370 5.000 -0.630 1
1 761 . 12 1 1 A 60 60 LEU CA C 60 52.800 53.394 -0.594 1
1 762 . 12 1 1 A 60 60 LEU CB C 60 46.700 44.935 1.765 1
1 766 . 12 1 1 A 60 60 LEU N N 60 121.800 122.659 -0.859 1
1 767 . 12 1 1 A 61 61 GLN H H 61 8.660 8.681 -0.021 1
1 768 . 12 1 1 A 61 61 GLN HA H 61 4.440 4.667 -0.227 1
1 775 . 12 1 1 A 61 61 GLN C C 61 174.000 175.097 -1.097 1
1 776 . 12 1 1 A 61 61 GLN CA C 61 53.800 53.965 -0.165 1
1 777 . 12 1 1 A 61 61 GLN CB C 61 31.800 31.035 0.765 1
1 780 . 12 1 1 A 61 61 GLN N N 61 120.300 120.774 -0.474 1
1 782 . 12 1 1 A 62 62 ASP H H 62 8.450 8.544 -0.094 1
1 783 . 12 1 1 A 62 62 ASP HA H 62 4.130 4.414 -0.284 1
1 786 . 12 1 1 A 62 62 ASP C C 62 177.200 176.994 0.206 1
1 787 . 12 1 1 A 62 62 ASP CA C 62 55.700 54.500 1.200 1
1 788 . 12 1 1 A 62 62 ASP CB C 62 39.400 41.785 -2.385 1
1 789 . 12 1 1 A 62 62 ASP N N 62 122.400 122.464 -0.064 1
1 790 . 12 1 1 A 63 63 SER H H 63 9.210 8.882 0.328 1
1 791 . 12 1 1 A 63 63 SER HA H 63 3.850 4.196 -0.346 1
1 794 . 12 1 1 A 63 63 SER C C 63 173.200 173.744 -0.544 1
1 795 . 12 1 1 A 63 63 SER CA C 63 61.700 59.094 2.606 1
1 796 . 12 1 1 A 63 63 SER CB C 63 61.800 61.099 0.701 1
1 797 . 12 1 1 A 63 63 SER N N 63 114.300 120.503 -6.203 1
1 798 . 12 1 1 A 64 64 ASP H H 64 7.960 7.681 0.279 1
1 799 . 12 1 1 A 64 64 ASP HA H 64 4.540 4.829 -0.289 1
1 802 . 12 1 1 A 64 64 ASP C C 64 174.900 175.106 -0.206 1
1 803 . 12 1 1 A 64 64 ASP CA C 64 54.900 53.565 1.335 1
1 804 . 12 1 1 A 64 64 ASP CB C 64 40.900 41.791 -0.891 1
1 805 . 12 1 1 A 64 64 ASP N N 64 122.600 122.946 -0.346 1
1 806 . 12 1 1 A 65 65 VAL H H 65 8.180 8.513 -0.333 1
1 807 . 12 1 1 A 65 65 VAL HA H 65 4.670 4.317 0.353 1
1 815 . 12 1 1 A 65 65 VAL C C 65 175.900 175.437 0.463 1
1 816 . 12 1 1 A 65 65 VAL CA C 65 62.300 62.524 -0.224 1
1 817 . 12 1 1 A 65 65 VAL CB C 65 31.700 30.802 0.898 1
1 820 . 12 1 1 A 65 65 VAL N N 65 123.100 127.298 -4.198 1
1 821 . 12 1 1 A 66 66 VAL H H 66 8.770 8.654 0.116 1
1 822 . 12 1 1 A 66 66 VAL HA H 66 5.160 5.088 0.072 1
1 830 . 12 1 1 A 66 66 VAL C C 66 173.600 173.346 0.254 1
1 831 . 12 1 1 A 66 66 VAL CA C 66 58.100 58.846 -0.746 1
1 832 . 12 1 1 A 66 66 VAL CB C 66 35.700 36.235 -0.535 1
1 835 . 12 1 1 A 66 66 VAL N N 66 118.100 120.420 -2.320 1
1 836 . 12 1 1 A 67 67 ARG H H 67 8.880 8.634 0.246 1
1 837 . 12 1 1 A 67 67 ARG HA H 67 5.110 5.090 0.020 1
1 845 . 12 1 1 A 67 67 ARG C C 67 175.300 174.629 0.671 1
1 846 . 12 1 1 A 67 67 ARG CA C 67 54.200 54.343 -0.143 1
1 847 . 12 1 1 A 67 67 ARG CB C 67 32.200 33.562 -1.362 1
1 851 . 12 1 1 A 67 67 ARG N N 67 120.200 121.679 -1.479 1
1 853 . 12 1 1 A 68 68 ILE H H 68 9.220 8.840 0.380 1
1 854 . 12 1 1 A 68 68 ILE HA H 68 4.990 4.702 0.288 1
1 864 . 12 1 1 A 68 68 ILE C C 68 174.900 174.745 0.155 1
1 865 . 12 1 1 A 68 68 ILE CA C 68 58.600 59.847 -1.247 1
1 866 . 12 1 1 A 68 68 ILE CB C 68 39.300 38.396 0.904 1
1 870 . 12 1 1 A 68 68 ILE N N 68 127.200 128.507 -1.307 1
1 871 . 12 1 1 A 69 69 ASP H H 69 9.110 8.769 0.341 1
1 872 . 12 1 1 A 69 69 ASP HA H 69 5.370 5.106 0.264 1
1 875 . 12 1 1 A 69 69 ASP C C 69 175.800 176.357 -0.557 1
1 876 . 12 1 1 A 69 69 ASP CA C 69 52.400 52.736 -0.336 1
1 877 . 12 1 1 A 69 69 ASP CB C 69 43.700 43.268 0.432 1
1 878 . 12 1 1 A 69 69 ASP N N 69 123.400 125.882 -2.482 1
1 879 . 12 1 1 A 70 70 ASN H H 70 8.300 8.832 -0.532 1
1 880 . 12 1 1 A 70 70 ASN HA H 70 4.160 4.408 -0.248 1
1 885 . 12 1 1 A 70 70 ASN C C 70 176.300 174.609 1.691 1
1 886 . 12 1 1 A 70 70 ASN CA C 70 54.300 54.226 0.074 1
1 887 . 12 1 1 A 70 70 ASN CB C 70 37.500 37.670 -0.170 1
1 889 . 12 1 1 A 70 70 ASN N N 70 119.800 121.138 -1.338 1
1 891 . 12 1 1 A 71 71 ALA H H 71 9.100 8.160 0.940 1
1 892 . 12 1 1 A 71 71 ALA HA H 71 4.500 4.431 0.069 1
1 896 . 12 1 1 A 71 71 ALA C C 71 175.700 176.702 -1.002 1
1 897 . 12 1 1 A 71 71 ALA CA C 71 51.900 52.510 -0.610 1
1 898 . 12 1 1 A 71 71 ALA CB C 71 19.600 19.737 -0.137 1
1 899 . 12 1 1 A 71 71 ALA N N 71 123.000 121.173 1.827 1
1 900 . 12 1 1 A 72 72 ARG H H 72 8.490 8.513 -0.023 1
1 901 . 12 1 1 A 72 72 ARG HA H 72 4.720 4.765 -0.045 1
1 909 . 12 1 1 A 72 72 ARG C C 72 175.800 175.536 0.264 1
1 910 . 12 1 1 A 72 72 ARG CA C 72 54.400 55.475 -1.075 1
1 911 . 12 1 1 A 72 72 ARG CB C 72 32.700 31.288 1.412 1
1 915 . 12 1 1 A 72 72 ARG N N 72 122.500 123.981 -1.481 1
1 917 . 12 1 1 A 73 73 VAL H H 73 8.310 8.757 -0.447 1
1 918 . 12 1 1 A 73 73 VAL HA H 73 4.250 4.540 -0.290 1
1 926 . 12 1 1 A 73 73 VAL C C 73 174.600 175.580 -0.980 1
1 927 . 12 1 1 A 73 73 VAL CA C 73 62.800 62.109 0.691 1
1 928 . 12 1 1 A 73 73 VAL CB C 73 32.100 32.037 0.063 1
1 931 . 12 1 1 A 73 73 VAL N N 73 127.100 127.314 -0.214 1
1 932 . 12 1 1 A 74 74 ALA H H 74 8.880 8.939 -0.059 1
1 933 . 12 1 1 A 74 74 ALA HA H 74 4.500 5.092 -0.592 1
1 937 . 12 1 1 A 74 74 ALA C C 74 174.800 174.692 0.108 1
1 938 . 12 1 1 A 74 74 ALA CA C 74 50.500 50.185 0.315 1
1 939 . 12 1 1 A 74 74 ALA CB C 74 22.500 23.948 -1.448 1
1 940 . 12 1 1 A 74 74 ALA N N 74 131.000 128.600 2.400 1
1 941 . 12 1 1 A 75 75 GLN H H 75 8.280 8.459 -0.179 1
1 942 . 12 1 1 A 75 75 GLN HA H 75 4.910 4.865 0.045 1
1 949 . 12 1 1 A 75 75 GLN C C 75 175.100 174.144 0.956 1
1 950 . 12 1 1 A 75 75 GLN CA C 75 54.600 54.027 0.573 1
1 951 . 12 1 1 A 75 75 GLN CB C 75 31.400 30.648 0.752 1
1 954 . 12 1 1 A 75 75 GLN N N 75 118.800 120.688 -1.888 1
1 956 . 12 1 1 A 76 76 PHE H H 76 8.710 9.355 -0.645 1
1 957 . 12 1 1 A 76 76 PHE HA H 76 4.660 4.900 -0.240 1
1 965 . 12 1 1 A 76 76 PHE C C 76 174.900 175.526 -0.626 1
1 966 . 12 1 1 A 76 76 PHE CA C 76 57.000 56.697 0.303 1
1 967 . 12 1 1 A 76 76 PHE CB C 76 41.000 41.809 -0.809 1
1 973 . 12 1 1 A 76 76 PHE N N 76 125.000 125.874 -0.874 1
1 974 . 12 1 1 A 77 77 ASN H H 77 9.040 8.920 0.120 1
1 975 . 12 1 1 A 77 77 ASN HA H 77 4.170 4.487 -0.317 1
1 980 . 12 1 1 A 77 77 ASN C C 77 174.200 175.722 -1.522 1
1 981 . 12 1 1 A 77 77 ASN CA C 77 53.800 54.517 -0.717 1
1 982 . 12 1 1 A 77 77 ASN CB C 77 37.400 37.534 -0.134 1
1 984 . 12 1 1 A 77 77 ASN N N 77 123.200 124.229 -1.029 1
1 986 . 12 1 1 A 78 78 GLY H H 78 8.370 8.604 -0.234 1
1 987 . 12 1 1 A 78 78 GLY HA2 H 78 3.410 3.602 -0.192 1
1 988 . 12 1 1 A 78 78 GLY HA3 H 78 3.980 3.701 0.279 1
1 989 . 12 1 1 A 78 78 GLY C C 78 173.800 173.145 0.655 1
1 990 . 12 1 1 A 78 78 GLY CA C 78 45.000 45.232 -0.232 1
1 991 . 12 1 1 A 78 78 GLY N N 78 103.300 104.793 -1.493 1
1 992 . 12 1 1 A 79 79 TYR H H 79 7.670 8.226 -0.556 1
1 993 . 12 1 1 A 79 79 TYR HA H 79 4.860 4.795 0.065 1
1 1000 . 12 1 1 A 79 79 TYR C C 79 174.800 175.750 -0.950 1
1 1001 . 12 1 1 A 79 79 TYR CA C 79 56.300 57.572 -1.272 1
1 1002 . 12 1 1 A 79 79 TYR CB C 79 40.800 40.472 0.328 1
1 1007 . 12 1 1 A 79 79 TYR N N 79 118.700 119.287 -0.587 1
1 1008 . 12 1 1 A 80 80 LEU H H 80 8.760 8.771 -0.011 1
1 1009 . 12 1 1 A 80 80 LEU HA H 80 4.830 4.552 0.278 1
1 1019 . 12 1 1 A 80 80 LEU C C 80 176.200 176.242 -0.042 1
1 1020 . 12 1 1 A 80 80 LEU CA C 80 54.700 55.107 -0.407 1
1 1021 . 12 1 1 A 80 80 LEU CB C 80 43.500 42.596 0.904 1
1 1025 . 12 1 1 A 80 80 LEU N N 80 122.600 126.057 -3.457 1
1 1026 . 12 1 1 A 81 81 SER H H 81 8.650 8.897 -0.247 1
1 1027 . 12 1 1 A 81 81 SER HA H 81 4.860 5.223 -0.363 1
1 1030 . 12 1 1 A 81 81 SER C C 81 172.600 172.411 0.189 1
1 1031 . 12 1 1 A 81 81 SER CA C 81 56.600 57.290 -0.690 1
1 1032 . 12 1 1 A 81 81 SER CB C 81 66.300 66.439 -0.139 1
1 1033 . 12 1 1 A 81 81 SER N N 81 114.700 116.830 -2.130 1
1 1034 . 12 1 1 A 82 82 LEU H H 82 8.680 8.755 -0.075 1
1 1035 . 12 1 1 A 82 82 LEU HA H 82 5.190 5.259 -0.069 1
1 1045 . 12 1 1 A 82 82 LEU C C 82 177.100 175.824 1.276 1
1 1046 . 12 1 1 A 82 82 LEU CA C 82 53.300 53.867 -0.567 1
1 1047 . 12 1 1 A 82 82 LEU CB C 82 43.800 44.219 -0.419 1
1 1051 . 12 1 1 A 82 82 LEU N N 82 119.800 122.503 -2.703 1
1 1052 . 12 1 1 A 83 83 SER H H 83 9.560 9.475 0.085 1
1 1053 . 12 1 1 A 83 83 SER HA H 83 5.390 5.207 0.183 1
1 1056 . 12 1 1 A 83 83 SER C C 83 174.200 173.779 0.421 1
1 1057 . 12 1 1 A 83 83 SER CA C 83 57.100 57.775 -0.675 1
1 1058 . 12 1 1 A 83 83 SER CB C 83 64.400 64.279 0.121 1
1 1059 . 12 1 1 A 83 83 SER N N 83 119.000 122.236 -3.236 1
1 1060 . 12 1 1 A 84 84 VAL H H 84 9.150 9.284 -0.134 1
1 1061 . 12 1 1 A 84 84 VAL HA H 84 4.490 4.670 -0.180 1
1 1069 . 12 1 1 A 84 84 VAL C C 84 174.700 175.845 -1.145 1
1 1070 . 12 1 1 A 84 84 VAL CA C 84 61.300 61.213 0.087 1
1 1071 . 12 1 1 A 84 84 VAL CB C 84 33.000 32.107 0.893 1
1 1074 . 12 1 1 A 84 84 VAL N N 84 128.300 127.240 1.060 1
1 1075 . 12 1 1 A 85 85 GLY H H 85 7.970 8.521 -0.551 1
1 1076 . 12 1 1 A 85 85 GLY HA2 H 85 4.030 4.416 -0.386 1
1 1077 . 12 1 1 A 85 85 GLY HA3 H 85 4.840 4.537 0.303 1
1 1078 . 12 1 1 A 85 85 GLY C C 85 175.800 175.211 0.589 1
1 1079 . 12 1 1 A 85 85 GLY CA C 85 44.800 44.252 0.548 1
1 1080 . 12 1 1 A 85 85 GLY N N 85 114.300 115.369 -1.069 1
1 1081 . 12 1 1 A 86 86 ASP H H 86 8.860 8.842 0.018 1
1 1082 . 12 1 1 A 86 86 ASP HA H 86 4.370 4.399 -0.029 1
1 1085 . 12 1 1 A 86 86 ASP C C 86 177.400 177.886 -0.486 1
1 1086 . 12 1 1 A 86 86 ASP CA C 86 57.400 57.160 0.240 1
1 1087 . 12 1 1 A 86 86 ASP CB C 86 40.600 40.462 0.138 1
1 1088 . 12 1 1 A 86 86 ASP N N 86 122.500 120.309 2.191 1
1 1089 . 12 1 1 A 87 87 SER H H 87 8.540 7.856 0.684 1
1 1090 . 12 1 1 A 87 87 SER HA H 87 4.620 4.288 0.332 1
1 1093 . 12 1 1 A 87 87 SER C C 87 174.700 174.559 0.141 1
1 1094 . 12 1 1 A 87 87 SER CA C 87 58.200 60.974 -2.774 1
1 1095 . 12 1 1 A 87 87 SER CB C 87 63.300 63.076 0.224 1
1 1096 . 12 1 1 A 87 87 SER N N 87 112.100 113.469 -1.369 1
1 1097 . 12 1 1 A 88 88 SER H H 88 7.880 7.678 0.202 1
1 1098 . 12 1 1 A 88 88 SER HA H 88 5.050 4.569 0.481 1
1 1101 . 12 1 1 A 88 88 SER C C 88 172.700 173.596 -0.896 1
1 1102 . 12 1 1 A 88 88 SER CA C 88 57.600 58.967 -1.367 1
1 1103 . 12 1 1 A 88 88 SER CB C 88 64.300 64.432 -0.132 1
1 1104 . 12 1 1 A 88 88 SER N N 88 119.200 116.772 2.428 1
1 1105 . 12 1 1 A 89 89 ARG H H 89 8.350 8.426 -0.076 1
1 1106 . 12 1 1 A 89 89 ARG HA H 89 4.720 5.120 -0.400 1
1 1114 . 12 1 1 A 89 89 ARG C C 89 174.200 174.454 -0.254 1
1 1115 . 12 1 1 A 89 89 ARG CA C 89 55.000 54.456 0.544 1
1 1116 . 12 1 1 A 89 89 ARG CB C 89 33.500 33.830 -0.330 1
1 1120 . 12 1 1 A 89 89 ARG N N 89 122.800 124.430 -1.630 1
1 1122 . 12 1 1 A 90 90 ILE H H 90 8.530 9.030 -0.500 1
1 1123 . 12 1 1 A 90 90 ILE HA H 90 4.790 5.013 -0.223 1
1 1133 . 12 1 1 A 90 90 ILE C C 90 175.400 175.063 0.337 1
1 1134 . 12 1 1 A 90 90 ILE CA C 90 60.600 60.091 0.509 1
1 1135 . 12 1 1 A 90 90 ILE CB C 90 40.600 40.765 -0.165 1
1 1139 . 12 1 1 A 90 90 ILE N N 90 123.100 126.686 -3.586 1
1 1140 . 12 1 1 A 91 91 GLU H H 91 9.000 8.752 0.248 1
1 1141 . 12 1 1 A 91 91 GLU HA H 91 4.730 4.894 -0.164 1
1 1146 . 12 1 1 A 91 91 GLU C C 91 175.100 176.483 -1.383 1
1 1147 . 12 1 1 A 91 91 GLU CA C 91 54.300 54.470 -0.170 1
1 1148 . 12 1 1 A 91 91 GLU CB C 91 32.400 33.193 -0.793 1
1 1150 . 12 1 1 A 91 91 GLU N N 91 126.400 127.133 -0.733 1
1 1151 . 12 1 1 A 92 92 SER H H 92 8.830 8.804 0.026 1
1 1152 . 12 1 1 A 92 92 SER HA H 92 4.700 4.541 0.159 1
1 1155 . 12 1 1 A 92 92 SER C C 92 174.600 174.475 0.125 1
1 1156 . 12 1 1 A 92 92 SER CA C 92 59.300 58.457 0.843 1
1 1157 . 12 1 1 A 92 92 SER CB C 92 63.100 64.097 -0.997 1
1 1158 . 12 1 1 A 92 92 SER N N 92 119.800 119.179 0.621 1
1 1159 . 12 1 1 A 93 93 VAL H H 93 8.350 8.525 -0.175 1
1 1160 . 12 1 1 A 93 93 VAL HA H 93 4.290 4.538 -0.248 1
1 1168 . 12 1 1 A 93 93 VAL C C 93 175.100 175.757 -0.657 1
1 1169 . 12 1 1 A 93 93 VAL CA C 93 61.300 61.010 0.290 1
1 1170 . 12 1 1 A 93 93 VAL CB C 93 33.900 34.384 -0.484 1
1 1173 . 12 1 1 A 93 93 VAL N N 93 121.800 122.475 -0.675 1
1 1174 . 12 1 1 A 94 94 ASN H H 94 8.510 8.928 -0.418 1
1 1175 . 12 1 1 A 94 94 ASN HA H 94 4.770 4.647 0.123 1
1 1180 . 12 1 1 A 94 94 ASN C C 94 175.000 174.025 0.975 1
1 1181 . 12 1 1 A 94 94 ASN CA C 94 52.700 53.840 -1.140 1
1 1182 . 12 1 1 A 94 94 ASN CB C 94 38.500 38.018 0.482 1
1 1184 . 12 1 1 A 94 94 ASN N N 94 121.800 124.237 -2.437 1
1 1186 . 12 1 1 A 95 95 VAL H H 95 7.860 8.292 -0.432 1
1 1187 . 12 1 1 A 95 95 VAL HA H 95 4.100 4.811 -0.711 1
1 1195 . 12 1 1 A 95 95 VAL C C 95 175.100 175.990 -0.890 1
1 1196 . 12 1 1 A 95 95 VAL CA C 95 61.700 60.311 1.389 1
1 1197 . 12 1 1 A 95 95 VAL CB C 95 33.100 33.489 -0.389 1
1 1200 . 12 1 1 A 95 95 VAL N N 95 119.700 121.055 -1.355 1
1 1201 . 12 1 1 A 96 96 ASN H H 96 8.490 8.511 -0.021 1
1 1202 . 12 1 1 A 96 96 ASN HA H 96 4.700 5.021 -0.321 1
1 1207 . 12 1 1 A 96 96 ASN C C 96 174.600 174.498 0.102 1
1 1208 . 12 1 1 A 96 96 ASN CA C 96 53.000 50.906 2.094 1
1 1209 . 12 1 1 A 96 96 ASN CB C 96 39.000 39.409 -0.409 1
1 1211 . 12 1 1 A 96 96 ASN N N 96 122.200 125.381 -3.181 1
1 1213 . 12 1 1 A 97 97 ILE H H 97 8.080 8.599 -0.519 1
1 1214 . 12 1 1 A 97 97 ILE HA H 97 4.370 4.813 -0.443 1
1 1224 . 12 1 1 A 97 97 ILE CA C 97 58.600 58.115 0.485 1
1 1225 . 12 1 1 A 97 97 ILE CB C 97 38.600 38.845 -0.245 1
1 1229 . 12 1 1 A 97 97 ILE N N 97 123.500 119.526 3.974 1
1 1230 . 12 1 1 A 98 98 PRO HA H 98 4.360 4.554 -0.194 1
1 1237 . 12 1 1 A 98 98 PRO C C 98 176.600 176.749 -0.149 1
1 1238 . 12 1 1 A 98 98 PRO CA C 98 63.100 63.016 0.084 1
1 1239 . 12 1 1 A 98 98 PRO CB C 98 31.800 32.369 -0.569 1
1 1242 . 12 1 1 A 99 99 LEU H H 99 8.200 8.674 -0.474 1
1 1243 . 12 1 1 A 99 99 LEU HA H 99 4.200 3.816 0.384 1
1 1253 . 12 1 1 A 99 99 LEU C C 99 177.300 176.822 0.478 1
1 1254 . 12 1 1 A 99 99 LEU CA C 99 55.000 55.657 -0.657 1
1 1255 . 12 1 1 A 99 99 LEU CB C 99 42.400 40.556 1.844 1
1 1259 . 12 1 1 A 99 99 LEU N N 99 122.500 117.947 4.553 1
1 1260 . 12 1 1 A 100 100 GLU H H 100 8.250 8.465 -0.215 1
1 1261 . 12 1 1 A 100 100 GLU HA H 100 4.140 4.409 -0.269 1
1 1266 . 12 1 1 A 100 100 GLU C C 100 176.100 176.442 -0.342 1
1 1267 . 12 1 1 A 100 100 GLU CA C 100 56.100 55.855 0.245 1
1 1268 . 12 1 1 A 100 100 GLU CB C 100 29.900 29.165 0.735 1
1 1270 . 12 1 1 A 100 100 GLU N N 100 121.000 117.810 3.190 1
1 1271 . 12 1 1 A 101 101 HIS H H 101 8.540 7.659 0.881 1
1 1272 . 12 1 1 A 101 101 HIS HA H 101 4.600 4.270 0.330 1
1 1275 . 12 1 1 A 101 101 HIS C C 101 174.200 174.770 -0.570 1
1 1276 . 12 1 1 A 101 101 HIS CA C 101 55.200 56.283 -1.083 1
1 1277 . 12 1 1 A 101 101 HIS CB C 101 29.000 30.032 -1.032 1
1 1278 . 12 1 1 A 101 101 HIS N N 101 119.400 122.150 -2.750 1
1 1279 . 12 1 1 A 102 102 HIS H H 102 8.660 8.320 0.340 1
1 1280 . 12 1 1 A 102 102 HIS HA H 102 4.630 4.151 0.479 1
1 1283 . 12 1 1 A 102 102 HIS C C 102 174.200 173.747 0.453 1
1 1284 . 12 1 1 A 102 102 HIS CA C 102 55.200 58.218 -3.018 1
1 1285 . 12 1 1 A 102 102 HIS CB C 102 29.100 28.289 0.811 1
1 1286 . 12 1 1 A 102 102 HIS N N 102 119.700 124.333 -4.633 1
1 1287 . 12 1 1 A 103 103 HIS H H 103 8.680 8.547 0.133 1
1 1288 . 12 1 1 A 103 103 HIS HA H 103 4.640 5.055 -0.415 1
1 1291 . 12 1 1 A 103 103 HIS C C 103 174.200 172.989 1.211 1
1 1292 . 12 1 1 A 103 103 HIS CA C 103 55.200 55.733 -0.533 1
1 1293 . 12 1 1 A 103 103 HIS CB C 103 29.200 33.330 -4.130 1
1 1294 . 12 1 1 A 103 103 HIS N N 103 120.500 120.881 -0.381 1
1 1295 . 12 1 1 A 104 104 HIS H H 104 8.580 8.136 0.444 1
1 1296 . 12 1 1 A 104 104 HIS HA H 104 4.590 4.656 -0.066 1
1 1299 . 12 1 1 A 104 104 HIS C C 104 174.200 175.621 -1.421 1
1 1300 . 12 1 1 A 104 104 HIS CA C 104 55.200 53.844 1.356 1
1 1301 . 12 1 1 A 104 104 HIS CB C 104 29.300 29.460 -0.160 1
1 1302 . 12 1 1 A 104 104 HIS N N 104 120.700 120.486 0.214 1
1 1303 . 12 1 1 A 105 105 HIS H H 105 8.550 7.138 1.412 1
1 1304 . 12 1 1 A 105 105 HIS HA H 105 4.610 3.812 0.798 1
1 1307 . 12 1 1 A 105 105 HIS C C 105 173.500 177.918 -4.418 1
1 1308 . 12 1 1 A 105 105 HIS CA C 105 55.400 59.608 -4.208 1
1 1309 . 12 1 1 A 105 105 HIS CB C 105 28.800 30.114 -1.314 1
1 1310 . 12 1 1 A 105 105 HIS N N 105 119.000 119.499 -0.499 1
1 7 . 13 1 1 A 2 2 ASP H H 2 8.890 8.749 0.141 1
1 8 . 13 1 1 A 2 2 ASP HA H 2 4.740 5.098 -0.358 1
1 11 . 13 1 1 A 2 2 ASP C C 2 174.600 174.597 0.003 1
1 12 . 13 1 1 A 2 2 ASP CA C 2 53.800 53.745 0.055 1
1 13 . 13 1 1 A 2 2 ASP CB C 2 41.500 45.072 -3.572 1
1 14 . 13 1 1 A 2 2 ASP N N 2 122.100 120.901 1.199 1
1 15 . 13 1 1 A 3 3 LEU H H 3 8.280 8.534 -0.254 1
1 16 . 13 1 1 A 3 3 LEU HA H 3 4.420 4.770 -0.350 1
1 26 . 13 1 1 A 3 3 LEU C C 3 176.900 176.363 0.537 1
1 27 . 13 1 1 A 3 3 LEU CA C 3 55.000 54.647 0.353 1
1 28 . 13 1 1 A 3 3 LEU CB C 3 42.700 42.546 0.154 1
1 32 . 13 1 1 A 3 3 LEU N N 3 122.300 125.302 -3.002 1
1 33 . 13 1 1 A 4 4 VAL H H 4 8.640 8.618 0.022 1
1 34 . 13 1 1 A 4 4 VAL HA H 4 4.540 4.976 -0.436 1
1 42 . 13 1 1 A 4 4 VAL C C 4 175.800 175.126 0.674 1
1 43 . 13 1 1 A 4 4 VAL CA C 4 59.400 58.637 0.763 1
1 44 . 13 1 1 A 4 4 VAL CB C 4 35.400 35.790 -0.390 1
1 47 . 13 1 1 A 4 4 VAL N N 4 122.600 117.784 4.816 1
1 48 . 13 1 1 A 5 5 LYS H H 5 8.630 8.664 -0.034 1
1 49 . 13 1 1 A 5 5 LYS HA H 5 4.450 4.419 0.031 1
1 58 . 13 1 1 A 5 5 LYS C C 5 179.400 178.482 0.918 1
1 59 . 13 1 1 A 5 5 LYS CA C 5 53.600 55.772 -2.172 1
1 60 . 13 1 1 A 5 5 LYS CB C 5 30.900 33.229 -2.329 1
1 64 . 13 1 1 A 5 5 LYS N N 5 121.100 121.716 -0.616 1
1 65 . 13 1 1 A 6 6 ILE H H 6 10.320 8.892 1.428 1
1 66 . 13 1 1 A 6 6 ILE HA H 6 3.440 3.714 -0.274 1
1 76 . 13 1 1 A 6 6 ILE C C 6 178.300 177.893 0.407 1
1 77 . 13 1 1 A 6 6 ILE CA C 6 65.700 64.994 0.706 1
1 78 . 13 1 1 A 6 6 ILE CB C 6 35.900 37.691 -1.791 1
1 82 . 13 1 1 A 6 6 ILE N N 6 125.400 122.418 2.982 1
1 83 . 13 1 1 A 7 7 ARG H H 7 8.210 8.641 -0.431 1
1 84 . 13 1 1 A 7 7 ARG HA H 7 3.850 4.220 -0.370 1
1 92 . 13 1 1 A 7 7 ARG C C 7 175.600 176.764 -1.164 1
1 93 . 13 1 1 A 7 7 ARG CA C 7 57.800 57.582 0.218 1
1 94 . 13 1 1 A 7 7 ARG CB C 7 30.300 28.863 1.437 1
1 98 . 13 1 1 A 7 7 ARG N N 7 118.800 120.683 -1.883 1
1 100 . 13 1 1 A 8 8 ASP H H 8 7.850 7.738 0.112 1
1 101 . 13 1 1 A 8 8 ASP HA H 8 4.700 4.724 -0.024 1
1 104 . 13 1 1 A 8 8 ASP C C 8 176.100 176.364 -0.264 1
1 105 . 13 1 1 A 8 8 ASP CA C 8 54.100 54.358 -0.258 1
1 106 . 13 1 1 A 8 8 ASP CB C 8 41.200 41.473 -0.273 1
1 107 . 13 1 1 A 8 8 ASP N N 8 116.800 118.508 -1.708 1
1 108 . 13 1 1 A 9 9 VAL H H 9 7.240 7.375 -0.135 1
1 109 . 13 1 1 A 9 9 VAL HA H 9 3.710 3.957 -0.247 1
1 117 . 13 1 1 A 9 9 VAL C C 9 174.900 176.214 -1.314 1
1 118 . 13 1 1 A 9 9 VAL CA C 9 64.300 63.353 0.947 1
1 119 . 13 1 1 A 9 9 VAL CB C 9 31.500 31.840 -0.340 1
1 122 . 13 1 1 A 9 9 VAL N N 9 121.800 122.131 -0.331 1
1 123 . 13 1 1 A 10 10 SER H H 10 8.600 8.221 0.379 1
1 124 . 13 1 1 A 10 10 SER HA H 10 4.600 4.982 -0.382 1
1 127 . 13 1 1 A 10 10 SER CA C 10 56.700 56.541 0.159 1
1 128 . 13 1 1 A 10 10 SER CB C 10 66.100 64.629 1.471 1
1 129 . 13 1 1 A 10 10 SER N N 10 122.200 119.211 2.989 1
1 130 . 13 1 1 A 11 11 LEU H H 11 8.660 8.968 -0.308 1
1 131 . 13 1 1 A 11 11 LEU HA H 11 3.900 3.974 -0.074 1
1 141 . 13 1 1 A 11 11 LEU C C 11 178.100 179.308 -1.208 1
1 142 . 13 1 1 A 11 11 LEU CA C 11 56.700 57.964 -1.264 1
1 143 . 13 1 1 A 11 11 LEU CB C 11 41.400 41.207 0.193 1
1 147 . 13 1 1 A 11 11 LEU N N 11 120.300 126.661 -6.361 1
1 148 . 13 1 1 A 12 12 SER H H 12 8.160 7.644 0.516 1
1 149 . 13 1 1 A 12 12 SER HA H 12 4.270 4.290 -0.020 1
1 152 . 13 1 1 A 12 12 SER C C 12 174.200 174.951 -0.751 1
1 153 . 13 1 1 A 12 12 SER CA C 12 59.900 61.444 -1.544 1
1 154 . 13 1 1 A 12 12 SER CB C 12 63.100 62.836 0.264 1
1 155 . 13 1 1 A 12 12 SER N N 12 112.100 114.285 -2.185 1
1 156 . 13 1 1 A 13 13 THR H H 13 7.460 7.560 -0.100 1
1 157 . 13 1 1 A 13 13 THR HA H 13 4.760 4.665 0.095 1
1 162 . 13 1 1 A 13 13 THR CA C 13 56.600 58.991 -2.391 1
1 163 . 13 1 1 A 13 13 THR CB C 13 70.100 68.943 1.157 1
1 165 . 13 1 1 A 13 13 THR N N 13 114.700 111.514 3.186 1
1 166 . 13 1 1 A 14 14 PRO HA H 14 4.050 4.337 -0.287 1
1 173 . 13 1 1 A 14 14 PRO C C 14 175.800 175.842 -0.042 1
1 174 . 13 1 1 A 14 14 PRO CA C 14 65.100 64.462 0.638 1
1 175 . 13 1 1 A 14 14 PRO CB C 14 32.100 31.660 0.440 1
1 178 . 13 1 1 A 15 15 TYR H H 15 7.380 7.506 -0.126 1
1 179 . 13 1 1 A 15 15 TYR HA H 15 5.570 5.567 0.003 1
1 186 . 13 1 1 A 15 15 TYR C C 15 176.100 175.051 1.049 1
1 187 . 13 1 1 A 15 15 TYR CA C 15 56.400 56.677 -0.277 1
1 188 . 13 1 1 A 15 15 TYR CB C 15 41.500 40.233 1.267 1
1 193 . 13 1 1 A 15 15 TYR N N 15 113.800 117.697 -3.897 1
1 194 . 13 1 1 A 16 16 VAL H H 16 9.010 8.663 0.347 1
1 195 . 13 1 1 A 16 16 VAL HA H 16 4.920 5.081 -0.161 1
1 203 . 13 1 1 A 16 16 VAL C C 16 174.300 173.408 0.892 1
1 204 . 13 1 1 A 16 16 VAL CA C 16 59.600 59.483 0.117 1
1 205 . 13 1 1 A 16 16 VAL CB C 16 36.800 36.287 0.513 1
1 208 . 13 1 1 A 16 16 VAL N N 16 113.800 118.272 -4.472 1
1 209 . 13 1 1 A 17 17 SER H H 17 7.960 8.835 -0.875 1
1 210 . 13 1 1 A 17 17 SER HA H 17 5.860 5.610 0.250 1
1 213 . 13 1 1 A 17 17 SER C C 17 172.700 173.267 -0.567 1
1 214 . 13 1 1 A 17 17 SER CA C 17 57.300 56.480 0.820 1
1 215 . 13 1 1 A 17 17 SER CB C 17 64.000 65.046 -1.046 1
1 216 . 13 1 1 A 17 17 SER N N 17 117.100 117.277 -0.177 1
1 217 . 13 1 1 A 18 18 VAL H H 18 8.570 8.756 -0.186 1
1 218 . 13 1 1 A 18 18 VAL HA H 18 4.900 5.160 -0.260 1
1 226 . 13 1 1 A 18 18 VAL C C 18 173.700 173.584 0.116 1
1 227 . 13 1 1 A 18 18 VAL CA C 18 58.800 59.078 -0.278 1
1 228 . 13 1 1 A 18 18 VAL CB C 18 36.700 36.017 0.683 1
1 231 . 13 1 1 A 18 18 VAL N N 18 113.500 119.028 -5.528 1
1 232 . 13 1 1 A 19 19 ILE H H 19 8.490 8.611 -0.121 1
1 233 . 13 1 1 A 19 19 ILE HA H 19 5.300 4.954 0.346 1
1 243 . 13 1 1 A 19 19 ILE C C 19 175.800 174.807 0.993 1
1 244 . 13 1 1 A 19 19 ILE CA C 19 59.700 59.250 0.450 1
1 245 . 13 1 1 A 19 19 ILE CB C 19 41.700 42.659 -0.959 1
1 249 . 13 1 1 A 19 19 ILE N N 19 120.600 121.796 -1.196 1
1 250 . 13 1 1 A 20 20 GLY H H 20 8.670 7.970 0.700 1
1 251 . 13 1 1 A 20 20 GLY HA2 H 20 3.760 4.153 -0.393 1
1 252 . 13 1 1 A 20 20 GLY HA3 H 20 4.190 4.156 0.034 1
1 253 . 13 1 1 A 20 20 GLY C C 20 169.900 171.438 -1.538 1
1 254 . 13 1 1 A 20 20 GLY CA C 20 46.000 45.991 0.009 1
1 255 . 13 1 1 A 20 20 GLY N N 20 110.200 113.440 -3.240 1
1 256 . 13 1 1 A 21 21 LYS H H 21 8.920 8.321 0.599 1
1 257 . 13 1 1 A 21 21 LYS HA H 21 5.210 5.075 0.135 1
1 266 . 13 1 1 A 21 21 LYS C C 21 176.400 175.340 1.060 1
1 267 . 13 1 1 A 21 21 LYS CA C 21 54.400 54.734 -0.334 1
1 268 . 13 1 1 A 21 21 LYS CB C 21 35.400 35.034 0.366 1
1 272 . 13 1 1 A 21 21 LYS N N 21 119.100 120.630 -1.530 1
1 273 . 13 1 1 A 22 22 ILE H H 22 8.900 8.710 0.190 1
1 274 . 13 1 1 A 22 22 ILE HA H 22 5.050 5.050 0.000 1
1 284 . 13 1 1 A 22 22 ILE C C 22 176.900 175.156 1.744 1
1 285 . 13 1 1 A 22 22 ILE CA C 22 57.800 60.222 -2.422 1
1 286 . 13 1 1 A 22 22 ILE CB C 22 36.200 39.583 -3.383 1
1 290 . 13 1 1 A 22 22 ILE N N 22 130.000 128.286 1.714 1
1 291 . 13 1 1 A 23 23 THR H H 23 9.020 8.695 0.325 1
1 292 . 13 1 1 A 23 23 THR HA H 23 4.660 4.861 -0.201 1
1 297 . 13 1 1 A 23 23 THR C C 23 174.000 174.502 -0.502 1
1 298 . 13 1 1 A 23 23 THR CA C 23 60.800 59.905 0.895 1
1 299 . 13 1 1 A 23 23 THR CB C 23 73.400 71.490 1.910 1
1 301 . 13 1 1 A 23 23 THR N N 23 118.200 117.775 0.425 1
1 302 . 13 1 1 A 24 24 GLY H H 24 8.430 8.456 -0.026 1
1 303 . 13 1 1 A 24 24 GLY HA2 H 24 3.910 3.915 -0.005 1
1 304 . 13 1 1 A 24 24 GLY HA3 H 24 3.910 4.038 -0.128 1
1 305 . 13 1 1 A 24 24 GLY C C 24 175.400 174.264 1.136 1
1 306 . 13 1 1 A 24 24 GLY CA C 24 47.100 46.847 0.253 1
1 307 . 13 1 1 A 24 24 GLY N N 24 107.200 108.853 -1.653 1
1 308 . 13 1 1 A 25 25 ILE H H 25 9.370 7.973 1.397 1
1 309 . 13 1 1 A 25 25 ILE HA H 25 4.480 4.038 0.442 1
1 319 . 13 1 1 A 25 25 ILE C C 25 178.200 174.615 3.585 1
1 320 . 13 1 1 A 25 25 ILE CA C 25 59.200 61.895 -2.695 1
1 321 . 13 1 1 A 25 25 ILE CB C 25 35.400 36.975 -1.575 1
1 325 . 13 1 1 A 25 25 ILE N N 25 120.600 120.056 0.544 1
1 326 . 13 1 1 A 26 26 HIS H H 26 9.000 9.090 -0.090 1
1 327 . 13 1 1 A 26 26 HIS HA H 26 4.770 5.003 -0.233 1
1 330 . 13 1 1 A 26 26 HIS C C 26 172.700 173.817 -1.117 1
1 331 . 13 1 1 A 26 26 HIS CA C 26 55.000 54.186 0.814 1
1 332 . 13 1 1 A 26 26 HIS CB C 26 31.100 33.433 -2.333 1
1 333 . 13 1 1 A 26 26 HIS N N 26 123.800 125.507 -1.707 1
1 334 . 13 1 1 A 27 27 LYS H H 27 8.930 8.945 -0.015 1
1 335 . 13 1 1 A 27 27 LYS HA H 27 4.770 4.280 0.490 1
1 344 . 13 1 1 A 27 27 LYS C C 27 175.300 175.289 0.011 1
1 345 . 13 1 1 A 27 27 LYS CA C 27 55.100 55.765 -0.665 1
1 346 . 13 1 1 A 27 27 LYS CB C 27 34.400 33.442 0.958 1
1 350 . 13 1 1 A 27 27 LYS N N 27 125.900 123.851 2.049 1
1 351 . 13 1 1 A 28 28 LYS H H 28 8.880 8.100 0.780 1
1 352 . 13 1 1 A 28 28 LYS HA H 28 4.570 4.852 -0.282 1
1 361 . 13 1 1 A 28 28 LYS C C 28 174.500 173.709 0.791 1
1 362 . 13 1 1 A 28 28 LYS CA C 28 54.600 55.115 -0.515 1
1 363 . 13 1 1 A 28 28 LYS CB C 28 35.300 36.699 -1.399 1
1 367 . 13 1 1 A 28 28 LYS N N 28 127.400 126.405 0.995 1
1 368 . 13 1 1 A 29 29 GLU H H 29 8.440 8.507 -0.067 1
1 369 . 13 1 1 A 29 29 GLU HA H 29 5.260 5.222 0.038 1
1 374 . 13 1 1 A 29 29 GLU C C 29 175.800 175.693 0.107 1
1 375 . 13 1 1 A 29 29 GLU CA C 29 54.800 54.791 0.009 1
1 376 . 13 1 1 A 29 29 GLU CB C 29 31.500 33.081 -1.581 1
1 378 . 13 1 1 A 29 29 GLU N N 29 122.200 124.629 -2.429 1
1 379 . 13 1 1 A 30 30 TYR H H 30 8.960 8.762 0.198 1
1 380 . 13 1 1 A 30 30 TYR HA H 30 4.820 5.233 -0.413 1
1 387 . 13 1 1 A 30 30 TYR C C 30 172.600 173.372 -0.772 1
1 388 . 13 1 1 A 30 30 TYR CA C 30 56.300 55.675 0.625 1
1 389 . 13 1 1 A 30 30 TYR CB C 30 40.500 41.212 -0.712 1
1 394 . 13 1 1 A 30 30 TYR N N 30 121.100 118.710 2.390 1
1 395 . 13 1 1 A 31 31 GLU H H 31 8.610 8.526 0.084 1
1 396 . 13 1 1 A 31 31 GLU HA H 31 4.810 4.614 0.196 1
1 401 . 13 1 1 A 31 31 GLU C C 31 176.100 175.428 0.672 1
1 402 . 13 1 1 A 31 31 GLU CA C 31 55.100 57.010 -1.910 1
1 403 . 13 1 1 A 31 31 GLU CB C 31 30.300 30.378 -0.078 1
1 405 . 13 1 1 A 31 31 GLU N N 31 121.800 120.398 1.402 1
1 406 . 13 1 1 A 32 32 SER H H 32 8.570 8.917 -0.347 1
1 407 . 13 1 1 A 32 32 SER HA H 32 4.520 4.846 -0.326 1
1 410 . 13 1 1 A 32 32 SER C C 32 174.300 173.488 0.812 1
1 411 . 13 1 1 A 32 32 SER CA C 32 57.300 57.316 -0.016 1
1 412 . 13 1 1 A 32 32 SER CB C 32 64.100 65.472 -1.372 1
1 413 . 13 1 1 A 32 32 SER N N 32 118.500 117.388 1.112 1
1 414 . 13 1 1 A 33 33 ASP H H 33 9.290 9.354 -0.064 1
1 415 . 13 1 1 A 33 33 ASP HA H 33 4.340 4.284 0.056 1
1 418 . 13 1 1 A 33 33 ASP C C 33 175.900 175.289 0.611 1
1 419 . 13 1 1 A 33 33 ASP CA C 33 55.000 55.020 -0.020 1
1 420 . 13 1 1 A 33 33 ASP CB C 33 39.300 39.737 -0.437 1
1 421 . 13 1 1 A 33 33 ASP N N 33 125.700 128.688 -2.988 1
1 422 . 13 1 1 A 34 34 GLY H H 34 8.690 8.577 0.113 1
1 423 . 13 1 1 A 34 34 GLY HA2 H 34 3.660 3.761 -0.101 1
1 424 . 13 1 1 A 34 34 GLY HA3 H 34 4.140 3.765 0.375 1
1 425 . 13 1 1 A 34 34 GLY C C 34 174.200 173.732 0.468 1
1 426 . 13 1 1 A 34 34 GLY CA C 34 45.600 45.439 0.161 1
1 427 . 13 1 1 A 34 34 GLY N N 34 104.800 104.389 0.411 1
1 428 . 13 1 1 A 35 35 THR H H 35 7.840 7.820 0.020 1
1 429 . 13 1 1 A 35 35 THR HA H 35 4.660 4.577 0.083 1
1 434 . 13 1 1 A 35 35 THR C C 35 173.000 173.271 -0.271 1
1 435 . 13 1 1 A 35 35 THR CA C 35 60.200 61.264 -1.064 1
1 436 . 13 1 1 A 35 35 THR CB C 35 71.200 71.391 -0.191 1
1 438 . 13 1 1 A 35 35 THR N N 35 114.800 116.278 -1.478 1
1 439 . 13 1 1 A 36 36 THR H H 36 8.480 8.640 -0.160 1
1 440 . 13 1 1 A 36 36 THR HA H 36 4.620 4.487 0.133 1
1 445 . 13 1 1 A 36 36 THR C C 36 173.800 174.314 -0.514 1
1 446 . 13 1 1 A 36 36 THR CA C 36 62.300 62.953 -0.653 1
1 447 . 13 1 1 A 36 36 THR CB C 36 69.500 69.506 -0.006 1
1 449 . 13 1 1 A 36 36 THR N N 36 119.400 121.193 -1.793 1
1 450 . 13 1 1 A 37 37 LYS H H 37 8.880 8.575 0.305 1
1 451 . 13 1 1 A 37 37 LYS HA H 37 4.570 4.877 -0.307 1
1 460 . 13 1 1 A 37 37 LYS C C 37 174.500 175.979 -1.479 1
1 461 . 13 1 1 A 37 37 LYS CA C 37 54.600 54.029 0.571 1
1 462 . 13 1 1 A 37 37 LYS CB C 37 35.500 36.042 -0.542 1
1 466 . 13 1 1 A 37 37 LYS N N 37 128.000 124.962 3.038 1
1 467 . 13 1 1 A 38 38 SER H H 38 8.370 8.872 -0.502 1
1 468 . 13 1 1 A 38 38 SER HA H 38 5.250 5.114 0.136 1
1 471 . 13 1 1 A 38 38 SER C C 38 173.200 173.723 -0.523 1
1 472 . 13 1 1 A 38 38 SER CA C 38 57.900 57.085 0.815 1
1 473 . 13 1 1 A 38 38 SER CB C 38 65.500 64.771 0.729 1
1 474 . 13 1 1 A 38 38 SER N N 38 114.300 116.850 -2.550 1
1 475 . 13 1 1 A 39 39 VAL H H 39 9.020 8.874 0.146 1
1 476 . 13 1 1 A 39 39 VAL HA H 39 4.900 4.944 -0.044 1
1 484 . 13 1 1 A 39 39 VAL C C 39 173.200 172.814 0.386 1
1 485 . 13 1 1 A 39 39 VAL CA C 39 59.200 59.736 -0.536 1
1 486 . 13 1 1 A 39 39 VAL CB C 39 34.600 35.399 -0.799 1
1 489 . 13 1 1 A 39 39 VAL N N 39 123.600 120.941 2.659 1
1 490 . 13 1 1 A 40 40 TYR H H 40 8.900 8.939 -0.039 1
1 491 . 13 1 1 A 40 40 TYR HA H 40 4.730 5.408 -0.678 1
1 498 . 13 1 1 A 40 40 TYR CA C 40 56.500 56.753 -0.253 1
1 499 . 13 1 1 A 40 40 TYR CB C 40 39.000 40.523 -1.523 1
1 504 . 13 1 1 A 40 40 TYR N N 40 126.300 126.818 -0.518 1
1 505 . 13 1 1 A 41 41 GLN H H 41 8.630 8.507 0.123 1
1 506 . 13 1 1 A 41 41 GLN HA H 41 5.330 5.319 0.011 1
1 513 . 13 1 1 A 41 41 GLN C C 41 175.500 175.915 -0.415 1
1 514 . 13 1 1 A 41 41 GLN CA C 41 53.800 54.157 -0.357 1
1 515 . 13 1 1 A 41 41 GLN CB C 41 32.100 31.934 0.166 1
1 518 . 13 1 1 A 41 41 GLN N N 41 122.000 122.020 -0.020 1
1 520 . 13 1 1 A 42 42 GLY H H 42 8.560 7.911 0.649 1
1 521 . 13 1 1 A 42 42 GLY HA2 H 42 3.680 4.315 -0.635 1
1 522 . 13 1 1 A 42 42 GLY HA3 H 42 4.020 4.373 -0.353 1
1 523 . 13 1 1 A 42 42 GLY C C 42 171.600 171.097 0.503 1
1 524 . 13 1 1 A 42 42 GLY CA C 42 47.300 46.198 1.102 1
1 525 . 13 1 1 A 42 42 GLY N N 42 113.000 108.851 4.149 1
1 526 . 13 1 1 A 43 43 TYR H H 43 9.320 8.359 0.961 1
1 527 . 13 1 1 A 43 43 TYR HA H 43 5.280 5.397 -0.117 1
1 534 . 13 1 1 A 43 43 TYR C C 43 173.200 174.183 -0.983 1
1 535 . 13 1 1 A 43 43 TYR CA C 43 57.600 56.336 1.264 1
1 536 . 13 1 1 A 43 43 TYR CB C 43 42.400 41.952 0.448 1
1 541 . 13 1 1 A 43 43 TYR N N 43 126.300 118.908 7.392 1
1 542 . 13 1 1 A 44 44 ILE H H 44 9.160 8.717 0.443 1
1 543 . 13 1 1 A 44 44 ILE HA H 44 5.270 5.417 -0.147 1
1 553 . 13 1 1 A 44 44 ILE C C 44 172.900 173.693 -0.793 1
1 554 . 13 1 1 A 44 44 ILE CA C 44 59.000 59.462 -0.462 1
1 555 . 13 1 1 A 44 44 ILE CB C 44 42.200 41.894 0.306 1
1 559 . 13 1 1 A 44 44 ILE N N 44 117.700 123.665 -5.965 1
1 560 . 13 1 1 A 45 45 GLU H H 45 8.420 8.856 -0.436 1
1 561 . 13 1 1 A 45 45 GLU HA H 45 5.600 5.369 0.231 1
1 566 . 13 1 1 A 45 45 GLU C C 45 174.300 174.402 -0.102 1
1 567 . 13 1 1 A 45 45 GLU CA C 45 54.000 54.746 -0.746 1
1 568 . 13 1 1 A 45 45 GLU CB C 45 34.400 33.813 0.587 1
1 570 . 13 1 1 A 45 45 GLU N N 45 123.600 128.080 -4.480 1
1 571 . 13 1 1 A 46 46 ASP H H 46 8.530 8.567 -0.037 1
1 572 . 13 1 1 A 46 46 ASP HA H 46 5.070 4.973 0.097 1
1 575 . 13 1 1 A 46 46 ASP C C 46 175.000 175.493 -0.493 1
1 576 . 13 1 1 A 46 46 ASP CA C 46 51.800 52.823 -1.023 1
1 577 . 13 1 1 A 46 46 ASP CB C 46 41.300 44.033 -2.733 1
1 578 . 13 1 1 A 46 46 ASP N N 46 125.500 123.966 1.534 1
1 579 . 13 1 1 A 47 47 ASP H H 47 9.160 8.663 0.497 1
1 580 . 13 1 1 A 47 47 ASP HA H 47 4.430 4.335 0.095 1
1 583 . 13 1 1 A 47 47 ASP C C 47 176.000 178.132 -2.132 1
1 584 . 13 1 1 A 47 47 ASP CA C 47 55.000 56.977 -1.977 1
1 585 . 13 1 1 A 47 47 ASP CB C 47 38.900 40.691 -1.791 1
1 586 . 13 1 1 A 47 47 ASP N N 47 114.200 123.798 -9.598 1
1 587 . 13 1 1 A 48 48 THR H H 48 9.470 7.645 1.825 1
1 588 . 13 1 1 A 48 48 THR HA H 48 4.520 4.216 0.304 1
1 593 . 13 1 1 A 48 48 THR C C 48 174.500 174.173 0.327 1
1 594 . 13 1 1 A 48 48 THR CA C 48 62.600 63.287 -0.687 1
1 595 . 13 1 1 A 48 48 THR CB C 48 70.400 68.591 1.809 1
1 597 . 13 1 1 A 48 48 THR N N 48 111.800 114.047 -2.247 1
1 598 . 13 1 1 A 49 49 ALA H H 49 7.850 7.652 0.198 1
1 599 . 13 1 1 A 49 49 ALA HA H 49 4.440 4.498 -0.058 1
1 603 . 13 1 1 A 49 49 ALA C C 49 173.200 175.556 -2.356 1
1 604 . 13 1 1 A 49 49 ALA CA C 49 52.700 50.993 1.707 1
1 605 . 13 1 1 A 49 49 ALA CB C 49 21.300 20.648 0.652 1
1 606 . 13 1 1 A 49 49 ALA N N 49 123.400 121.304 2.096 1
1 607 . 13 1 1 A 50 50 ARG H H 50 8.160 8.918 -0.758 1
1 608 . 13 1 1 A 50 50 ARG HA H 50 5.350 5.580 -0.230 1
1 616 . 13 1 1 A 50 50 ARG C C 50 174.700 174.701 -0.001 1
1 617 . 13 1 1 A 50 50 ARG CA C 50 54.000 54.421 -0.421 1
1 618 . 13 1 1 A 50 50 ARG CB C 50 34.500 34.484 0.016 1
1 622 . 13 1 1 A 50 50 ARG N N 50 117.400 114.927 2.473 1
1 624 . 13 1 1 A 51 51 ILE H H 51 9.390 8.552 0.838 1
1 625 . 13 1 1 A 51 51 ILE HA H 51 4.790 4.908 -0.118 1
1 635 . 13 1 1 A 51 51 ILE C C 51 172.600 174.767 -2.167 1
1 636 . 13 1 1 A 51 51 ILE CA C 51 60.000 58.943 1.057 1
1 637 . 13 1 1 A 51 51 ILE CB C 51 42.800 41.638 1.162 1
1 641 . 13 1 1 A 51 51 ILE N N 51 124.600 120.778 3.822 1
1 642 . 13 1 1 A 52 52 ARG H H 52 7.980 8.319 -0.339 1
1 643 . 13 1 1 A 52 52 ARG HA H 52 4.170 4.207 -0.037 1
1 651 . 13 1 1 A 52 52 ARG C C 52 174.600 176.279 -1.679 1
1 652 . 13 1 1 A 52 52 ARG CA C 52 57.100 56.120 0.980 1
1 653 . 13 1 1 A 52 52 ARG CB C 52 31.300 30.829 0.471 1
1 657 . 13 1 1 A 52 52 ARG N N 52 125.900 125.574 0.326 1
1 659 . 13 1 1 A 53 53 ILE H H 53 8.290 8.513 -0.223 1
1 660 . 13 1 1 A 53 53 ILE HA H 53 5.160 5.060 0.100 1
1 670 . 13 1 1 A 53 53 ILE C C 53 172.400 174.732 -2.332 1
1 671 . 13 1 1 A 53 53 ILE CA C 53 58.600 59.246 -0.646 1
1 672 . 13 1 1 A 53 53 ILE CB C 53 41.900 42.468 -0.568 1
1 676 . 13 1 1 A 53 53 ILE N N 53 118.500 119.395 -0.895 1
1 677 . 13 1 1 A 54 54 SER H H 54 8.350 9.101 -0.751 1
1 678 . 13 1 1 A 54 54 SER HA H 54 5.070 5.311 -0.241 1
1 681 . 13 1 1 A 54 54 SER C C 54 172.400 171.873 0.527 1
1 682 . 13 1 1 A 54 54 SER CA C 54 57.000 56.663 0.337 1
1 683 . 13 1 1 A 54 54 SER CB C 54 65.900 65.669 0.231 1
1 684 . 13 1 1 A 54 54 SER N N 54 120.700 118.318 2.382 1
1 685 . 13 1 1 A 55 55 SER H H 55 9.130 9.300 -0.170 1
1 686 . 13 1 1 A 55 55 SER HA H 55 5.270 5.126 0.144 1
1 690 . 13 1 1 A 55 55 SER C C 55 174.400 172.723 1.677 1
1 691 . 13 1 1 A 55 55 SER CA C 55 55.500 56.698 -1.198 1
1 692 . 13 1 1 A 55 55 SER CB C 55 64.500 64.568 -0.068 1
1 693 . 13 1 1 A 55 55 SER N N 55 117.200 119.707 -2.507 1
1 694 . 13 1 1 A 56 56 PHE H H 56 8.970 8.763 0.207 1
1 695 . 13 1 1 A 56 56 PHE HA H 56 4.600 4.986 -0.386 1
1 703 . 13 1 1 A 56 56 PHE C C 56 176.500 177.106 -0.606 1
1 704 . 13 1 1 A 56 56 PHE CA C 56 58.300 57.216 1.084 1
1 705 . 13 1 1 A 56 56 PHE CB C 56 37.900 40.882 -2.982 1
1 711 . 13 1 1 A 56 56 PHE N N 56 129.400 126.881 2.519 1
1 712 . 13 1 1 A 57 57 GLY H H 57 8.570 8.766 -0.196 1
1 713 . 13 1 1 A 57 57 GLY HA2 H 57 4.020 4.137 -0.117 1
1 714 . 13 1 1 A 57 57 GLY HA3 H 57 4.380 4.152 0.228 1
1 715 . 13 1 1 A 57 57 GLY C C 57 173.700 174.291 -0.591 1
1 716 . 13 1 1 A 57 57 GLY CA C 57 46.300 45.568 0.732 1
1 717 . 13 1 1 A 57 57 GLY N N 57 112.500 112.237 0.263 1
1 718 . 13 1 1 A 58 58 LYS H H 58 6.800 7.930 -1.130 1
1 719 . 13 1 1 A 58 58 LYS HA H 58 4.410 4.384 0.026 1
1 728 . 13 1 1 A 58 58 LYS C C 58 174.800 175.448 -0.648 1
1 729 . 13 1 1 A 58 58 LYS CA C 58 55.200 56.172 -0.972 1
1 730 . 13 1 1 A 58 58 LYS CB C 58 33.300 33.370 -0.070 1
1 734 . 13 1 1 A 58 58 LYS N N 58 118.700 121.136 -2.436 1
1 735 . 13 1 1 A 59 59 GLN H H 59 8.390 8.590 -0.200 1
1 736 . 13 1 1 A 59 59 GLN HA H 59 1.830 3.879 -2.049 1
1 743 . 13 1 1 A 59 59 GLN C C 59 174.100 174.298 -0.198 1
1 744 . 13 1 1 A 59 59 GLN CA C 59 57.100 54.523 2.577 1
1 745 . 13 1 1 A 59 59 GLN CB C 59 28.900 29.905 -1.005 1
1 748 . 13 1 1 A 59 59 GLN N N 59 124.000 123.018 0.982 1
1 750 . 13 1 1 A 60 60 LEU H H 60 5.320 8.131 -2.811 1
1 751 . 13 1 1 A 60 60 LEU HA H 60 4.370 4.906 -0.536 1
1 761 . 13 1 1 A 60 60 LEU CA C 60 52.800 53.476 -0.676 1
1 762 . 13 1 1 A 60 60 LEU CB C 60 46.700 45.749 0.951 1
1 766 . 13 1 1 A 60 60 LEU N N 60 121.800 124.508 -2.708 1
1 767 . 13 1 1 A 61 61 GLN H H 61 8.660 8.786 -0.126 1
1 768 . 13 1 1 A 61 61 GLN HA H 61 4.440 4.701 -0.261 1
1 775 . 13 1 1 A 61 61 GLN C C 61 174.000 175.447 -1.447 1
1 776 . 13 1 1 A 61 61 GLN CA C 61 53.800 53.821 -0.021 1
1 777 . 13 1 1 A 61 61 GLN CB C 61 31.800 31.747 0.053 1
1 780 . 13 1 1 A 61 61 GLN N N 61 120.300 120.255 0.045 1
1 782 . 13 1 1 A 62 62 ASP H H 62 8.450 8.713 -0.263 1
1 783 . 13 1 1 A 62 62 ASP HA H 62 4.130 4.443 -0.313 1
1 786 . 13 1 1 A 62 62 ASP C C 62 177.200 176.172 1.028 1
1 787 . 13 1 1 A 62 62 ASP CA C 62 55.700 54.712 0.988 1
1 788 . 13 1 1 A 62 62 ASP CB C 62 39.400 40.755 -1.355 1
1 789 . 13 1 1 A 62 62 ASP N N 62 122.400 124.294 -1.894 1
1 790 . 13 1 1 A 63 63 SER H H 63 9.210 9.001 0.209 1
1 791 . 13 1 1 A 63 63 SER HA H 63 3.850 4.045 -0.195 1
1 794 . 13 1 1 A 63 63 SER C C 63 173.200 172.781 0.419 1
1 795 . 13 1 1 A 63 63 SER CA C 63 61.700 59.062 2.638 1
1 796 . 13 1 1 A 63 63 SER CB C 63 61.800 61.632 0.168 1
1 797 . 13 1 1 A 63 63 SER N N 63 114.300 115.700 -1.400 1
1 798 . 13 1 1 A 64 64 ASP H H 64 7.960 7.401 0.559 1
1 799 . 13 1 1 A 64 64 ASP HA H 64 4.540 5.205 -0.665 1
1 802 . 13 1 1 A 64 64 ASP C C 64 174.900 174.266 0.634 1
1 803 . 13 1 1 A 64 64 ASP CA C 64 54.900 53.138 1.762 1
1 804 . 13 1 1 A 64 64 ASP CB C 64 40.900 44.138 -3.238 1
1 805 . 13 1 1 A 64 64 ASP N N 64 122.600 119.994 2.606 1
1 806 . 13 1 1 A 65 65 VAL H H 65 8.180 8.775 -0.595 1
1 807 . 13 1 1 A 65 65 VAL HA H 65 4.670 4.561 0.109 1
1 815 . 13 1 1 A 65 65 VAL C C 65 175.900 175.709 0.191 1
1 816 . 13 1 1 A 65 65 VAL CA C 65 62.300 62.710 -0.410 1
1 817 . 13 1 1 A 65 65 VAL CB C 65 31.700 31.020 0.680 1
1 820 . 13 1 1 A 65 65 VAL N N 65 123.100 124.562 -1.462 1
1 821 . 13 1 1 A 66 66 VAL H H 66 8.770 8.738 0.032 1
1 822 . 13 1 1 A 66 66 VAL HA H 66 5.160 5.156 0.004 1
1 830 . 13 1 1 A 66 66 VAL C C 66 173.600 173.304 0.296 1
1 831 . 13 1 1 A 66 66 VAL CA C 66 58.100 58.741 -0.641 1
1 832 . 13 1 1 A 66 66 VAL CB C 66 35.700 36.115 -0.415 1
1 835 . 13 1 1 A 66 66 VAL N N 66 118.100 121.109 -3.009 1
1 836 . 13 1 1 A 67 67 ARG H H 67 8.880 8.754 0.126 1
1 837 . 13 1 1 A 67 67 ARG HA H 67 5.110 5.160 -0.050 1
1 845 . 13 1 1 A 67 67 ARG C C 67 175.300 174.520 0.780 1
1 846 . 13 1 1 A 67 67 ARG CA C 67 54.200 54.343 -0.143 1
1 847 . 13 1 1 A 67 67 ARG CB C 67 32.200 33.487 -1.287 1
1 851 . 13 1 1 A 67 67 ARG N N 67 120.200 121.762 -1.562 1
1 853 . 13 1 1 A 68 68 ILE H H 68 9.220 9.044 0.176 1
1 854 . 13 1 1 A 68 68 ILE HA H 68 4.990 4.648 0.342 1
1 864 . 13 1 1 A 68 68 ILE C C 68 174.900 174.085 0.815 1
1 865 . 13 1 1 A 68 68 ILE CA C 68 58.600 59.608 -1.008 1
1 866 . 13 1 1 A 68 68 ILE CB C 68 39.300 38.891 0.409 1
1 870 . 13 1 1 A 68 68 ILE N N 68 127.200 128.283 -1.083 1
1 871 . 13 1 1 A 69 69 ASP H H 69 9.110 8.889 0.221 1
1 872 . 13 1 1 A 69 69 ASP HA H 69 5.370 5.065 0.305 1
1 875 . 13 1 1 A 69 69 ASP C C 69 175.800 175.853 -0.053 1
1 876 . 13 1 1 A 69 69 ASP CA C 69 52.400 52.946 -0.546 1
1 877 . 13 1 1 A 69 69 ASP CB C 69 43.700 43.174 0.526 1
1 878 . 13 1 1 A 69 69 ASP N N 69 123.400 127.465 -4.065 1
1 879 . 13 1 1 A 70 70 ASN H H 70 8.300 9.102 -0.802 1
1 880 . 13 1 1 A 70 70 ASN HA H 70 4.160 4.413 -0.253 1
1 885 . 13 1 1 A 70 70 ASN C C 70 176.300 174.627 1.673 1
1 886 . 13 1 1 A 70 70 ASN CA C 70 54.300 54.185 0.115 1
1 887 . 13 1 1 A 70 70 ASN CB C 70 37.500 37.557 -0.057 1
1 889 . 13 1 1 A 70 70 ASN N N 70 119.800 123.014 -3.214 1
1 891 . 13 1 1 A 71 71 ALA H H 71 9.100 7.874 1.226 1
1 892 . 13 1 1 A 71 71 ALA HA H 71 4.500 4.511 -0.011 1
1 896 . 13 1 1 A 71 71 ALA C C 71 175.700 176.534 -0.834 1
1 897 . 13 1 1 A 71 71 ALA CA C 71 51.900 52.914 -1.014 1
1 898 . 13 1 1 A 71 71 ALA CB C 71 19.600 19.875 -0.275 1
1 899 . 13 1 1 A 71 71 ALA N N 71 123.000 121.060 1.940 1
1 900 . 13 1 1 A 72 72 ARG H H 72 8.490 8.533 -0.043 1
1 901 . 13 1 1 A 72 72 ARG HA H 72 4.720 4.889 -0.169 1
1 909 . 13 1 1 A 72 72 ARG C C 72 175.800 174.831 0.969 1
1 910 . 13 1 1 A 72 72 ARG CA C 72 54.400 54.887 -0.487 1
1 911 . 13 1 1 A 72 72 ARG CB C 72 32.700 31.976 0.724 1
1 915 . 13 1 1 A 72 72 ARG N N 72 122.500 122.685 -0.185 1
1 917 . 13 1 1 A 73 73 VAL H H 73 8.310 8.236 0.074 1
1 918 . 13 1 1 A 73 73 VAL HA H 73 4.250 4.612 -0.362 1
1 926 . 13 1 1 A 73 73 VAL C C 73 174.600 175.040 -0.440 1
1 927 . 13 1 1 A 73 73 VAL CA C 73 62.800 61.544 1.256 1
1 928 . 13 1 1 A 73 73 VAL CB C 73 32.100 32.313 -0.213 1
1 931 . 13 1 1 A 73 73 VAL N N 73 127.100 127.079 0.021 1
1 932 . 13 1 1 A 74 74 ALA H H 74 8.880 8.548 0.332 1
1 933 . 13 1 1 A 74 74 ALA HA H 74 4.500 4.949 -0.449 1
1 937 . 13 1 1 A 74 74 ALA C C 74 174.800 174.696 0.104 1
1 938 . 13 1 1 A 74 74 ALA CA C 74 50.500 50.730 -0.230 1
1 939 . 13 1 1 A 74 74 ALA CB C 74 22.500 23.726 -1.226 1
1 940 . 13 1 1 A 74 74 ALA N N 74 131.000 128.221 2.779 1
1 941 . 13 1 1 A 75 75 GLN H H 75 8.280 8.372 -0.092 1
1 942 . 13 1 1 A 75 75 GLN HA H 75 4.910 4.862 0.048 1
1 949 . 13 1 1 A 75 75 GLN C C 75 175.100 174.209 0.891 1
1 950 . 13 1 1 A 75 75 GLN CA C 75 54.600 54.011 0.589 1
1 951 . 13 1 1 A 75 75 GLN CB C 75 31.400 31.415 -0.015 1
1 954 . 13 1 1 A 75 75 GLN N N 75 118.800 120.559 -1.759 1
1 956 . 13 1 1 A 76 76 PHE H H 76 8.710 9.111 -0.401 1
1 957 . 13 1 1 A 76 76 PHE HA H 76 4.660 4.974 -0.314 1
1 965 . 13 1 1 A 76 76 PHE C C 76 174.900 176.106 -1.206 1
1 966 . 13 1 1 A 76 76 PHE CA C 76 57.000 56.631 0.369 1
1 967 . 13 1 1 A 76 76 PHE CB C 76 41.000 42.109 -1.109 1
1 973 . 13 1 1 A 76 76 PHE N N 76 125.000 125.258 -0.258 1
1 974 . 13 1 1 A 77 77 ASN H H 77 9.040 9.596 -0.556 1
1 975 . 13 1 1 A 77 77 ASN HA H 77 4.170 4.521 -0.351 1
1 980 . 13 1 1 A 77 77 ASN C C 77 174.200 174.853 -0.653 1
1 981 . 13 1 1 A 77 77 ASN CA C 77 53.800 54.198 -0.398 1
1 982 . 13 1 1 A 77 77 ASN CB C 77 37.400 37.640 -0.240 1
1 984 . 13 1 1 A 77 77 ASN N N 77 123.200 122.862 0.338 1
1 986 . 13 1 1 A 78 78 GLY H H 78 8.370 8.623 -0.253 1
1 987 . 13 1 1 A 78 78 GLY HA2 H 78 3.410 3.616 -0.206 1
1 988 . 13 1 1 A 78 78 GLY HA3 H 78 3.980 3.709 0.271 1
1 989 . 13 1 1 A 78 78 GLY C C 78 173.800 173.091 0.709 1
1 990 . 13 1 1 A 78 78 GLY CA C 78 45.000 45.285 -0.285 1
1 991 . 13 1 1 A 78 78 GLY N N 78 103.300 104.257 -0.957 1
1 992 . 13 1 1 A 79 79 TYR H H 79 7.670 8.274 -0.604 1
1 993 . 13 1 1 A 79 79 TYR HA H 79 4.860 4.960 -0.100 1
1 1000 . 13 1 1 A 79 79 TYR C C 79 174.800 175.485 -0.685 1
1 1001 . 13 1 1 A 79 79 TYR CA C 79 56.300 57.203 -0.903 1
1 1002 . 13 1 1 A 79 79 TYR CB C 79 40.800 41.374 -0.574 1
1 1007 . 13 1 1 A 79 79 TYR N N 79 118.700 119.035 -0.335 1
1 1008 . 13 1 1 A 80 80 LEU H H 80 8.760 8.686 0.074 1
1 1009 . 13 1 1 A 80 80 LEU HA H 80 4.830 4.470 0.360 1
1 1019 . 13 1 1 A 80 80 LEU C C 80 176.200 176.149 0.051 1
1 1020 . 13 1 1 A 80 80 LEU CA C 80 54.700 55.103 -0.403 1
1 1021 . 13 1 1 A 80 80 LEU CB C 80 43.500 42.655 0.845 1
1 1025 . 13 1 1 A 80 80 LEU N N 80 122.600 125.354 -2.754 1
1 1026 . 13 1 1 A 81 81 SER H H 81 8.650 8.702 -0.052 1
1 1027 . 13 1 1 A 81 81 SER HA H 81 4.860 5.324 -0.464 1
1 1030 . 13 1 1 A 81 81 SER C C 81 172.600 172.295 0.305 1
1 1031 . 13 1 1 A 81 81 SER CA C 81 56.600 57.307 -0.707 1
1 1032 . 13 1 1 A 81 81 SER CB C 81 66.300 66.539 -0.239 1
1 1033 . 13 1 1 A 81 81 SER N N 81 114.700 116.972 -2.272 1
1 1034 . 13 1 1 A 82 82 LEU H H 82 8.680 8.665 0.015 1
1 1035 . 13 1 1 A 82 82 LEU HA H 82 5.190 5.097 0.093 1
1 1045 . 13 1 1 A 82 82 LEU C C 82 177.100 175.658 1.442 1
1 1046 . 13 1 1 A 82 82 LEU CA C 82 53.300 53.820 -0.520 1
1 1047 . 13 1 1 A 82 82 LEU CB C 82 43.800 43.536 0.264 1
1 1051 . 13 1 1 A 82 82 LEU N N 82 119.800 122.119 -2.319 1
1 1052 . 13 1 1 A 83 83 SER H H 83 9.560 9.648 -0.088 1
1 1053 . 13 1 1 A 83 83 SER HA H 83 5.390 5.470 -0.080 1
1 1056 . 13 1 1 A 83 83 SER C C 83 174.200 173.917 0.283 1
1 1057 . 13 1 1 A 83 83 SER CA C 83 57.100 57.853 -0.753 1
1 1058 . 13 1 1 A 83 83 SER CB C 83 64.400 64.481 -0.081 1
1 1059 . 13 1 1 A 83 83 SER N N 83 119.000 122.147 -3.147 1
1 1060 . 13 1 1 A 84 84 VAL H H 84 9.150 9.180 -0.030 1
1 1061 . 13 1 1 A 84 84 VAL HA H 84 4.490 4.700 -0.210 1
1 1069 . 13 1 1 A 84 84 VAL C C 84 174.700 175.935 -1.235 1
1 1070 . 13 1 1 A 84 84 VAL CA C 84 61.300 61.263 0.037 1
1 1071 . 13 1 1 A 84 84 VAL CB C 84 33.000 32.330 0.670 1
1 1074 . 13 1 1 A 84 84 VAL N N 84 128.300 127.289 1.011 1
1 1075 . 13 1 1 A 85 85 GLY H H 85 7.970 8.479 -0.509 1
1 1076 . 13 1 1 A 85 85 GLY HA2 H 85 4.030 4.313 -0.283 1
1 1077 . 13 1 1 A 85 85 GLY HA3 H 85 4.840 4.375 0.465 1
1 1078 . 13 1 1 A 85 85 GLY C C 85 175.800 175.075 0.725 1
1 1079 . 13 1 1 A 85 85 GLY CA C 85 44.800 44.281 0.519 1
1 1080 . 13 1 1 A 85 85 GLY N N 85 114.300 115.502 -1.202 1
1 1081 . 13 1 1 A 86 86 ASP H H 86 8.860 8.891 -0.031 1
1 1082 . 13 1 1 A 86 86 ASP HA H 86 4.370 4.392 -0.022 1
1 1085 . 13 1 1 A 86 86 ASP C C 86 177.400 177.803 -0.403 1
1 1086 . 13 1 1 A 86 86 ASP CA C 86 57.400 56.789 0.611 1
1 1087 . 13 1 1 A 86 86 ASP CB C 86 40.600 40.589 0.011 1
1 1088 . 13 1 1 A 86 86 ASP N N 86 122.500 120.567 1.933 1
1 1089 . 13 1 1 A 87 87 SER H H 87 8.540 7.911 0.629 1
1 1090 . 13 1 1 A 87 87 SER HA H 87 4.620 4.443 0.177 1
1 1093 . 13 1 1 A 87 87 SER C C 87 174.700 174.756 -0.056 1
1 1094 . 13 1 1 A 87 87 SER CA C 87 58.200 59.288 -1.088 1
1 1095 . 13 1 1 A 87 87 SER CB C 87 63.300 63.597 -0.297 1
1 1096 . 13 1 1 A 87 87 SER N N 87 112.100 112.736 -0.636 1
1 1097 . 13 1 1 A 88 88 SER H H 88 7.880 7.692 0.188 1
1 1098 . 13 1 1 A 88 88 SER HA H 88 5.050 4.705 0.345 1
1 1101 . 13 1 1 A 88 88 SER C C 88 172.700 173.421 -0.721 1
1 1102 . 13 1 1 A 88 88 SER CA C 88 57.600 58.443 -0.843 1
1 1103 . 13 1 1 A 88 88 SER CB C 88 64.300 65.199 -0.899 1
1 1104 . 13 1 1 A 88 88 SER N N 88 119.200 117.828 1.372 1
1 1105 . 13 1 1 A 89 89 ARG H H 89 8.350 8.327 0.023 1
1 1106 . 13 1 1 A 89 89 ARG HA H 89 4.720 5.277 -0.557 1
1 1114 . 13 1 1 A 89 89 ARG C C 89 174.200 174.772 -0.572 1
1 1115 . 13 1 1 A 89 89 ARG CA C 89 55.000 54.478 0.522 1
1 1116 . 13 1 1 A 89 89 ARG CB C 89 33.500 34.043 -0.543 1
1 1120 . 13 1 1 A 89 89 ARG N N 89 122.800 120.792 2.008 1
1 1122 . 13 1 1 A 90 90 ILE H H 90 8.530 8.934 -0.404 1
1 1123 . 13 1 1 A 90 90 ILE HA H 90 4.790 4.991 -0.201 1
1 1133 . 13 1 1 A 90 90 ILE C C 90 175.400 174.483 0.917 1
1 1134 . 13 1 1 A 90 90 ILE CA C 90 60.600 60.131 0.469 1
1 1135 . 13 1 1 A 90 90 ILE CB C 90 40.600 40.785 -0.185 1
1 1139 . 13 1 1 A 90 90 ILE N N 90 123.100 123.142 -0.042 1
1 1140 . 13 1 1 A 91 91 GLU H H 91 9.000 9.125 -0.125 1
1 1141 . 13 1 1 A 91 91 GLU HA H 91 4.730 5.064 -0.334 1
1 1146 . 13 1 1 A 91 91 GLU C C 91 175.100 175.460 -0.360 1
1 1147 . 13 1 1 A 91 91 GLU CA C 91 54.300 54.503 -0.203 1
1 1148 . 13 1 1 A 91 91 GLU CB C 91 32.400 32.609 -0.209 1
1 1150 . 13 1 1 A 91 91 GLU N N 91 126.400 128.660 -2.260 1
1 1151 . 13 1 1 A 92 92 SER H H 92 8.830 8.887 -0.057 1
1 1152 . 13 1 1 A 92 92 SER HA H 92 4.700 4.852 -0.152 1
1 1155 . 13 1 1 A 92 92 SER C C 92 174.600 174.357 0.243 1
1 1156 . 13 1 1 A 92 92 SER CA C 92 59.300 58.498 0.802 1
1 1157 . 13 1 1 A 92 92 SER CB C 92 63.100 63.670 -0.570 1
1 1158 . 13 1 1 A 92 92 SER N N 92 119.800 124.665 -4.865 1
1 1159 . 13 1 1 A 93 93 VAL H H 93 8.350 8.484 -0.134 1
1 1160 . 13 1 1 A 93 93 VAL HA H 93 4.290 4.801 -0.511 1
1 1168 . 13 1 1 A 93 93 VAL C C 93 175.100 174.995 0.105 1
1 1169 . 13 1 1 A 93 93 VAL CA C 93 61.300 59.632 1.668 1
1 1170 . 13 1 1 A 93 93 VAL CB C 93 33.900 34.861 -0.961 1
1 1173 . 13 1 1 A 93 93 VAL N N 93 121.800 118.919 2.881 1
1 1174 . 13 1 1 A 94 94 ASN H H 94 8.510 9.138 -0.628 1
1 1175 . 13 1 1 A 94 94 ASN HA H 94 4.770 4.848 -0.078 1
1 1180 . 13 1 1 A 94 94 ASN C C 94 175.000 174.394 0.606 1
1 1181 . 13 1 1 A 94 94 ASN CA C 94 52.700 54.444 -1.744 1
1 1182 . 13 1 1 A 94 94 ASN CB C 94 38.500 40.536 -2.036 1
1 1184 . 13 1 1 A 94 94 ASN N N 94 121.800 122.512 -0.712 1
1 1186 . 13 1 1 A 95 95 VAL H H 95 7.860 8.016 -0.156 1
1 1187 . 13 1 1 A 95 95 VAL HA H 95 4.100 4.473 -0.373 1
1 1195 . 13 1 1 A 95 95 VAL C C 95 175.100 175.702 -0.602 1
1 1196 . 13 1 1 A 95 95 VAL CA C 95 61.700 61.156 0.544 1
1 1197 . 13 1 1 A 95 95 VAL CB C 95 33.100 33.902 -0.802 1
1 1200 . 13 1 1 A 95 95 VAL N N 95 119.700 115.273 4.427 1
1 1201 . 13 1 1 A 96 96 ASN H H 96 8.490 8.513 -0.023 1
1 1202 . 13 1 1 A 96 96 ASN HA H 96 4.700 4.724 -0.024 1
1 1207 . 13 1 1 A 96 96 ASN C C 96 174.600 175.952 -1.352 1
1 1208 . 13 1 1 A 96 96 ASN CA C 96 53.000 55.491 -2.491 1
1 1209 . 13 1 1 A 96 96 ASN CB C 96 39.000 38.418 0.582 1
1 1211 . 13 1 1 A 96 96 ASN N N 96 122.200 120.673 1.527 1
1 1213 . 13 1 1 A 97 97 ILE H H 97 8.080 7.754 0.326 1
1 1214 . 13 1 1 A 97 97 ILE HA H 97 4.370 4.552 -0.182 1
1 1224 . 13 1 1 A 97 97 ILE CA C 97 58.600 58.100 0.500 1
1 1225 . 13 1 1 A 97 97 ILE CB C 97 38.600 38.004 0.596 1
1 1229 . 13 1 1 A 97 97 ILE N N 97 123.500 113.864 9.636 1
1 1230 . 13 1 1 A 98 98 PRO HA H 98 4.360 4.647 -0.287 1
1 1237 . 13 1 1 A 98 98 PRO C C 98 176.600 176.075 0.525 1
1 1238 . 13 1 1 A 98 98 PRO CA C 98 63.100 63.762 -0.662 1
1 1239 . 13 1 1 A 98 98 PRO CB C 98 31.800 31.689 0.111 1
1 1242 . 13 1 1 A 99 99 LEU H H 99 8.200 7.547 0.653 1
1 1243 . 13 1 1 A 99 99 LEU HA H 99 4.200 4.575 -0.375 1
1 1253 . 13 1 1 A 99 99 LEU C C 99 177.300 176.361 0.939 1
1 1254 . 13 1 1 A 99 99 LEU CA C 99 55.000 54.514 0.486 1
1 1255 . 13 1 1 A 99 99 LEU CB C 99 42.400 43.201 -0.801 1
1 1259 . 13 1 1 A 99 99 LEU N N 99 122.500 119.548 2.952 1
1 1260 . 13 1 1 A 100 100 GLU H H 100 8.250 8.467 -0.217 1
1 1261 . 13 1 1 A 100 100 GLU HA H 100 4.140 4.707 -0.567 1
1 1266 . 13 1 1 A 100 100 GLU C C 100 176.100 177.246 -1.146 1
1 1267 . 13 1 1 A 100 100 GLU CA C 100 56.100 55.856 0.244 1
1 1268 . 13 1 1 A 100 100 GLU CB C 100 29.900 31.127 -1.227 1
1 1270 . 13 1 1 A 100 100 GLU N N 100 121.000 122.545 -1.545 1
1 1271 . 13 1 1 A 101 101 HIS H H 101 8.540 7.912 0.628 1
1 1272 . 13 1 1 A 101 101 HIS HA H 101 4.600 4.293 0.307 1
1 1275 . 13 1 1 A 101 101 HIS C C 101 174.200 174.846 -0.646 1
1 1276 . 13 1 1 A 101 101 HIS CA C 101 55.200 59.506 -4.306 1
1 1277 . 13 1 1 A 101 101 HIS CB C 101 29.000 30.038 -1.038 1
1 1278 . 13 1 1 A 101 101 HIS N N 101 119.400 117.702 1.698 1
1 1279 . 13 1 1 A 102 102 HIS H H 102 8.660 8.021 0.639 1
1 1280 . 13 1 1 A 102 102 HIS HA H 102 4.630 5.363 -0.733 1
1 1283 . 13 1 1 A 102 102 HIS C C 102 174.200 174.457 -0.257 1
1 1284 . 13 1 1 A 102 102 HIS CA C 102 55.200 54.591 0.609 1
1 1285 . 13 1 1 A 102 102 HIS CB C 102 29.100 32.329 -3.229 1
1 1286 . 13 1 1 A 102 102 HIS N N 102 119.700 115.049 4.651 1
1 1287 . 13 1 1 A 103 103 HIS H H 103 8.680 9.326 -0.646 1
1 1288 . 13 1 1 A 103 103 HIS HA H 103 4.640 4.902 -0.262 1
1 1291 . 13 1 1 A 103 103 HIS C C 103 174.200 174.487 -0.287 1
1 1292 . 13 1 1 A 103 103 HIS CA C 103 55.200 55.515 -0.315 1
1 1293 . 13 1 1 A 103 103 HIS CB C 103 29.200 33.081 -3.881 1
1 1294 . 13 1 1 A 103 103 HIS N N 103 120.500 121.562 -1.062 1
1 1295 . 13 1 1 A 104 104 HIS H H 104 8.580 7.599 0.981 1
1 1296 . 13 1 1 A 104 104 HIS HA H 104 4.590 3.722 0.868 1
1 1299 . 13 1 1 A 104 104 HIS C C 104 174.200 173.255 0.945 1
1 1300 . 13 1 1 A 104 104 HIS CA C 104 55.200 56.609 -1.409 1
1 1301 . 13 1 1 A 104 104 HIS CB C 104 29.300 28.952 0.348 1
1 1302 . 13 1 1 A 104 104 HIS N N 104 120.700 122.910 -2.210 1
1 1303 . 13 1 1 A 105 105 HIS H H 105 8.550 7.706 0.844 1
1 1304 . 13 1 1 A 105 105 HIS HA H 105 4.610 5.182 -0.572 1
1 1307 . 13 1 1 A 105 105 HIS C C 105 173.500 174.175 -0.675 1
1 1308 . 13 1 1 A 105 105 HIS CA C 105 55.400 54.828 0.572 1
1 1309 . 13 1 1 A 105 105 HIS CB C 105 28.800 33.878 -5.078 1
1 1310 . 13 1 1 A 105 105 HIS N N 105 119.000 117.247 1.753 1
1 7 . 14 1 1 A 2 2 ASP H H 2 8.890 8.055 0.835 1
1 8 . 14 1 1 A 2 2 ASP HA H 2 4.740 4.851 -0.111 1
1 11 . 14 1 1 A 2 2 ASP C C 2 174.600 175.461 -0.861 1
1 12 . 14 1 1 A 2 2 ASP CA C 2 53.800 52.861 0.939 1
1 13 . 14 1 1 A 2 2 ASP CB C 2 41.500 42.468 -0.968 1
1 14 . 14 1 1 A 2 2 ASP N N 2 122.100 120.916 1.184 1
1 15 . 14 1 1 A 3 3 LEU H H 3 8.280 8.313 -0.033 1
1 16 . 14 1 1 A 3 3 LEU HA H 3 4.420 4.677 -0.257 1
1 26 . 14 1 1 A 3 3 LEU C C 3 176.900 176.121 0.779 1
1 27 . 14 1 1 A 3 3 LEU CA C 3 55.000 54.723 0.277 1
1 28 . 14 1 1 A 3 3 LEU CB C 3 42.700 43.109 -0.409 1
1 32 . 14 1 1 A 3 3 LEU N N 3 122.300 122.760 -0.460 1
1 33 . 14 1 1 A 4 4 VAL H H 4 8.640 8.639 0.001 1
1 34 . 14 1 1 A 4 4 VAL HA H 4 4.540 4.959 -0.419 1
1 42 . 14 1 1 A 4 4 VAL C C 4 175.800 174.904 0.896 1
1 43 . 14 1 1 A 4 4 VAL CA C 4 59.400 58.609 0.791 1
1 44 . 14 1 1 A 4 4 VAL CB C 4 35.400 35.798 -0.398 1
1 47 . 14 1 1 A 4 4 VAL N N 4 122.600 118.934 3.666 1
1 48 . 14 1 1 A 5 5 LYS H H 5 8.630 8.629 0.001 1
1 49 . 14 1 1 A 5 5 LYS HA H 5 4.450 4.395 0.055 1
1 58 . 14 1 1 A 5 5 LYS C C 5 179.400 178.462 0.938 1
1 59 . 14 1 1 A 5 5 LYS CA C 5 53.600 56.043 -2.443 1
1 60 . 14 1 1 A 5 5 LYS CB C 5 30.900 33.246 -2.346 1
1 64 . 14 1 1 A 5 5 LYS N N 5 121.100 121.633 -0.533 1
1 65 . 14 1 1 A 6 6 ILE H H 6 10.320 8.852 1.468 1
1 66 . 14 1 1 A 6 6 ILE HA H 6 3.440 3.712 -0.272 1
1 76 . 14 1 1 A 6 6 ILE C C 6 178.300 177.804 0.496 1
1 77 . 14 1 1 A 6 6 ILE CA C 6 65.700 64.941 0.759 1
1 78 . 14 1 1 A 6 6 ILE CB C 6 35.900 37.679 -1.779 1
1 82 . 14 1 1 A 6 6 ILE N N 6 125.400 122.540 2.860 1
1 83 . 14 1 1 A 7 7 ARG H H 7 8.210 8.667 -0.457 1
1 84 . 14 1 1 A 7 7 ARG HA H 7 3.850 4.168 -0.318 1
1 92 . 14 1 1 A 7 7 ARG C C 7 175.600 177.211 -1.611 1
1 93 . 14 1 1 A 7 7 ARG CA C 7 57.800 57.789 0.011 1
1 94 . 14 1 1 A 7 7 ARG CB C 7 30.300 29.023 1.277 1
1 98 . 14 1 1 A 7 7 ARG N N 7 118.800 120.679 -1.879 1
1 100 . 14 1 1 A 8 8 ASP H H 8 7.850 7.535 0.315 1
1 101 . 14 1 1 A 8 8 ASP HA H 8 4.700 4.684 0.016 1
1 104 . 14 1 1 A 8 8 ASP C C 8 176.100 176.505 -0.405 1
1 105 . 14 1 1 A 8 8 ASP CA C 8 54.100 54.357 -0.257 1
1 106 . 14 1 1 A 8 8 ASP CB C 8 41.200 41.096 0.104 1
1 107 . 14 1 1 A 8 8 ASP N N 8 116.800 119.587 -2.787 1
1 108 . 14 1 1 A 9 9 VAL H H 9 7.240 7.345 -0.105 1
1 109 . 14 1 1 A 9 9 VAL HA H 9 3.710 3.965 -0.255 1
1 117 . 14 1 1 A 9 9 VAL C C 9 174.900 175.773 -0.873 1
1 118 . 14 1 1 A 9 9 VAL CA C 9 64.300 63.211 1.089 1
1 119 . 14 1 1 A 9 9 VAL CB C 9 31.500 31.607 -0.107 1
1 122 . 14 1 1 A 9 9 VAL N N 9 121.800 121.448 0.352 1
1 123 . 14 1 1 A 10 10 SER H H 10 8.600 8.086 0.514 1
1 124 . 14 1 1 A 10 10 SER HA H 10 4.600 4.653 -0.053 1
1 127 . 14 1 1 A 10 10 SER CA C 10 56.700 56.865 -0.165 1
1 128 . 14 1 1 A 10 10 SER CB C 10 66.100 65.678 0.422 1
1 129 . 14 1 1 A 10 10 SER N N 10 122.200 120.645 1.555 1
1 130 . 14 1 1 A 11 11 LEU H H 11 8.660 9.027 -0.367 1
1 131 . 14 1 1 A 11 11 LEU HA H 11 3.900 3.997 -0.097 1
1 141 . 14 1 1 A 11 11 LEU C C 11 178.100 179.235 -1.135 1
1 142 . 14 1 1 A 11 11 LEU CA C 11 56.700 57.961 -1.261 1
1 143 . 14 1 1 A 11 11 LEU CB C 11 41.400 41.224 0.176 1
1 147 . 14 1 1 A 11 11 LEU N N 11 120.300 123.259 -2.959 1
1 148 . 14 1 1 A 12 12 SER H H 12 8.160 8.110 0.050 1
1 149 . 14 1 1 A 12 12 SER HA H 12 4.270 4.293 -0.023 1
1 152 . 14 1 1 A 12 12 SER C C 12 174.200 174.949 -0.749 1
1 153 . 14 1 1 A 12 12 SER CA C 12 59.900 61.434 -1.534 1
1 154 . 14 1 1 A 12 12 SER CB C 12 63.100 62.841 0.259 1
1 155 . 14 1 1 A 12 12 SER N N 12 112.100 114.384 -2.284 1
1 156 . 14 1 1 A 13 13 THR H H 13 7.460 7.608 -0.148 1
1 157 . 14 1 1 A 13 13 THR HA H 13 4.760 4.684 0.076 1
1 162 . 14 1 1 A 13 13 THR CA C 13 56.600 58.929 -2.329 1
1 163 . 14 1 1 A 13 13 THR CB C 13 70.100 68.914 1.186 1
1 165 . 14 1 1 A 13 13 THR N N 13 114.700 111.521 3.179 1
1 166 . 14 1 1 A 14 14 PRO HA H 14 4.050 4.416 -0.366 1
1 173 . 14 1 1 A 14 14 PRO C C 14 175.800 175.764 0.036 1
1 174 . 14 1 1 A 14 14 PRO CA C 14 65.100 64.264 0.836 1
1 175 . 14 1 1 A 14 14 PRO CB C 14 32.100 31.479 0.621 1
1 178 . 14 1 1 A 15 15 TYR H H 15 7.380 7.491 -0.111 1
1 179 . 14 1 1 A 15 15 TYR HA H 15 5.570 5.521 0.049 1
1 186 . 14 1 1 A 15 15 TYR C C 15 176.100 175.014 1.086 1
1 187 . 14 1 1 A 15 15 TYR CA C 15 56.400 56.813 -0.413 1
1 188 . 14 1 1 A 15 15 TYR CB C 15 41.500 40.293 1.207 1
1 193 . 14 1 1 A 15 15 TYR N N 15 113.800 117.853 -4.053 1
1 194 . 14 1 1 A 16 16 VAL H H 16 9.010 8.685 0.325 1
1 195 . 14 1 1 A 16 16 VAL HA H 16 4.920 5.050 -0.130 1
1 203 . 14 1 1 A 16 16 VAL C C 16 174.300 173.356 0.944 1
1 204 . 14 1 1 A 16 16 VAL CA C 16 59.600 59.533 0.067 1
1 205 . 14 1 1 A 16 16 VAL CB C 16 36.800 36.397 0.403 1
1 208 . 14 1 1 A 16 16 VAL N N 16 113.800 118.374 -4.574 1
1 209 . 14 1 1 A 17 17 SER H H 17 7.960 8.904 -0.944 1
1 210 . 14 1 1 A 17 17 SER HA H 17 5.860 5.612 0.248 1
1 213 . 14 1 1 A 17 17 SER C C 17 172.700 173.256 -0.556 1
1 214 . 14 1 1 A 17 17 SER CA C 17 57.300 56.379 0.921 1
1 215 . 14 1 1 A 17 17 SER CB C 17 64.000 65.182 -1.182 1
1 216 . 14 1 1 A 17 17 SER N N 17 117.100 117.283 -0.183 1
1 217 . 14 1 1 A 18 18 VAL H H 18 8.570 8.828 -0.258 1
1 218 . 14 1 1 A 18 18 VAL HA H 18 4.900 5.199 -0.299 1
1 226 . 14 1 1 A 18 18 VAL C C 18 173.700 173.727 -0.027 1
1 227 . 14 1 1 A 18 18 VAL CA C 18 58.800 59.180 -0.380 1
1 228 . 14 1 1 A 18 18 VAL CB C 18 36.700 35.949 0.751 1
1 231 . 14 1 1 A 18 18 VAL N N 18 113.500 119.393 -5.893 1
1 232 . 14 1 1 A 19 19 ILE H H 19 8.490 8.596 -0.106 1
1 233 . 14 1 1 A 19 19 ILE HA H 19 5.300 4.898 0.402 1
1 243 . 14 1 1 A 19 19 ILE C C 19 175.800 174.801 0.999 1
1 244 . 14 1 1 A 19 19 ILE CA C 19 59.700 59.413 0.287 1
1 245 . 14 1 1 A 19 19 ILE CB C 19 41.700 42.335 -0.635 1
1 249 . 14 1 1 A 19 19 ILE N N 19 120.600 122.189 -1.589 1
1 250 . 14 1 1 A 20 20 GLY H H 20 8.670 7.897 0.773 1
1 251 . 14 1 1 A 20 20 GLY HA2 H 20 3.760 4.179 -0.419 1
1 252 . 14 1 1 A 20 20 GLY HA3 H 20 4.190 4.182 0.008 1
1 253 . 14 1 1 A 20 20 GLY C C 20 169.900 171.450 -1.550 1
1 254 . 14 1 1 A 20 20 GLY CA C 20 46.000 46.009 -0.009 1
1 255 . 14 1 1 A 20 20 GLY N N 20 110.200 113.787 -3.587 1
1 256 . 14 1 1 A 21 21 LYS H H 21 8.920 8.183 0.737 1
1 257 . 14 1 1 A 21 21 LYS HA H 21 5.210 5.060 0.150 1
1 266 . 14 1 1 A 21 21 LYS C C 21 176.400 175.415 0.985 1
1 267 . 14 1 1 A 21 21 LYS CA C 21 54.400 54.715 -0.315 1
1 268 . 14 1 1 A 21 21 LYS CB C 21 35.400 35.003 0.397 1
1 272 . 14 1 1 A 21 21 LYS N N 21 119.100 121.080 -1.980 1
1 273 . 14 1 1 A 22 22 ILE H H 22 8.900 8.736 0.164 1
1 274 . 14 1 1 A 22 22 ILE HA H 22 5.050 5.211 -0.161 1
1 284 . 14 1 1 A 22 22 ILE C C 22 176.900 175.152 1.748 1
1 285 . 14 1 1 A 22 22 ILE CA C 22 57.800 60.300 -2.500 1
1 286 . 14 1 1 A 22 22 ILE CB C 22 36.200 39.288 -3.088 1
1 290 . 14 1 1 A 22 22 ILE N N 22 130.000 126.889 3.111 1
1 291 . 14 1 1 A 23 23 THR H H 23 9.020 8.884 0.136 1
1 292 . 14 1 1 A 23 23 THR HA H 23 4.660 4.857 -0.197 1
1 297 . 14 1 1 A 23 23 THR C C 23 174.000 174.488 -0.488 1
1 298 . 14 1 1 A 23 23 THR CA C 23 60.800 59.835 0.965 1
1 299 . 14 1 1 A 23 23 THR CB C 23 73.400 71.469 1.931 1
1 301 . 14 1 1 A 23 23 THR N N 23 118.200 117.713 0.487 1
1 302 . 14 1 1 A 24 24 GLY H H 24 8.430 8.617 -0.187 1
1 303 . 14 1 1 A 24 24 GLY HA2 H 24 3.910 3.960 -0.050 1
1 304 . 14 1 1 A 24 24 GLY HA3 H 24 3.910 4.104 -0.194 1
1 305 . 14 1 1 A 24 24 GLY C C 24 175.400 174.303 1.097 1
1 306 . 14 1 1 A 24 24 GLY CA C 24 47.100 45.792 1.308 1
1 307 . 14 1 1 A 24 24 GLY N N 24 107.200 108.946 -1.746 1
1 308 . 14 1 1 A 25 25 ILE H H 25 9.370 7.922 1.448 1
1 309 . 14 1 1 A 25 25 ILE HA H 25 4.480 4.030 0.450 1
1 319 . 14 1 1 A 25 25 ILE C C 25 178.200 174.291 3.909 1
1 320 . 14 1 1 A 25 25 ILE CA C 25 59.200 62.120 -2.920 1
1 321 . 14 1 1 A 25 25 ILE CB C 25 35.400 36.975 -1.575 1
1 325 . 14 1 1 A 25 25 ILE N N 25 120.600 118.719 1.881 1
1 326 . 14 1 1 A 26 26 HIS H H 26 9.000 9.200 -0.200 1
1 327 . 14 1 1 A 26 26 HIS HA H 26 4.770 4.995 -0.225 1
1 330 . 14 1 1 A 26 26 HIS C C 26 172.700 173.601 -0.901 1
1 331 . 14 1 1 A 26 26 HIS CA C 26 55.000 54.637 0.363 1
1 332 . 14 1 1 A 26 26 HIS CB C 26 31.100 34.060 -2.960 1
1 333 . 14 1 1 A 26 26 HIS N N 26 123.800 125.014 -1.214 1
1 334 . 14 1 1 A 27 27 LYS H H 27 8.930 8.997 -0.067 1
1 335 . 14 1 1 A 27 27 LYS HA H 27 4.770 4.595 0.175 1
1 344 . 14 1 1 A 27 27 LYS C C 27 175.300 175.121 0.179 1
1 345 . 14 1 1 A 27 27 LYS CA C 27 55.100 54.807 0.293 1
1 346 . 14 1 1 A 27 27 LYS CB C 27 34.400 34.687 -0.287 1
1 350 . 14 1 1 A 27 27 LYS N N 27 125.900 123.625 2.275 1
1 351 . 14 1 1 A 28 28 LYS H H 28 8.880 8.660 0.220 1
1 352 . 14 1 1 A 28 28 LYS HA H 28 4.570 4.991 -0.421 1
1 361 . 14 1 1 A 28 28 LYS C C 28 174.500 174.985 -0.485 1
1 362 . 14 1 1 A 28 28 LYS CA C 28 54.600 54.477 0.123 1
1 363 . 14 1 1 A 28 28 LYS CB C 28 35.300 37.083 -1.783 1
1 367 . 14 1 1 A 28 28 LYS N N 28 127.400 124.961 2.439 1
1 368 . 14 1 1 A 29 29 GLU H H 29 8.440 8.461 -0.021 1
1 369 . 14 1 1 A 29 29 GLU HA H 29 5.260 5.317 -0.057 1
1 374 . 14 1 1 A 29 29 GLU C C 29 175.800 175.782 0.018 1
1 375 . 14 1 1 A 29 29 GLU CA C 29 54.800 54.877 -0.077 1
1 376 . 14 1 1 A 29 29 GLU CB C 29 31.500 32.980 -1.480 1
1 378 . 14 1 1 A 29 29 GLU N N 29 122.200 120.504 1.696 1
1 379 . 14 1 1 A 30 30 TYR H H 30 8.960 8.765 0.195 1
1 380 . 14 1 1 A 30 30 TYR HA H 30 4.820 5.321 -0.501 1
1 387 . 14 1 1 A 30 30 TYR C C 30 172.600 172.834 -0.234 1
1 388 . 14 1 1 A 30 30 TYR CA C 30 56.300 55.661 0.639 1
1 389 . 14 1 1 A 30 30 TYR CB C 30 40.500 41.471 -0.971 1
1 394 . 14 1 1 A 30 30 TYR N N 30 121.100 118.710 2.390 1
1 395 . 14 1 1 A 31 31 GLU H H 31 8.610 8.710 -0.100 1
1 396 . 14 1 1 A 31 31 GLU HA H 31 4.810 4.514 0.296 1
1 401 . 14 1 1 A 31 31 GLU C C 31 176.100 174.840 1.260 1
1 402 . 14 1 1 A 31 31 GLU CA C 31 55.100 56.115 -1.015 1
1 403 . 14 1 1 A 31 31 GLU CB C 31 30.300 30.298 0.002 1
1 405 . 14 1 1 A 31 31 GLU N N 31 121.800 120.224 1.576 1
1 406 . 14 1 1 A 32 32 SER H H 32 8.570 9.194 -0.624 1
1 407 . 14 1 1 A 32 32 SER HA H 32 4.520 4.877 -0.357 1
1 410 . 14 1 1 A 32 32 SER C C 32 174.300 173.709 0.591 1
1 411 . 14 1 1 A 32 32 SER CA C 32 57.300 56.665 0.635 1
1 412 . 14 1 1 A 32 32 SER CB C 32 64.100 64.855 -0.755 1
1 413 . 14 1 1 A 32 32 SER N N 32 118.500 120.578 -2.078 1
1 414 . 14 1 1 A 33 33 ASP H H 33 9.290 9.341 -0.051 1
1 415 . 14 1 1 A 33 33 ASP HA H 33 4.340 4.280 0.060 1
1 418 . 14 1 1 A 33 33 ASP C C 33 175.900 175.288 0.612 1
1 419 . 14 1 1 A 33 33 ASP CA C 33 55.000 55.042 -0.042 1
1 420 . 14 1 1 A 33 33 ASP CB C 33 39.300 39.739 -0.439 1
1 421 . 14 1 1 A 33 33 ASP N N 33 125.700 128.794 -3.094 1
1 422 . 14 1 1 A 34 34 GLY H H 34 8.690 8.474 0.216 1
1 423 . 14 1 1 A 34 34 GLY HA2 H 34 3.660 3.743 -0.083 1
1 424 . 14 1 1 A 34 34 GLY HA3 H 34 4.140 3.746 0.394 1
1 425 . 14 1 1 A 34 34 GLY C C 34 174.200 173.703 0.497 1
1 426 . 14 1 1 A 34 34 GLY CA C 34 45.600 45.453 0.147 1
1 427 . 14 1 1 A 34 34 GLY N N 34 104.800 104.443 0.357 1
1 428 . 14 1 1 A 35 35 THR H H 35 7.840 8.018 -0.178 1
1 429 . 14 1 1 A 35 35 THR HA H 35 4.660 4.557 0.103 1
1 434 . 14 1 1 A 35 35 THR C C 35 173.000 173.359 -0.359 1
1 435 . 14 1 1 A 35 35 THR CA C 35 60.200 61.331 -1.131 1
1 436 . 14 1 1 A 35 35 THR CB C 35 71.200 71.146 0.054 1
1 438 . 14 1 1 A 35 35 THR N N 35 114.800 116.219 -1.419 1
1 439 . 14 1 1 A 36 36 THR H H 36 8.480 8.614 -0.134 1
1 440 . 14 1 1 A 36 36 THR HA H 36 4.620 4.522 0.098 1
1 445 . 14 1 1 A 36 36 THR C C 36 173.800 174.390 -0.590 1
1 446 . 14 1 1 A 36 36 THR CA C 36 62.300 62.829 -0.529 1
1 447 . 14 1 1 A 36 36 THR CB C 36 69.500 69.176 0.324 1
1 449 . 14 1 1 A 36 36 THR N N 36 119.400 121.367 -1.967 1
1 450 . 14 1 1 A 37 37 LYS H H 37 8.880 8.413 0.467 1
1 451 . 14 1 1 A 37 37 LYS HA H 37 4.570 4.854 -0.284 1
1 460 . 14 1 1 A 37 37 LYS C C 37 174.500 176.067 -1.567 1
1 461 . 14 1 1 A 37 37 LYS CA C 37 54.600 53.988 0.612 1
1 462 . 14 1 1 A 37 37 LYS CB C 37 35.500 36.278 -0.778 1
1 466 . 14 1 1 A 37 37 LYS N N 37 128.000 125.180 2.820 1
1 467 . 14 1 1 A 38 38 SER H H 38 8.370 8.714 -0.344 1
1 468 . 14 1 1 A 38 38 SER HA H 38 5.250 5.039 0.211 1
1 471 . 14 1 1 A 38 38 SER C C 38 173.200 173.849 -0.649 1
1 472 . 14 1 1 A 38 38 SER CA C 38 57.900 57.694 0.206 1
1 473 . 14 1 1 A 38 38 SER CB C 38 65.500 64.520 0.980 1
1 474 . 14 1 1 A 38 38 SER N N 38 114.300 117.303 -3.003 1
1 475 . 14 1 1 A 39 39 VAL H H 39 9.020 8.934 0.086 1
1 476 . 14 1 1 A 39 39 VAL HA H 39 4.900 5.038 -0.138 1
1 484 . 14 1 1 A 39 39 VAL C C 39 173.200 172.746 0.454 1
1 485 . 14 1 1 A 39 39 VAL CA C 39 59.200 59.718 -0.518 1
1 486 . 14 1 1 A 39 39 VAL CB C 39 34.600 35.458 -0.858 1
1 489 . 14 1 1 A 39 39 VAL N N 39 123.600 120.836 2.764 1
1 490 . 14 1 1 A 40 40 TYR H H 40 8.900 8.964 -0.064 1
1 491 . 14 1 1 A 40 40 TYR HA H 40 4.730 5.406 -0.676 1
1 498 . 14 1 1 A 40 40 TYR CA C 40 56.500 56.761 -0.261 1
1 499 . 14 1 1 A 40 40 TYR CB C 40 39.000 40.474 -1.474 1
1 504 . 14 1 1 A 40 40 TYR N N 40 126.300 127.222 -0.922 1
1 505 . 14 1 1 A 41 41 GLN H H 41 8.630 8.647 -0.017 1
1 506 . 14 1 1 A 41 41 GLN HA H 41 5.330 5.380 -0.050 1
1 513 . 14 1 1 A 41 41 GLN C C 41 175.500 175.602 -0.102 1
1 514 . 14 1 1 A 41 41 GLN CA C 41 53.800 54.221 -0.421 1
1 515 . 14 1 1 A 41 41 GLN CB C 41 32.100 32.584 -0.484 1
1 518 . 14 1 1 A 41 41 GLN N N 41 122.000 121.670 0.330 1
1 520 . 14 1 1 A 42 42 GLY H H 42 8.560 7.853 0.707 1
1 521 . 14 1 1 A 42 42 GLY HA2 H 42 3.680 4.270 -0.590 1
1 522 . 14 1 1 A 42 42 GLY HA3 H 42 4.020 4.289 -0.269 1
1 523 . 14 1 1 A 42 42 GLY C C 42 171.600 171.135 0.465 1
1 524 . 14 1 1 A 42 42 GLY CA C 42 47.300 46.121 1.179 1
1 525 . 14 1 1 A 42 42 GLY N N 42 113.000 108.620 4.380 1
1 526 . 14 1 1 A 43 43 TYR H H 43 9.320 8.574 0.746 1
1 527 . 14 1 1 A 43 43 TYR HA H 43 5.280 5.392 -0.112 1
1 534 . 14 1 1 A 43 43 TYR C C 43 173.200 174.493 -1.293 1
1 535 . 14 1 1 A 43 43 TYR CA C 43 57.600 56.444 1.156 1
1 536 . 14 1 1 A 43 43 TYR CB C 43 42.400 42.201 0.199 1
1 541 . 14 1 1 A 43 43 TYR N N 43 126.300 118.927 7.373 1
1 542 . 14 1 1 A 44 44 ILE H H 44 9.160 8.805 0.355 1
1 543 . 14 1 1 A 44 44 ILE HA H 44 5.270 5.321 -0.051 1
1 553 . 14 1 1 A 44 44 ILE C C 44 172.900 174.183 -1.283 1
1 554 . 14 1 1 A 44 44 ILE CA C 44 59.000 59.654 -0.654 1
1 555 . 14 1 1 A 44 44 ILE CB C 44 42.200 42.026 0.174 1
1 559 . 14 1 1 A 44 44 ILE N N 44 117.700 122.351 -4.651 1
1 560 . 14 1 1 A 45 45 GLU H H 45 8.420 8.841 -0.421 1
1 561 . 14 1 1 A 45 45 GLU HA H 45 5.600 5.414 0.186 1
1 566 . 14 1 1 A 45 45 GLU C C 45 174.300 174.594 -0.294 1
1 567 . 14 1 1 A 45 45 GLU CA C 45 54.000 54.331 -0.331 1
1 568 . 14 1 1 A 45 45 GLU CB C 45 34.400 34.037 0.363 1
1 570 . 14 1 1 A 45 45 GLU N N 45 123.600 127.128 -3.528 1
1 571 . 14 1 1 A 46 46 ASP H H 46 8.530 8.356 0.174 1
1 572 . 14 1 1 A 46 46 ASP HA H 46 5.070 5.173 -0.103 1
1 575 . 14 1 1 A 46 46 ASP C C 46 175.000 175.314 -0.314 1
1 576 . 14 1 1 A 46 46 ASP CA C 46 51.800 53.205 -1.405 1
1 577 . 14 1 1 A 46 46 ASP CB C 46 41.300 42.603 -1.303 1
1 578 . 14 1 1 A 46 46 ASP N N 46 125.500 119.501 5.999 1
1 579 . 14 1 1 A 47 47 ASP H H 47 9.160 8.526 0.634 1
1 580 . 14 1 1 A 47 47 ASP HA H 47 4.430 4.351 0.079 1
1 583 . 14 1 1 A 47 47 ASP C C 47 176.000 175.132 0.868 1
1 584 . 14 1 1 A 47 47 ASP CA C 47 55.000 54.839 0.161 1
1 585 . 14 1 1 A 47 47 ASP CB C 47 38.900 38.631 0.269 1
1 586 . 14 1 1 A 47 47 ASP N N 47 114.200 122.156 -7.956 1
1 587 . 14 1 1 A 48 48 THR H H 48 9.470 7.958 1.512 1
1 588 . 14 1 1 A 48 48 THR HA H 48 4.520 4.542 -0.022 1
1 593 . 14 1 1 A 48 48 THR C C 48 174.500 174.178 0.322 1
1 594 . 14 1 1 A 48 48 THR CA C 48 62.600 63.159 -0.559 1
1 595 . 14 1 1 A 48 48 THR CB C 48 70.400 71.374 -0.974 1
1 597 . 14 1 1 A 48 48 THR N N 48 111.800 111.870 -0.070 1
1 598 . 14 1 1 A 49 49 ALA H H 49 7.850 7.511 0.339 1
1 599 . 14 1 1 A 49 49 ALA HA H 49 4.440 4.461 -0.021 1
1 603 . 14 1 1 A 49 49 ALA C C 49 173.200 175.352 -2.152 1
1 604 . 14 1 1 A 49 49 ALA CA C 49 52.700 51.592 1.108 1
1 605 . 14 1 1 A 49 49 ALA CB C 49 21.300 21.391 -0.091 1
1 606 . 14 1 1 A 49 49 ALA N N 49 123.400 119.037 4.363 1
1 607 . 14 1 1 A 50 50 ARG H H 50 8.160 8.666 -0.506 1
1 608 . 14 1 1 A 50 50 ARG HA H 50 5.350 5.466 -0.116 1
1 616 . 14 1 1 A 50 50 ARG C C 50 174.700 174.259 0.441 1
1 617 . 14 1 1 A 50 50 ARG CA C 50 54.000 54.349 -0.349 1
1 618 . 14 1 1 A 50 50 ARG CB C 50 34.500 34.195 0.305 1
1 622 . 14 1 1 A 50 50 ARG N N 50 117.400 116.279 1.121 1
1 624 . 14 1 1 A 51 51 ILE H H 51 9.390 8.713 0.677 1
1 625 . 14 1 1 A 51 51 ILE HA H 51 4.790 5.027 -0.237 1
1 635 . 14 1 1 A 51 51 ILE C C 51 172.600 174.404 -1.804 1
1 636 . 14 1 1 A 51 51 ILE CA C 51 60.000 59.088 0.912 1
1 637 . 14 1 1 A 51 51 ILE CB C 51 42.800 42.123 0.677 1
1 641 . 14 1 1 A 51 51 ILE N N 51 124.600 120.943 3.657 1
1 642 . 14 1 1 A 52 52 ARG H H 52 7.980 8.378 -0.398 1
1 643 . 14 1 1 A 52 52 ARG HA H 52 4.170 4.316 -0.146 1
1 651 . 14 1 1 A 52 52 ARG C C 52 174.600 176.208 -1.608 1
1 652 . 14 1 1 A 52 52 ARG CA C 52 57.100 56.041 1.059 1
1 653 . 14 1 1 A 52 52 ARG CB C 52 31.300 30.782 0.518 1
1 657 . 14 1 1 A 52 52 ARG N N 52 125.900 126.108 -0.208 1
1 659 . 14 1 1 A 53 53 ILE H H 53 8.290 8.617 -0.327 1
1 660 . 14 1 1 A 53 53 ILE HA H 53 5.160 5.267 -0.107 1
1 670 . 14 1 1 A 53 53 ILE C C 53 172.400 174.286 -1.886 1
1 671 . 14 1 1 A 53 53 ILE CA C 53 58.600 59.153 -0.553 1
1 672 . 14 1 1 A 53 53 ILE CB C 53 41.900 42.433 -0.533 1
1 676 . 14 1 1 A 53 53 ILE N N 53 118.500 118.739 -0.239 1
1 677 . 14 1 1 A 54 54 SER H H 54 8.350 8.661 -0.311 1
1 678 . 14 1 1 A 54 54 SER HA H 54 5.070 5.103 -0.033 1
1 681 . 14 1 1 A 54 54 SER C C 54 172.400 172.651 -0.251 1
1 682 . 14 1 1 A 54 54 SER CA C 54 57.000 56.719 0.281 1
1 683 . 14 1 1 A 54 54 SER CB C 54 65.900 64.855 1.045 1
1 684 . 14 1 1 A 54 54 SER N N 54 120.700 118.328 2.372 1
1 685 . 14 1 1 A 55 55 SER H H 55 9.130 9.441 -0.311 1
1 686 . 14 1 1 A 55 55 SER HA H 55 5.270 5.355 -0.085 1
1 690 . 14 1 1 A 55 55 SER C C 55 174.400 172.864 1.536 1
1 691 . 14 1 1 A 55 55 SER CA C 55 55.500 56.073 -0.573 1
1 692 . 14 1 1 A 55 55 SER CB C 55 64.500 65.884 -1.384 1
1 693 . 14 1 1 A 55 55 SER N N 55 117.200 119.935 -2.735 1
1 694 . 14 1 1 A 56 56 PHE H H 56 8.970 8.522 0.448 1
1 695 . 14 1 1 A 56 56 PHE HA H 56 4.600 4.965 -0.365 1
1 703 . 14 1 1 A 56 56 PHE C C 56 176.500 177.243 -0.743 1
1 704 . 14 1 1 A 56 56 PHE CA C 56 58.300 57.199 1.101 1
1 705 . 14 1 1 A 56 56 PHE CB C 56 37.900 40.652 -2.752 1
1 711 . 14 1 1 A 56 56 PHE N N 56 129.400 122.916 6.484 1
1 712 . 14 1 1 A 57 57 GLY H H 57 8.570 8.908 -0.338 1
1 713 . 14 1 1 A 57 57 GLY HA2 H 57 4.020 4.122 -0.102 1
1 714 . 14 1 1 A 57 57 GLY HA3 H 57 4.380 4.169 0.211 1
1 715 . 14 1 1 A 57 57 GLY C C 57 173.700 173.815 -0.115 1
1 716 . 14 1 1 A 57 57 GLY CA C 57 46.300 45.522 0.778 1
1 717 . 14 1 1 A 57 57 GLY N N 57 112.500 112.435 0.065 1
1 718 . 14 1 1 A 58 58 LYS H H 58 6.800 7.863 -1.063 1
1 719 . 14 1 1 A 58 58 LYS HA H 58 4.410 4.345 0.065 1
1 728 . 14 1 1 A 58 58 LYS C C 58 174.800 175.322 -0.522 1
1 729 . 14 1 1 A 58 58 LYS CA C 58 55.200 55.900 -0.700 1
1 730 . 14 1 1 A 58 58 LYS CB C 58 33.300 33.053 0.247 1
1 734 . 14 1 1 A 58 58 LYS N N 58 118.700 120.426 -1.726 1
1 735 . 14 1 1 A 59 59 GLN H H 59 8.390 8.529 -0.139 1
1 736 . 14 1 1 A 59 59 GLN HA H 59 1.830 3.765 -1.935 1
1 743 . 14 1 1 A 59 59 GLN C C 59 174.100 174.275 -0.175 1
1 744 . 14 1 1 A 59 59 GLN CA C 59 57.100 54.513 2.587 1
1 745 . 14 1 1 A 59 59 GLN CB C 59 28.900 30.072 -1.172 1
1 748 . 14 1 1 A 59 59 GLN N N 59 124.000 122.859 1.141 1
1 750 . 14 1 1 A 60 60 LEU H H 60 5.320 8.351 -3.031 1
1 751 . 14 1 1 A 60 60 LEU HA H 60 4.370 4.879 -0.509 1
1 761 . 14 1 1 A 60 60 LEU CA C 60 52.800 53.505 -0.705 1
1 762 . 14 1 1 A 60 60 LEU CB C 60 46.700 45.512 1.188 1
1 766 . 14 1 1 A 60 60 LEU N N 60 121.800 125.825 -4.025 1
1 767 . 14 1 1 A 61 61 GLN H H 61 8.660 8.853 -0.193 1
1 768 . 14 1 1 A 61 61 GLN HA H 61 4.440 4.789 -0.349 1
1 775 . 14 1 1 A 61 61 GLN C C 61 174.000 175.389 -1.389 1
1 776 . 14 1 1 A 61 61 GLN CA C 61 53.800 54.125 -0.325 1
1 777 . 14 1 1 A 61 61 GLN CB C 61 31.800 31.790 0.010 1
1 780 . 14 1 1 A 61 61 GLN N N 61 120.300 120.388 -0.088 1
1 782 . 14 1 1 A 62 62 ASP H H 62 8.450 8.797 -0.347 1
1 783 . 14 1 1 A 62 62 ASP HA H 62 4.130 4.459 -0.329 1
1 786 . 14 1 1 A 62 62 ASP C C 62 177.200 176.616 0.584 1
1 787 . 14 1 1 A 62 62 ASP CA C 62 55.700 54.945 0.755 1
1 788 . 14 1 1 A 62 62 ASP CB C 62 39.400 41.379 -1.979 1
1 789 . 14 1 1 A 62 62 ASP N N 62 122.400 121.955 0.445 1
1 790 . 14 1 1 A 63 63 SER H H 63 9.210 8.877 0.333 1
1 791 . 14 1 1 A 63 63 SER HA H 63 3.850 4.024 -0.174 1
1 794 . 14 1 1 A 63 63 SER C C 63 173.200 172.491 0.709 1
1 795 . 14 1 1 A 63 63 SER CA C 63 61.700 59.269 2.431 1
1 796 . 14 1 1 A 63 63 SER CB C 63 61.800 61.928 -0.128 1
1 797 . 14 1 1 A 63 63 SER N N 63 114.300 112.818 1.482 1
1 798 . 14 1 1 A 64 64 ASP H H 64 7.960 7.604 0.356 1
1 799 . 14 1 1 A 64 64 ASP HA H 64 4.540 4.859 -0.319 1
1 802 . 14 1 1 A 64 64 ASP C C 64 174.900 174.860 0.040 1
1 803 . 14 1 1 A 64 64 ASP CA C 64 54.900 53.423 1.477 1
1 804 . 14 1 1 A 64 64 ASP CB C 64 40.900 41.963 -1.063 1
1 805 . 14 1 1 A 64 64 ASP N N 64 122.600 120.200 2.400 1
1 806 . 14 1 1 A 65 65 VAL H H 65 8.180 8.655 -0.475 1
1 807 . 14 1 1 A 65 65 VAL HA H 65 4.670 4.588 0.082 1
1 815 . 14 1 1 A 65 65 VAL C C 65 175.900 175.566 0.334 1
1 816 . 14 1 1 A 65 65 VAL CA C 65 62.300 61.430 0.870 1
1 817 . 14 1 1 A 65 65 VAL CB C 65 31.700 32.820 -1.120 1
1 820 . 14 1 1 A 65 65 VAL N N 65 123.100 124.609 -1.509 1
1 821 . 14 1 1 A 66 66 VAL H H 66 8.770 8.658 0.112 1
1 822 . 14 1 1 A 66 66 VAL HA H 66 5.160 5.006 0.154 1
1 830 . 14 1 1 A 66 66 VAL C C 66 173.600 173.243 0.357 1
1 831 . 14 1 1 A 66 66 VAL CA C 66 58.100 58.830 -0.730 1
1 832 . 14 1 1 A 66 66 VAL CB C 66 35.700 36.245 -0.545 1
1 835 . 14 1 1 A 66 66 VAL N N 66 118.100 121.952 -3.852 1
1 836 . 14 1 1 A 67 67 ARG H H 67 8.880 8.838 0.042 1
1 837 . 14 1 1 A 67 67 ARG HA H 67 5.110 5.229 -0.119 1
1 845 . 14 1 1 A 67 67 ARG C C 67 175.300 174.483 0.817 1
1 846 . 14 1 1 A 67 67 ARG CA C 67 54.200 54.370 -0.170 1
1 847 . 14 1 1 A 67 67 ARG CB C 67 32.200 33.679 -1.479 1
1 851 . 14 1 1 A 67 67 ARG N N 67 120.200 121.896 -1.696 1
1 853 . 14 1 1 A 68 68 ILE H H 68 9.220 9.109 0.111 1
1 854 . 14 1 1 A 68 68 ILE HA H 68 4.990 4.628 0.362 1
1 864 . 14 1 1 A 68 68 ILE C C 68 174.900 174.821 0.079 1
1 865 . 14 1 1 A 68 68 ILE CA C 68 58.600 59.748 -1.148 1
1 866 . 14 1 1 A 68 68 ILE CB C 68 39.300 38.877 0.423 1
1 870 . 14 1 1 A 68 68 ILE N N 68 127.200 128.716 -1.516 1
1 871 . 14 1 1 A 69 69 ASP H H 69 9.110 8.929 0.181 1
1 872 . 14 1 1 A 69 69 ASP HA H 69 5.370 5.049 0.321 1
1 875 . 14 1 1 A 69 69 ASP C C 69 175.800 175.660 0.140 1
1 876 . 14 1 1 A 69 69 ASP CA C 69 52.400 52.774 -0.374 1
1 877 . 14 1 1 A 69 69 ASP CB C 69 43.700 43.420 0.280 1
1 878 . 14 1 1 A 69 69 ASP N N 69 123.400 125.888 -2.488 1
1 879 . 14 1 1 A 70 70 ASN H H 70 8.300 8.805 -0.505 1
1 880 . 14 1 1 A 70 70 ASN HA H 70 4.160 4.342 -0.182 1
1 885 . 14 1 1 A 70 70 ASN C C 70 176.300 174.631 1.669 1
1 886 . 14 1 1 A 70 70 ASN CA C 70 54.300 54.285 0.015 1
1 887 . 14 1 1 A 70 70 ASN CB C 70 37.500 37.014 0.486 1
1 889 . 14 1 1 A 70 70 ASN N N 70 119.800 115.488 4.312 1
1 891 . 14 1 1 A 71 71 ALA H H 71 9.100 7.653 1.447 1
1 892 . 14 1 1 A 71 71 ALA HA H 71 4.500 4.385 0.115 1
1 896 . 14 1 1 A 71 71 ALA C C 71 175.700 176.508 -0.808 1
1 897 . 14 1 1 A 71 71 ALA CA C 71 51.900 52.943 -1.043 1
1 898 . 14 1 1 A 71 71 ALA CB C 71 19.600 19.714 -0.114 1
1 899 . 14 1 1 A 71 71 ALA N N 71 123.000 119.605 3.395 1
1 900 . 14 1 1 A 72 72 ARG H H 72 8.490 8.475 0.015 1
1 901 . 14 1 1 A 72 72 ARG HA H 72 4.720 4.925 -0.205 1
1 909 . 14 1 1 A 72 72 ARG C C 72 175.800 174.572 1.228 1
1 910 . 14 1 1 A 72 72 ARG CA C 72 54.400 54.753 -0.353 1
1 911 . 14 1 1 A 72 72 ARG CB C 72 32.700 31.949 0.751 1
1 915 . 14 1 1 A 72 72 ARG N N 72 122.500 123.065 -0.565 1
1 917 . 14 1 1 A 73 73 VAL H H 73 8.310 8.180 0.130 1
1 918 . 14 1 1 A 73 73 VAL HA H 73 4.250 4.635 -0.385 1
1 926 . 14 1 1 A 73 73 VAL C C 73 174.600 175.293 -0.693 1
1 927 . 14 1 1 A 73 73 VAL CA C 73 62.800 61.733 1.067 1
1 928 . 14 1 1 A 73 73 VAL CB C 73 32.100 32.080 0.020 1
1 931 . 14 1 1 A 73 73 VAL N N 73 127.100 127.551 -0.451 1
1 932 . 14 1 1 A 74 74 ALA H H 74 8.880 8.675 0.205 1
1 933 . 14 1 1 A 74 74 ALA HA H 74 4.500 4.721 -0.221 1
1 937 . 14 1 1 A 74 74 ALA C C 74 174.800 174.658 0.142 1
1 938 . 14 1 1 A 74 74 ALA CA C 74 50.500 50.847 -0.347 1
1 939 . 14 1 1 A 74 74 ALA CB C 74 22.500 23.532 -1.032 1
1 940 . 14 1 1 A 74 74 ALA N N 74 131.000 128.510 2.490 1
1 941 . 14 1 1 A 75 75 GLN H H 75 8.280 8.345 -0.065 1
1 942 . 14 1 1 A 75 75 GLN HA H 75 4.910 4.975 -0.065 1
1 949 . 14 1 1 A 75 75 GLN C C 75 175.100 174.243 0.857 1
1 950 . 14 1 1 A 75 75 GLN CA C 75 54.600 54.056 0.544 1
1 951 . 14 1 1 A 75 75 GLN CB C 75 31.400 30.780 0.620 1
1 954 . 14 1 1 A 75 75 GLN N N 75 118.800 120.140 -1.340 1
1 956 . 14 1 1 A 76 76 PHE H H 76 8.710 8.494 0.216 1
1 957 . 14 1 1 A 76 76 PHE HA H 76 4.660 4.740 -0.080 1
1 965 . 14 1 1 A 76 76 PHE C C 76 174.900 175.546 -0.646 1
1 966 . 14 1 1 A 76 76 PHE CA C 76 57.000 56.158 0.842 1
1 967 . 14 1 1 A 76 76 PHE CB C 76 41.000 41.566 -0.566 1
1 973 . 14 1 1 A 76 76 PHE N N 76 125.000 123.829 1.171 1
1 974 . 14 1 1 A 77 77 ASN H H 77 9.040 9.164 -0.124 1
1 975 . 14 1 1 A 77 77 ASN HA H 77 4.170 4.290 -0.120 1
1 980 . 14 1 1 A 77 77 ASN C C 77 174.200 175.415 -1.215 1
1 981 . 14 1 1 A 77 77 ASN CA C 77 53.800 55.964 -2.164 1
1 982 . 14 1 1 A 77 77 ASN CB C 77 37.400 36.846 0.554 1
1 984 . 14 1 1 A 77 77 ASN N N 77 123.200 120.152 3.048 1
1 986 . 14 1 1 A 78 78 GLY H H 78 8.370 8.373 -0.003 1
1 987 . 14 1 1 A 78 78 GLY HA2 H 78 3.410 4.030 -0.620 1
1 988 . 14 1 1 A 78 78 GLY HA3 H 78 3.980 4.102 -0.122 1
1 989 . 14 1 1 A 78 78 GLY C C 78 173.800 173.469 0.331 1
1 990 . 14 1 1 A 78 78 GLY CA C 78 45.000 45.351 -0.351 1
1 991 . 14 1 1 A 78 78 GLY N N 78 103.300 104.776 -1.476 1
1 992 . 14 1 1 A 79 79 TYR H H 79 7.670 6.964 0.706 1
1 993 . 14 1 1 A 79 79 TYR HA H 79 4.860 5.201 -0.341 1
1 1000 . 14 1 1 A 79 79 TYR C C 79 174.800 173.420 1.380 1
1 1001 . 14 1 1 A 79 79 TYR CA C 79 56.300 55.965 0.335 1
1 1002 . 14 1 1 A 79 79 TYR CB C 79 40.800 40.990 -0.190 1
1 1007 . 14 1 1 A 79 79 TYR N N 79 118.700 115.927 2.773 1
1 1008 . 14 1 1 A 80 80 LEU H H 80 8.760 8.435 0.325 1
1 1009 . 14 1 1 A 80 80 LEU HA H 80 4.830 4.656 0.174 1
1 1019 . 14 1 1 A 80 80 LEU C C 80 176.200 176.854 -0.654 1
1 1020 . 14 1 1 A 80 80 LEU CA C 80 54.700 54.731 -0.031 1
1 1021 . 14 1 1 A 80 80 LEU CB C 80 43.500 42.666 0.834 1
1 1025 . 14 1 1 A 80 80 LEU N N 80 122.600 122.278 0.322 1
1 1026 . 14 1 1 A 81 81 SER H H 81 8.650 8.635 0.015 1
1 1027 . 14 1 1 A 81 81 SER HA H 81 4.860 4.931 -0.071 1
1 1030 . 14 1 1 A 81 81 SER C C 81 172.600 172.844 -0.244 1
1 1031 . 14 1 1 A 81 81 SER CA C 81 56.600 57.119 -0.519 1
1 1032 . 14 1 1 A 81 81 SER CB C 81 66.300 65.068 1.232 1
1 1033 . 14 1 1 A 81 81 SER N N 81 114.700 118.547 -3.847 1
1 1034 . 14 1 1 A 82 82 LEU H H 82 8.680 8.668 0.012 1
1 1035 . 14 1 1 A 82 82 LEU HA H 82 5.190 5.124 0.066 1
1 1045 . 14 1 1 A 82 82 LEU C C 82 177.100 175.850 1.250 1
1 1046 . 14 1 1 A 82 82 LEU CA C 82 53.300 53.688 -0.388 1
1 1047 . 14 1 1 A 82 82 LEU CB C 82 43.800 43.876 -0.076 1
1 1051 . 14 1 1 A 82 82 LEU N N 82 119.800 124.387 -4.587 1
1 1052 . 14 1 1 A 83 83 SER H H 83 9.560 9.655 -0.095 1
1 1053 . 14 1 1 A 83 83 SER HA H 83 5.390 5.294 0.096 1
1 1056 . 14 1 1 A 83 83 SER C C 83 174.200 173.825 0.375 1
1 1057 . 14 1 1 A 83 83 SER CA C 83 57.100 57.956 -0.856 1
1 1058 . 14 1 1 A 83 83 SER CB C 83 64.400 64.408 -0.008 1
1 1059 . 14 1 1 A 83 83 SER N N 83 119.000 122.716 -3.716 1
1 1060 . 14 1 1 A 84 84 VAL H H 84 9.150 9.321 -0.171 1
1 1061 . 14 1 1 A 84 84 VAL HA H 84 4.490 4.586 -0.096 1
1 1069 . 14 1 1 A 84 84 VAL C C 84 174.700 176.130 -1.430 1
1 1070 . 14 1 1 A 84 84 VAL CA C 84 61.300 61.239 0.061 1
1 1071 . 14 1 1 A 84 84 VAL CB C 84 33.000 31.898 1.102 1
1 1074 . 14 1 1 A 84 84 VAL N N 84 128.300 127.322 0.978 1
1 1075 . 14 1 1 A 85 85 GLY H H 85 7.970 8.777 -0.807 1
1 1076 . 14 1 1 A 85 85 GLY HA2 H 85 4.030 4.329 -0.299 1
1 1077 . 14 1 1 A 85 85 GLY HA3 H 85 4.840 4.463 0.377 1
1 1078 . 14 1 1 A 85 85 GLY C C 85 175.800 175.048 0.752 1
1 1079 . 14 1 1 A 85 85 GLY CA C 85 44.800 44.256 0.544 1
1 1080 . 14 1 1 A 85 85 GLY N N 85 114.300 115.529 -1.229 1
1 1081 . 14 1 1 A 86 86 ASP H H 86 8.860 8.753 0.107 1
1 1082 . 14 1 1 A 86 86 ASP HA H 86 4.370 4.404 -0.034 1
1 1085 . 14 1 1 A 86 86 ASP C C 86 177.400 177.416 -0.016 1
1 1086 . 14 1 1 A 86 86 ASP CA C 86 57.400 56.169 1.231 1
1 1087 . 14 1 1 A 86 86 ASP CB C 86 40.600 40.421 0.179 1
1 1088 . 14 1 1 A 86 86 ASP N N 86 122.500 119.651 2.849 1
1 1089 . 14 1 1 A 87 87 SER H H 87 8.540 7.840 0.700 1
1 1090 . 14 1 1 A 87 87 SER HA H 87 4.620 4.492 0.128 1
1 1093 . 14 1 1 A 87 87 SER C C 87 174.700 174.214 0.486 1
1 1094 . 14 1 1 A 87 87 SER CA C 87 58.200 59.017 -0.817 1
1 1095 . 14 1 1 A 87 87 SER CB C 87 63.300 63.930 -0.630 1
1 1096 . 14 1 1 A 87 87 SER N N 87 112.100 113.325 -1.225 1
1 1097 . 14 1 1 A 88 88 SER H H 88 7.880 7.360 0.520 1
1 1098 . 14 1 1 A 88 88 SER HA H 88 5.050 4.487 0.563 1
1 1101 . 14 1 1 A 88 88 SER C C 88 172.700 174.052 -1.352 1
1 1102 . 14 1 1 A 88 88 SER CA C 88 57.600 58.561 -0.961 1
1 1103 . 14 1 1 A 88 88 SER CB C 88 64.300 64.187 0.113 1
1 1104 . 14 1 1 A 88 88 SER N N 88 119.200 117.849 1.351 1
1 1105 . 14 1 1 A 89 89 ARG H H 89 8.350 8.419 -0.069 1
1 1106 . 14 1 1 A 89 89 ARG HA H 89 4.720 5.181 -0.461 1
1 1114 . 14 1 1 A 89 89 ARG C C 89 174.200 174.248 -0.048 1
1 1115 . 14 1 1 A 89 89 ARG CA C 89 55.000 54.361 0.639 1
1 1116 . 14 1 1 A 89 89 ARG CB C 89 33.500 34.004 -0.504 1
1 1120 . 14 1 1 A 89 89 ARG N N 89 122.800 125.368 -2.568 1
1 1122 . 14 1 1 A 90 90 ILE H H 90 8.530 9.001 -0.471 1
1 1123 . 14 1 1 A 90 90 ILE HA H 90 4.790 5.032 -0.242 1
1 1133 . 14 1 1 A 90 90 ILE C C 90 175.400 174.393 1.007 1
1 1134 . 14 1 1 A 90 90 ILE CA C 90 60.600 60.130 0.470 1
1 1135 . 14 1 1 A 90 90 ILE CB C 90 40.600 40.473 0.127 1
1 1139 . 14 1 1 A 90 90 ILE N N 90 123.100 126.841 -3.741 1
1 1140 . 14 1 1 A 91 91 GLU H H 91 9.000 8.996 0.004 1
1 1141 . 14 1 1 A 91 91 GLU HA H 91 4.730 5.095 -0.365 1
1 1146 . 14 1 1 A 91 91 GLU C C 91 175.100 175.903 -0.803 1
1 1147 . 14 1 1 A 91 91 GLU CA C 91 54.300 54.484 -0.184 1
1 1148 . 14 1 1 A 91 91 GLU CB C 91 32.400 33.231 -0.831 1
1 1150 . 14 1 1 A 91 91 GLU N N 91 126.400 128.257 -1.857 1
1 1151 . 14 1 1 A 92 92 SER H H 92 8.830 8.802 0.028 1
1 1152 . 14 1 1 A 92 92 SER HA H 92 4.700 4.768 -0.068 1
1 1155 . 14 1 1 A 92 92 SER C C 92 174.600 174.392 0.208 1
1 1156 . 14 1 1 A 92 92 SER CA C 92 59.300 58.363 0.937 1
1 1157 . 14 1 1 A 92 92 SER CB C 92 63.100 63.710 -0.610 1
1 1158 . 14 1 1 A 92 92 SER N N 92 119.800 122.986 -3.186 1
1 1159 . 14 1 1 A 93 93 VAL H H 93 8.350 8.283 0.067 1
1 1160 . 14 1 1 A 93 93 VAL HA H 93 4.290 4.518 -0.228 1
1 1168 . 14 1 1 A 93 93 VAL C C 93 175.100 175.043 0.057 1
1 1169 . 14 1 1 A 93 93 VAL CA C 93 61.300 61.163 0.137 1
1 1170 . 14 1 1 A 93 93 VAL CB C 93 33.900 34.552 -0.652 1
1 1173 . 14 1 1 A 93 93 VAL N N 93 121.800 124.690 -2.890 1
1 1174 . 14 1 1 A 94 94 ASN H H 94 8.510 8.744 -0.234 1
1 1175 . 14 1 1 A 94 94 ASN HA H 94 4.770 5.066 -0.296 1
1 1180 . 14 1 1 A 94 94 ASN C C 94 175.000 175.500 -0.500 1
1 1181 . 14 1 1 A 94 94 ASN CA C 94 52.700 52.191 0.509 1
1 1182 . 14 1 1 A 94 94 ASN CB C 94 38.500 39.780 -1.280 1
1 1184 . 14 1 1 A 94 94 ASN N N 94 121.800 125.331 -3.531 1
1 1186 . 14 1 1 A 95 95 VAL H H 95 7.860 8.967 -1.107 1
1 1187 . 14 1 1 A 95 95 VAL HA H 95 4.100 3.999 0.101 1
1 1195 . 14 1 1 A 95 95 VAL C C 95 175.100 175.561 -0.461 1
1 1196 . 14 1 1 A 95 95 VAL CA C 95 61.700 64.460 -2.760 1
1 1197 . 14 1 1 A 95 95 VAL CB C 95 33.100 31.734 1.366 1
1 1200 . 14 1 1 A 95 95 VAL N N 95 119.700 123.027 -3.327 1
1 1201 . 14 1 1 A 96 96 ASN H H 96 8.490 8.022 0.468 1
1 1202 . 14 1 1 A 96 96 ASN HA H 96 4.700 5.031 -0.331 1
1 1207 . 14 1 1 A 96 96 ASN C C 96 174.600 174.875 -0.275 1
1 1208 . 14 1 1 A 96 96 ASN CA C 96 53.000 52.283 0.717 1
1 1209 . 14 1 1 A 96 96 ASN CB C 96 39.000 40.719 -1.719 1
1 1211 . 14 1 1 A 96 96 ASN N N 96 122.200 116.004 6.196 1
1 1213 . 14 1 1 A 97 97 ILE H H 97 8.080 8.555 -0.475 1
1 1214 . 14 1 1 A 97 97 ILE HA H 97 4.370 3.689 0.681 1
1 1224 . 14 1 1 A 97 97 ILE CA C 97 58.600 61.895 -3.295 1
1 1225 . 14 1 1 A 97 97 ILE CB C 97 38.600 36.698 1.902 1
1 1229 . 14 1 1 A 97 97 ILE N N 97 123.500 122.496 1.004 1
1 1230 . 14 1 1 A 98 98 PRO HA H 98 4.360 4.427 -0.067 1
1 1237 . 14 1 1 A 98 98 PRO C C 98 176.600 177.596 -0.996 1
1 1238 . 14 1 1 A 98 98 PRO CA C 98 63.100 62.933 0.167 1
1 1239 . 14 1 1 A 98 98 PRO CB C 98 31.800 32.481 -0.681 1
1 1242 . 14 1 1 A 99 99 LEU H H 99 8.200 8.727 -0.527 1
1 1243 . 14 1 1 A 99 99 LEU HA H 99 4.200 4.001 0.199 1
1 1253 . 14 1 1 A 99 99 LEU C C 99 177.300 177.178 0.122 1
1 1254 . 14 1 1 A 99 99 LEU CA C 99 55.000 57.613 -2.613 1
1 1255 . 14 1 1 A 99 99 LEU CB C 99 42.400 41.278 1.122 1
1 1259 . 14 1 1 A 99 99 LEU N N 99 122.500 123.668 -1.168 1
1 1260 . 14 1 1 A 100 100 GLU H H 100 8.250 7.807 0.443 1
1 1261 . 14 1 1 A 100 100 GLU HA H 100 4.140 4.257 -0.117 1
1 1266 . 14 1 1 A 100 100 GLU C C 100 176.100 176.121 -0.021 1
1 1267 . 14 1 1 A 100 100 GLU CA C 100 56.100 56.767 -0.667 1
1 1268 . 14 1 1 A 100 100 GLU CB C 100 29.900 30.104 -0.204 1
1 1270 . 14 1 1 A 100 100 GLU N N 100 121.000 118.924 2.076 1
1 1271 . 14 1 1 A 101 101 HIS H H 101 8.540 8.771 -0.231 1
1 1272 . 14 1 1 A 101 101 HIS HA H 101 4.600 4.924 -0.324 1
1 1275 . 14 1 1 A 101 101 HIS C C 101 174.200 175.323 -1.123 1
1 1276 . 14 1 1 A 101 101 HIS CA C 101 55.200 53.417 1.783 1
1 1277 . 14 1 1 A 101 101 HIS CB C 101 29.000 31.778 -2.778 1
1 1278 . 14 1 1 A 101 101 HIS N N 101 119.400 121.806 -2.406 1
1 1279 . 14 1 1 A 102 102 HIS H H 102 8.660 8.667 -0.007 1
1 1280 . 14 1 1 A 102 102 HIS HA H 102 4.630 3.938 0.692 1
1 1283 . 14 1 1 A 102 102 HIS C C 102 174.200 175.436 -1.236 1
1 1284 . 14 1 1 A 102 102 HIS CA C 102 55.200 59.064 -3.864 1
1 1285 . 14 1 1 A 102 102 HIS CB C 102 29.100 29.874 -0.774 1
1 1286 . 14 1 1 A 102 102 HIS N N 102 119.700 121.614 -1.914 1
1 1287 . 14 1 1 A 103 103 HIS H H 103 8.680 7.959 0.721 1
1 1288 . 14 1 1 A 103 103 HIS HA H 103 4.640 4.226 0.414 1
1 1291 . 14 1 1 A 103 103 HIS C C 103 174.200 175.050 -0.850 1
1 1292 . 14 1 1 A 103 103 HIS CA C 103 55.200 57.094 -1.894 1
1 1293 . 14 1 1 A 103 103 HIS CB C 103 29.200 27.425 1.775 1
1 1294 . 14 1 1 A 103 103 HIS N N 103 120.500 114.915 5.585 1
1 1295 . 14 1 1 A 104 104 HIS H H 104 8.580 8.317 0.263 1
1 1296 . 14 1 1 A 104 104 HIS HA H 104 4.590 4.008 0.582 1
1 1299 . 14 1 1 A 104 104 HIS C C 104 174.200 174.855 -0.655 1
1 1300 . 14 1 1 A 104 104 HIS CA C 104 55.200 58.367 -3.167 1
1 1301 . 14 1 1 A 104 104 HIS CB C 104 29.300 28.361 0.939 1
1 1302 . 14 1 1 A 104 104 HIS N N 104 120.700 110.957 9.743 1
1 1303 . 14 1 1 A 105 105 HIS H H 105 8.550 8.524 0.026 1
1 1304 . 14 1 1 A 105 105 HIS HA H 105 4.610 4.778 -0.168 1
1 1307 . 14 1 1 A 105 105 HIS C C 105 173.500 174.879 -1.379 1
1 1308 . 14 1 1 A 105 105 HIS CA C 105 55.400 55.785 -0.385 1
1 1309 . 14 1 1 A 105 105 HIS CB C 105 28.800 31.254 -2.454 1
1 1310 . 14 1 1 A 105 105 HIS N N 105 119.000 122.664 -3.664 1
1 7 . 15 1 1 A 2 2 ASP H H 2 8.890 8.079 0.811 1
1 8 . 15 1 1 A 2 2 ASP HA H 2 4.740 4.564 0.176 1
1 11 . 15 1 1 A 2 2 ASP C C 2 174.600 175.508 -0.908 1
1 12 . 15 1 1 A 2 2 ASP CA C 2 53.800 54.257 -0.457 1
1 13 . 15 1 1 A 2 2 ASP CB C 2 41.500 41.780 -0.280 1
1 14 . 15 1 1 A 2 2 ASP N N 2 122.100 119.584 2.516 1
1 15 . 15 1 1 A 3 3 LEU H H 3 8.280 8.373 -0.093 1
1 16 . 15 1 1 A 3 3 LEU HA H 3 4.420 4.618 -0.198 1
1 26 . 15 1 1 A 3 3 LEU C C 3 176.900 175.943 0.957 1
1 27 . 15 1 1 A 3 3 LEU CA C 3 55.000 55.736 -0.736 1
1 28 . 15 1 1 A 3 3 LEU CB C 3 42.700 42.334 0.366 1
1 32 . 15 1 1 A 3 3 LEU N N 3 122.300 126.768 -4.468 1
1 33 . 15 1 1 A 4 4 VAL H H 4 8.640 8.579 0.061 1
1 34 . 15 1 1 A 4 4 VAL HA H 4 4.540 4.986 -0.446 1
1 42 . 15 1 1 A 4 4 VAL C C 4 175.800 174.931 0.869 1
1 43 . 15 1 1 A 4 4 VAL CA C 4 59.400 58.598 0.802 1
1 44 . 15 1 1 A 4 4 VAL CB C 4 35.400 35.856 -0.456 1
1 47 . 15 1 1 A 4 4 VAL N N 4 122.600 119.792 2.808 1
1 48 . 15 1 1 A 5 5 LYS H H 5 8.630 8.630 0.000 1
1 49 . 15 1 1 A 5 5 LYS HA H 5 4.450 4.342 0.108 1
1 58 . 15 1 1 A 5 5 LYS C C 5 179.400 178.448 0.952 1
1 59 . 15 1 1 A 5 5 LYS CA C 5 53.600 56.106 -2.506 1
1 60 . 15 1 1 A 5 5 LYS CB C 5 30.900 33.277 -2.377 1
1 64 . 15 1 1 A 5 5 LYS N N 5 121.100 121.800 -0.700 1
1 65 . 15 1 1 A 6 6 ILE H H 6 10.320 8.880 1.440 1
1 66 . 15 1 1 A 6 6 ILE HA H 6 3.440 3.705 -0.265 1
1 76 . 15 1 1 A 6 6 ILE C C 6 178.300 177.601 0.699 1
1 77 . 15 1 1 A 6 6 ILE CA C 6 65.700 65.028 0.672 1
1 78 . 15 1 1 A 6 6 ILE CB C 6 35.900 37.685 -1.785 1
1 82 . 15 1 1 A 6 6 ILE N N 6 125.400 122.532 2.868 1
1 83 . 15 1 1 A 7 7 ARG H H 7 8.210 8.003 0.207 1
1 84 . 15 1 1 A 7 7 ARG HA H 7 3.850 4.131 -0.281 1
1 92 . 15 1 1 A 7 7 ARG C C 7 175.600 177.182 -1.582 1
1 93 . 15 1 1 A 7 7 ARG CA C 7 57.800 58.917 -1.117 1
1 94 . 15 1 1 A 7 7 ARG CB C 7 30.300 29.924 0.376 1
1 98 . 15 1 1 A 7 7 ARG N N 7 118.800 120.347 -1.547 1
1 100 . 15 1 1 A 8 8 ASP H H 8 7.850 7.765 0.085 1
1 101 . 15 1 1 A 8 8 ASP HA H 8 4.700 4.673 0.027 1
1 104 . 15 1 1 A 8 8 ASP C C 8 176.100 176.516 -0.416 1
1 105 . 15 1 1 A 8 8 ASP CA C 8 54.100 54.616 -0.516 1
1 106 . 15 1 1 A 8 8 ASP CB C 8 41.200 41.044 0.156 1
1 107 . 15 1 1 A 8 8 ASP N N 8 116.800 119.257 -2.457 1
1 108 . 15 1 1 A 9 9 VAL H H 9 7.240 7.447 -0.207 1
1 109 . 15 1 1 A 9 9 VAL HA H 9 3.710 3.956 -0.246 1
1 117 . 15 1 1 A 9 9 VAL C C 9 174.900 175.596 -0.696 1
1 118 . 15 1 1 A 9 9 VAL CA C 9 64.300 63.283 1.017 1
1 119 . 15 1 1 A 9 9 VAL CB C 9 31.500 31.512 -0.012 1
1 122 . 15 1 1 A 9 9 VAL N N 9 121.800 121.433 0.367 1
1 123 . 15 1 1 A 10 10 SER H H 10 8.600 8.134 0.466 1
1 124 . 15 1 1 A 10 10 SER HA H 10 4.600 4.640 -0.040 1
1 127 . 15 1 1 A 10 10 SER CA C 10 56.700 57.138 -0.438 1
1 128 . 15 1 1 A 10 10 SER CB C 10 66.100 65.688 0.412 1
1 129 . 15 1 1 A 10 10 SER N N 10 122.200 120.833 1.367 1
1 130 . 15 1 1 A 11 11 LEU H H 11 8.660 9.008 -0.348 1
1 131 . 15 1 1 A 11 11 LEU HA H 11 3.900 3.963 -0.063 1
1 141 . 15 1 1 A 11 11 LEU C C 11 178.100 178.644 -0.544 1
1 142 . 15 1 1 A 11 11 LEU CA C 11 56.700 57.864 -1.164 1
1 143 . 15 1 1 A 11 11 LEU CB C 11 41.400 41.191 0.209 1
1 147 . 15 1 1 A 11 11 LEU N N 11 120.300 123.081 -2.781 1
1 148 . 15 1 1 A 12 12 SER H H 12 8.160 8.217 -0.057 1
1 149 . 15 1 1 A 12 12 SER HA H 12 4.270 4.345 -0.075 1
1 152 . 15 1 1 A 12 12 SER C C 12 174.200 175.230 -1.030 1
1 153 . 15 1 1 A 12 12 SER CA C 12 59.900 61.869 -1.969 1
1 154 . 15 1 1 A 12 12 SER CB C 12 63.100 63.125 -0.025 1
1 155 . 15 1 1 A 12 12 SER N N 12 112.100 114.021 -1.921 1
1 156 . 15 1 1 A 13 13 THR H H 13 7.460 7.655 -0.195 1
1 157 . 15 1 1 A 13 13 THR HA H 13 4.760 4.687 0.073 1
1 162 . 15 1 1 A 13 13 THR CA C 13 56.600 58.988 -2.388 1
1 163 . 15 1 1 A 13 13 THR CB C 13 70.100 68.987 1.113 1
1 165 . 15 1 1 A 13 13 THR N N 13 114.700 109.171 5.529 1
1 166 . 15 1 1 A 14 14 PRO HA H 14 4.050 4.330 -0.280 1
1 173 . 15 1 1 A 14 14 PRO C C 14 175.800 175.816 -0.016 1
1 174 . 15 1 1 A 14 14 PRO CA C 14 65.100 64.406 0.694 1
1 175 . 15 1 1 A 14 14 PRO CB C 14 32.100 31.683 0.417 1
1 178 . 15 1 1 A 15 15 TYR H H 15 7.380 7.493 -0.113 1
1 179 . 15 1 1 A 15 15 TYR HA H 15 5.570 5.566 0.004 1
1 186 . 15 1 1 A 15 15 TYR C C 15 176.100 175.051 1.049 1
1 187 . 15 1 1 A 15 15 TYR CA C 15 56.400 56.673 -0.273 1
1 188 . 15 1 1 A 15 15 TYR CB C 15 41.500 40.255 1.245 1
1 193 . 15 1 1 A 15 15 TYR N N 15 113.800 117.722 -3.922 1
1 194 . 15 1 1 A 16 16 VAL H H 16 9.010 8.682 0.328 1
1 195 . 15 1 1 A 16 16 VAL HA H 16 4.920 5.080 -0.160 1
1 203 . 15 1 1 A 16 16 VAL C C 16 174.300 173.421 0.879 1
1 204 . 15 1 1 A 16 16 VAL CA C 16 59.600 59.469 0.131 1
1 205 . 15 1 1 A 16 16 VAL CB C 16 36.800 36.260 0.540 1
1 208 . 15 1 1 A 16 16 VAL N N 16 113.800 118.231 -4.431 1
1 209 . 15 1 1 A 17 17 SER H H 17 7.960 8.753 -0.793 1
1 210 . 15 1 1 A 17 17 SER HA H 17 5.860 5.616 0.244 1
1 213 . 15 1 1 A 17 17 SER C C 17 172.700 173.054 -0.354 1
1 214 . 15 1 1 A 17 17 SER CA C 17 57.300 56.549 0.751 1
1 215 . 15 1 1 A 17 17 SER CB C 17 64.000 65.182 -1.182 1
1 216 . 15 1 1 A 17 17 SER N N 17 117.100 117.359 -0.259 1
1 217 . 15 1 1 A 18 18 VAL H H 18 8.570 8.622 -0.052 1
1 218 . 15 1 1 A 18 18 VAL HA H 18 4.900 5.112 -0.212 1
1 226 . 15 1 1 A 18 18 VAL C C 18 173.700 173.553 0.147 1
1 227 . 15 1 1 A 18 18 VAL CA C 18 58.800 59.151 -0.351 1
1 228 . 15 1 1 A 18 18 VAL CB C 18 36.700 36.131 0.569 1
1 231 . 15 1 1 A 18 18 VAL N N 18 113.500 119.407 -5.907 1
1 232 . 15 1 1 A 19 19 ILE H H 19 8.490 8.610 -0.120 1
1 233 . 15 1 1 A 19 19 ILE HA H 19 5.300 4.996 0.304 1
1 243 . 15 1 1 A 19 19 ILE C C 19 175.800 174.721 1.079 1
1 244 . 15 1 1 A 19 19 ILE CA C 19 59.700 59.260 0.440 1
1 245 . 15 1 1 A 19 19 ILE CB C 19 41.700 42.704 -1.004 1
1 249 . 15 1 1 A 19 19 ILE N N 19 120.600 122.018 -1.418 1
1 250 . 15 1 1 A 20 20 GLY H H 20 8.670 7.935 0.735 1
1 251 . 15 1 1 A 20 20 GLY HA2 H 20 3.760 4.171 -0.411 1
1 252 . 15 1 1 A 20 20 GLY HA3 H 20 4.190 4.175 0.015 1
1 253 . 15 1 1 A 20 20 GLY C C 20 169.900 171.492 -1.592 1
1 254 . 15 1 1 A 20 20 GLY CA C 20 46.000 46.021 -0.021 1
1 255 . 15 1 1 A 20 20 GLY N N 20 110.200 113.483 -3.283 1
1 256 . 15 1 1 A 21 21 LYS H H 21 8.920 8.376 0.544 1
1 257 . 15 1 1 A 21 21 LYS HA H 21 5.210 5.007 0.203 1
1 266 . 15 1 1 A 21 21 LYS C C 21 176.400 175.523 0.877 1
1 267 . 15 1 1 A 21 21 LYS CA C 21 54.400 54.478 -0.078 1
1 268 . 15 1 1 A 21 21 LYS CB C 21 35.400 34.957 0.443 1
1 272 . 15 1 1 A 21 21 LYS N N 21 119.100 120.515 -1.415 1
1 273 . 15 1 1 A 22 22 ILE H H 22 8.900 8.163 0.737 1
1 274 . 15 1 1 A 22 22 ILE HA H 22 5.050 4.810 0.240 1
1 284 . 15 1 1 A 22 22 ILE C C 22 176.900 175.199 1.701 1
1 285 . 15 1 1 A 22 22 ILE CA C 22 57.800 60.495 -2.695 1
1 286 . 15 1 1 A 22 22 ILE CB C 22 36.200 38.943 -2.743 1
1 290 . 15 1 1 A 22 22 ILE N N 22 130.000 123.096 6.904 1
1 291 . 15 1 1 A 23 23 THR H H 23 9.020 8.760 0.260 1
1 292 . 15 1 1 A 23 23 THR HA H 23 4.660 4.940 -0.280 1
1 297 . 15 1 1 A 23 23 THR C C 23 174.000 174.046 -0.046 1
1 298 . 15 1 1 A 23 23 THR CA C 23 60.800 59.934 0.866 1
1 299 . 15 1 1 A 23 23 THR CB C 23 73.400 71.844 1.556 1
1 301 . 15 1 1 A 23 23 THR N N 23 118.200 117.820 0.380 1
1 302 . 15 1 1 A 24 24 GLY H H 24 8.430 8.692 -0.262 1
1 303 . 15 1 1 A 24 24 GLY HA2 H 24 3.910 3.851 0.059 1
1 304 . 15 1 1 A 24 24 GLY HA3 H 24 3.910 4.036 -0.126 1
1 305 . 15 1 1 A 24 24 GLY C C 24 175.400 174.930 0.470 1
1 306 . 15 1 1 A 24 24 GLY CA C 24 47.100 46.999 0.101 1
1 307 . 15 1 1 A 24 24 GLY N N 24 107.200 112.551 -5.351 1
1 308 . 15 1 1 A 25 25 ILE H H 25 9.370 8.155 1.215 1
1 309 . 15 1 1 A 25 25 ILE HA H 25 4.480 4.075 0.405 1
1 319 . 15 1 1 A 25 25 ILE C C 25 178.200 175.634 2.566 1
1 320 . 15 1 1 A 25 25 ILE CA C 25 59.200 61.094 -1.894 1
1 321 . 15 1 1 A 25 25 ILE CB C 25 35.400 37.841 -2.441 1
1 325 . 15 1 1 A 25 25 ILE N N 25 120.600 120.538 0.062 1
1 326 . 15 1 1 A 26 26 HIS H H 26 9.000 9.053 -0.053 1
1 327 . 15 1 1 A 26 26 HIS HA H 26 4.770 5.154 -0.384 1
1 330 . 15 1 1 A 26 26 HIS C C 26 172.700 173.699 -0.999 1
1 331 . 15 1 1 A 26 26 HIS CA C 26 55.000 54.404 0.596 1
1 332 . 15 1 1 A 26 26 HIS CB C 26 31.100 33.777 -2.677 1
1 333 . 15 1 1 A 26 26 HIS N N 26 123.800 125.263 -1.463 1
1 334 . 15 1 1 A 27 27 LYS H H 27 8.930 8.983 -0.053 1
1 335 . 15 1 1 A 27 27 LYS HA H 27 4.770 4.674 0.096 1
1 344 . 15 1 1 A 27 27 LYS C C 27 175.300 175.025 0.275 1
1 345 . 15 1 1 A 27 27 LYS CA C 27 55.100 54.887 0.213 1
1 346 . 15 1 1 A 27 27 LYS CB C 27 34.400 34.621 -0.221 1
1 350 . 15 1 1 A 27 27 LYS N N 27 125.900 123.731 2.169 1
1 351 . 15 1 1 A 28 28 LYS H H 28 8.880 8.787 0.093 1
1 352 . 15 1 1 A 28 28 LYS HA H 28 4.570 5.010 -0.440 1
1 361 . 15 1 1 A 28 28 LYS C C 28 174.500 175.169 -0.669 1
1 362 . 15 1 1 A 28 28 LYS CA C 28 54.600 54.426 0.174 1
1 363 . 15 1 1 A 28 28 LYS CB C 28 35.300 37.180 -1.880 1
1 367 . 15 1 1 A 28 28 LYS N N 28 127.400 124.846 2.554 1
1 368 . 15 1 1 A 29 29 GLU H H 29 8.440 8.506 -0.066 1
1 369 . 15 1 1 A 29 29 GLU HA H 29 5.260 5.224 0.036 1
1 374 . 15 1 1 A 29 29 GLU C C 29 175.800 175.278 0.522 1
1 375 . 15 1 1 A 29 29 GLU CA C 29 54.800 54.825 -0.025 1
1 376 . 15 1 1 A 29 29 GLU CB C 29 31.500 33.331 -1.831 1
1 378 . 15 1 1 A 29 29 GLU N N 29 122.200 120.456 1.744 1
1 379 . 15 1 1 A 30 30 TYR H H 30 8.960 8.923 0.037 1
1 380 . 15 1 1 A 30 30 TYR HA H 30 4.820 5.393 -0.573 1
1 387 . 15 1 1 A 30 30 TYR C C 30 172.600 172.512 0.088 1
1 388 . 15 1 1 A 30 30 TYR CA C 30 56.300 55.429 0.871 1
1 389 . 15 1 1 A 30 30 TYR CB C 30 40.500 41.712 -1.212 1
1 394 . 15 1 1 A 30 30 TYR N N 30 121.100 118.930 2.170 1
1 395 . 15 1 1 A 31 31 GLU H H 31 8.610 8.766 -0.156 1
1 396 . 15 1 1 A 31 31 GLU HA H 31 4.810 4.435 0.375 1
1 401 . 15 1 1 A 31 31 GLU C C 31 176.100 175.611 0.489 1
1 402 . 15 1 1 A 31 31 GLU CA C 31 55.100 55.740 -0.640 1
1 403 . 15 1 1 A 31 31 GLU CB C 31 30.300 30.440 -0.140 1
1 405 . 15 1 1 A 31 31 GLU N N 31 121.800 121.477 0.323 1
1 406 . 15 1 1 A 32 32 SER H H 32 8.570 8.853 -0.283 1
1 407 . 15 1 1 A 32 32 SER HA H 32 4.520 5.109 -0.589 1
1 410 . 15 1 1 A 32 32 SER C C 32 174.300 173.820 0.480 1
1 411 . 15 1 1 A 32 32 SER CA C 32 57.300 56.563 0.737 1
1 412 . 15 1 1 A 32 32 SER CB C 32 64.100 64.609 -0.509 1
1 413 . 15 1 1 A 32 32 SER N N 32 118.500 119.376 -0.876 1
1 414 . 15 1 1 A 33 33 ASP H H 33 9.290 9.349 -0.059 1
1 415 . 15 1 1 A 33 33 ASP HA H 33 4.340 4.277 0.063 1
1 418 . 15 1 1 A 33 33 ASP C C 33 175.900 175.301 0.599 1
1 419 . 15 1 1 A 33 33 ASP CA C 33 55.000 55.011 -0.011 1
1 420 . 15 1 1 A 33 33 ASP CB C 33 39.300 39.702 -0.402 1
1 421 . 15 1 1 A 33 33 ASP N N 33 125.700 121.307 4.393 1
1 422 . 15 1 1 A 34 34 GLY H H 34 8.690 8.538 0.152 1
1 423 . 15 1 1 A 34 34 GLY HA2 H 34 3.660 3.752 -0.092 1
1 424 . 15 1 1 A 34 34 GLY HA3 H 34 4.140 3.755 0.385 1
1 425 . 15 1 1 A 34 34 GLY C C 34 174.200 173.707 0.493 1
1 426 . 15 1 1 A 34 34 GLY CA C 34 45.600 45.431 0.169 1
1 427 . 15 1 1 A 34 34 GLY N N 34 104.800 104.287 0.513 1
1 428 . 15 1 1 A 35 35 THR H H 35 7.840 8.081 -0.241 1
1 429 . 15 1 1 A 35 35 THR HA H 35 4.660 4.558 0.102 1
1 434 . 15 1 1 A 35 35 THR C C 35 173.000 173.249 -0.249 1
1 435 . 15 1 1 A 35 35 THR CA C 35 60.200 61.222 -1.022 1
1 436 . 15 1 1 A 35 35 THR CB C 35 71.200 71.180 0.020 1
1 438 . 15 1 1 A 35 35 THR N N 35 114.800 116.519 -1.719 1
1 439 . 15 1 1 A 36 36 THR H H 36 8.480 8.672 -0.192 1
1 440 . 15 1 1 A 36 36 THR HA H 36 4.620 4.460 0.160 1
1 445 . 15 1 1 A 36 36 THR C C 36 173.800 174.399 -0.599 1
1 446 . 15 1 1 A 36 36 THR CA C 36 62.300 63.326 -1.026 1
1 447 . 15 1 1 A 36 36 THR CB C 36 69.500 68.866 0.634 1
1 449 . 15 1 1 A 36 36 THR N N 36 119.400 120.984 -1.584 1
1 450 . 15 1 1 A 37 37 LYS H H 37 8.880 8.696 0.184 1
1 451 . 15 1 1 A 37 37 LYS HA H 37 4.570 4.807 -0.237 1
1 460 . 15 1 1 A 37 37 LYS C C 37 174.500 175.210 -0.710 1
1 461 . 15 1 1 A 37 37 LYS CA C 37 54.600 54.011 0.589 1
1 462 . 15 1 1 A 37 37 LYS CB C 37 35.500 35.751 -0.251 1
1 466 . 15 1 1 A 37 37 LYS N N 37 128.000 125.968 2.032 1
1 467 . 15 1 1 A 38 38 SER H H 38 8.370 8.776 -0.406 1
1 468 . 15 1 1 A 38 38 SER HA H 38 5.250 4.799 0.451 1
1 471 . 15 1 1 A 38 38 SER C C 38 173.200 173.770 -0.570 1
1 472 . 15 1 1 A 38 38 SER CA C 38 57.900 58.448 -0.548 1
1 473 . 15 1 1 A 38 38 SER CB C 38 65.500 63.757 1.743 1
1 474 . 15 1 1 A 38 38 SER N N 38 114.300 120.016 -5.716 1
1 475 . 15 1 1 A 39 39 VAL H H 39 9.020 8.923 0.097 1
1 476 . 15 1 1 A 39 39 VAL HA H 39 4.900 4.883 0.017 1
1 484 . 15 1 1 A 39 39 VAL C C 39 173.200 172.823 0.377 1
1 485 . 15 1 1 A 39 39 VAL CA C 39 59.200 59.634 -0.434 1
1 486 . 15 1 1 A 39 39 VAL CB C 39 34.600 35.396 -0.796 1
1 489 . 15 1 1 A 39 39 VAL N N 39 123.600 124.024 -0.424 1
1 490 . 15 1 1 A 40 40 TYR H H 40 8.900 8.848 0.052 1
1 491 . 15 1 1 A 40 40 TYR HA H 40 4.730 5.305 -0.575 1
1 498 . 15 1 1 A 40 40 TYR CA C 40 56.500 56.755 -0.255 1
1 499 . 15 1 1 A 40 40 TYR CB C 40 39.000 40.471 -1.471 1
1 504 . 15 1 1 A 40 40 TYR N N 40 126.300 127.426 -1.126 1
1 505 . 15 1 1 A 41 41 GLN H H 41 8.630 8.649 -0.019 1
1 506 . 15 1 1 A 41 41 GLN HA H 41 5.330 5.283 0.047 1
1 513 . 15 1 1 A 41 41 GLN C C 41 175.500 175.930 -0.430 1
1 514 . 15 1 1 A 41 41 GLN CA C 41 53.800 54.123 -0.323 1
1 515 . 15 1 1 A 41 41 GLN CB C 41 32.100 32.089 0.011 1
1 518 . 15 1 1 A 41 41 GLN N N 41 122.000 121.807 0.193 1
1 520 . 15 1 1 A 42 42 GLY H H 42 8.560 8.012 0.548 1
1 521 . 15 1 1 A 42 42 GLY HA2 H 42 3.680 4.312 -0.632 1
1 522 . 15 1 1 A 42 42 GLY HA3 H 42 4.020 4.375 -0.355 1
1 523 . 15 1 1 A 42 42 GLY C C 42 171.600 171.128 0.472 1
1 524 . 15 1 1 A 42 42 GLY CA C 42 47.300 46.220 1.080 1
1 525 . 15 1 1 A 42 42 GLY N N 42 113.000 108.948 4.052 1
1 526 . 15 1 1 A 43 43 TYR H H 43 9.320 8.865 0.455 1
1 527 . 15 1 1 A 43 43 TYR HA H 43 5.280 5.451 -0.171 1
1 534 . 15 1 1 A 43 43 TYR C C 43 173.200 174.051 -0.851 1
1 535 . 15 1 1 A 43 43 TYR CA C 43 57.600 56.414 1.186 1
1 536 . 15 1 1 A 43 43 TYR CB C 43 42.400 42.450 -0.050 1
1 541 . 15 1 1 A 43 43 TYR N N 43 126.300 118.726 7.574 1
1 542 . 15 1 1 A 44 44 ILE H H 44 9.160 8.841 0.319 1
1 543 . 15 1 1 A 44 44 ILE HA H 44 5.270 5.364 -0.094 1
1 553 . 15 1 1 A 44 44 ILE C C 44 172.900 174.356 -1.456 1
1 554 . 15 1 1 A 44 44 ILE CA C 44 59.000 59.509 -0.509 1
1 555 . 15 1 1 A 44 44 ILE CB C 44 42.200 41.982 0.218 1
1 559 . 15 1 1 A 44 44 ILE N N 44 117.700 123.016 -5.316 1
1 560 . 15 1 1 A 45 45 GLU H H 45 8.420 8.832 -0.412 1
1 561 . 15 1 1 A 45 45 GLU HA H 45 5.600 5.396 0.204 1
1 566 . 15 1 1 A 45 45 GLU C C 45 174.300 174.223 0.077 1
1 567 . 15 1 1 A 45 45 GLU CA C 45 54.000 54.385 -0.385 1
1 568 . 15 1 1 A 45 45 GLU CB C 45 34.400 33.889 0.511 1
1 570 . 15 1 1 A 45 45 GLU N N 45 123.600 127.225 -3.625 1
1 571 . 15 1 1 A 46 46 ASP H H 46 8.530 8.566 -0.036 1
1 572 . 15 1 1 A 46 46 ASP HA H 46 5.070 4.972 0.098 1
1 575 . 15 1 1 A 46 46 ASP C C 46 175.000 175.479 -0.479 1
1 576 . 15 1 1 A 46 46 ASP CA C 46 51.800 52.746 -0.946 1
1 577 . 15 1 1 A 46 46 ASP CB C 46 41.300 44.085 -2.785 1
1 578 . 15 1 1 A 46 46 ASP N N 46 125.500 119.053 6.447 1
1 579 . 15 1 1 A 47 47 ASP H H 47 9.160 8.756 0.404 1
1 580 . 15 1 1 A 47 47 ASP HA H 47 4.430 4.374 0.056 1
1 583 . 15 1 1 A 47 47 ASP C C 47 176.000 177.823 -1.823 1
1 584 . 15 1 1 A 47 47 ASP CA C 47 55.000 55.658 -0.658 1
1 585 . 15 1 1 A 47 47 ASP CB C 47 38.900 40.709 -1.809 1
1 586 . 15 1 1 A 47 47 ASP N N 47 114.200 123.528 -9.328 1
1 587 . 15 1 1 A 48 48 THR H H 48 9.470 7.871 1.599 1
1 588 . 15 1 1 A 48 48 THR HA H 48 4.520 4.452 0.068 1
1 593 . 15 1 1 A 48 48 THR C C 48 174.500 175.093 -0.593 1
1 594 . 15 1 1 A 48 48 THR CA C 48 62.600 62.392 0.208 1
1 595 . 15 1 1 A 48 48 THR CB C 48 70.400 68.988 1.412 1
1 597 . 15 1 1 A 48 48 THR N N 48 111.800 110.158 1.642 1
1 598 . 15 1 1 A 49 49 ALA H H 49 7.850 7.486 0.364 1
1 599 . 15 1 1 A 49 49 ALA HA H 49 4.440 4.429 0.011 1
1 603 . 15 1 1 A 49 49 ALA C C 49 173.200 175.494 -2.294 1
1 604 . 15 1 1 A 49 49 ALA CA C 49 52.700 51.459 1.241 1
1 605 . 15 1 1 A 49 49 ALA CB C 49 21.300 19.861 1.439 1
1 606 . 15 1 1 A 49 49 ALA N N 49 123.400 120.760 2.640 1
1 607 . 15 1 1 A 50 50 ARG H H 50 8.160 8.768 -0.608 1
1 608 . 15 1 1 A 50 50 ARG HA H 50 5.350 5.625 -0.275 1
1 616 . 15 1 1 A 50 50 ARG C C 50 174.700 174.466 0.234 1
1 617 . 15 1 1 A 50 50 ARG CA C 50 54.000 54.529 -0.529 1
1 618 . 15 1 1 A 50 50 ARG CB C 50 34.500 34.323 0.177 1
1 622 . 15 1 1 A 50 50 ARG N N 50 117.400 114.915 2.485 1
1 624 . 15 1 1 A 51 51 ILE H H 51 9.390 8.603 0.787 1
1 625 . 15 1 1 A 51 51 ILE HA H 51 4.790 4.935 -0.145 1
1 635 . 15 1 1 A 51 51 ILE C C 51 172.600 174.797 -2.197 1
1 636 . 15 1 1 A 51 51 ILE CA C 51 60.000 58.932 1.068 1
1 637 . 15 1 1 A 51 51 ILE CB C 51 42.800 41.674 1.126 1
1 641 . 15 1 1 A 51 51 ILE N N 51 124.600 120.999 3.601 1
1 642 . 15 1 1 A 52 52 ARG H H 52 7.980 8.344 -0.364 1
1 643 . 15 1 1 A 52 52 ARG HA H 52 4.170 4.192 -0.022 1
1 651 . 15 1 1 A 52 52 ARG C C 52 174.600 176.232 -1.632 1
1 652 . 15 1 1 A 52 52 ARG CA C 52 57.100 56.208 0.892 1
1 653 . 15 1 1 A 52 52 ARG CB C 52 31.300 30.865 0.435 1
1 657 . 15 1 1 A 52 52 ARG N N 52 125.900 125.589 0.311 1
1 659 . 15 1 1 A 53 53 ILE H H 53 8.290 8.673 -0.383 1
1 660 . 15 1 1 A 53 53 ILE HA H 53 5.160 5.155 0.005 1
1 670 . 15 1 1 A 53 53 ILE C C 53 172.400 174.198 -1.798 1
1 671 . 15 1 1 A 53 53 ILE CA C 53 58.600 59.248 -0.648 1
1 672 . 15 1 1 A 53 53 ILE CB C 53 41.900 42.506 -0.606 1
1 676 . 15 1 1 A 53 53 ILE N N 53 118.500 119.001 -0.501 1
1 677 . 15 1 1 A 54 54 SER H H 54 8.350 8.752 -0.402 1
1 678 . 15 1 1 A 54 54 SER HA H 54 5.070 5.226 -0.156 1
1 681 . 15 1 1 A 54 54 SER C C 54 172.400 172.425 -0.025 1
1 682 . 15 1 1 A 54 54 SER CA C 54 57.000 56.647 0.353 1
1 683 . 15 1 1 A 54 54 SER CB C 54 65.900 64.974 0.926 1
1 684 . 15 1 1 A 54 54 SER N N 54 120.700 118.722 1.978 1
1 685 . 15 1 1 A 55 55 SER H H 55 9.130 9.147 -0.017 1
1 686 . 15 1 1 A 55 55 SER HA H 55 5.270 5.095 0.175 1
1 690 . 15 1 1 A 55 55 SER C C 55 174.400 172.744 1.656 1
1 691 . 15 1 1 A 55 55 SER CA C 55 55.500 56.343 -0.843 1
1 692 . 15 1 1 A 55 55 SER CB C 55 64.500 65.139 -0.639 1
1 693 . 15 1 1 A 55 55 SER N N 55 117.200 121.146 -3.946 1
1 694 . 15 1 1 A 56 56 PHE H H 56 8.970 8.595 0.375 1
1 695 . 15 1 1 A 56 56 PHE HA H 56 4.600 4.932 -0.332 1
1 703 . 15 1 1 A 56 56 PHE C C 56 176.500 177.267 -0.767 1
1 704 . 15 1 1 A 56 56 PHE CA C 56 58.300 57.662 0.638 1
1 705 . 15 1 1 A 56 56 PHE CB C 56 37.900 40.560 -2.660 1
1 711 . 15 1 1 A 56 56 PHE N N 56 129.400 125.294 4.106 1
1 712 . 15 1 1 A 57 57 GLY H H 57 8.570 8.925 -0.355 1
1 713 . 15 1 1 A 57 57 GLY HA2 H 57 4.020 4.146 -0.126 1
1 714 . 15 1 1 A 57 57 GLY HA3 H 57 4.380 4.177 0.203 1
1 715 . 15 1 1 A 57 57 GLY C C 57 173.700 174.150 -0.450 1
1 716 . 15 1 1 A 57 57 GLY CA C 57 46.300 45.773 0.527 1
1 717 . 15 1 1 A 57 57 GLY N N 57 112.500 112.258 0.242 1
1 718 . 15 1 1 A 58 58 LYS H H 58 6.800 8.760 -1.960 1
1 719 . 15 1 1 A 58 58 LYS HA H 58 4.410 4.413 -0.003 1
1 728 . 15 1 1 A 58 58 LYS C C 58 174.800 175.864 -1.064 1
1 729 . 15 1 1 A 58 58 LYS CA C 58 55.200 55.825 -0.625 1
1 730 . 15 1 1 A 58 58 LYS CB C 58 33.300 33.097 0.203 1
1 734 . 15 1 1 A 58 58 LYS N N 58 118.700 122.524 -3.824 1
1 735 . 15 1 1 A 59 59 GLN H H 59 8.390 8.171 0.219 1
1 736 . 15 1 1 A 59 59 GLN HA H 59 1.830 3.687 -1.857 1
1 743 . 15 1 1 A 59 59 GLN C C 59 174.100 174.856 -0.756 1
1 744 . 15 1 1 A 59 59 GLN CA C 59 57.100 54.587 2.513 1
1 745 . 15 1 1 A 59 59 GLN CB C 59 28.900 29.570 -0.670 1
1 748 . 15 1 1 A 59 59 GLN N N 59 124.000 123.623 0.377 1
1 750 . 15 1 1 A 60 60 LEU H H 60 5.320 8.242 -2.922 1
1 751 . 15 1 1 A 60 60 LEU HA H 60 4.370 4.970 -0.600 1
1 761 . 15 1 1 A 60 60 LEU CA C 60 52.800 53.502 -0.702 1
1 762 . 15 1 1 A 60 60 LEU CB C 60 46.700 45.701 0.999 1
1 766 . 15 1 1 A 60 60 LEU N N 60 121.800 121.033 0.767 1
1 767 . 15 1 1 A 61 61 GLN H H 61 8.660 8.724 -0.064 1
1 768 . 15 1 1 A 61 61 GLN HA H 61 4.440 4.640 -0.200 1
1 775 . 15 1 1 A 61 61 GLN C C 61 174.000 175.313 -1.313 1
1 776 . 15 1 1 A 61 61 GLN CA C 61 53.800 54.389 -0.589 1
1 777 . 15 1 1 A 61 61 GLN CB C 61 31.800 30.991 0.809 1
1 780 . 15 1 1 A 61 61 GLN N N 61 120.300 120.325 -0.025 1
1 782 . 15 1 1 A 62 62 ASP H H 62 8.450 8.729 -0.279 1
1 783 . 15 1 1 A 62 62 ASP HA H 62 4.130 4.754 -0.624 1
1 786 . 15 1 1 A 62 62 ASP C C 62 177.200 176.242 0.958 1
1 787 . 15 1 1 A 62 62 ASP CA C 62 55.700 54.544 1.156 1
1 788 . 15 1 1 A 62 62 ASP CB C 62 39.400 40.979 -1.579 1
1 789 . 15 1 1 A 62 62 ASP N N 62 122.400 123.993 -1.593 1
1 790 . 15 1 1 A 63 63 SER H H 63 9.210 9.225 -0.015 1
1 791 . 15 1 1 A 63 63 SER HA H 63 3.850 4.121 -0.271 1
1 794 . 15 1 1 A 63 63 SER C C 63 173.200 173.090 0.110 1
1 795 . 15 1 1 A 63 63 SER CA C 63 61.700 59.602 2.098 1
1 796 . 15 1 1 A 63 63 SER CB C 63 61.800 62.735 -0.935 1
1 797 . 15 1 1 A 63 63 SER N N 63 114.300 115.723 -1.423 1
1 798 . 15 1 1 A 64 64 ASP H H 64 7.960 7.590 0.370 1
1 799 . 15 1 1 A 64 64 ASP HA H 64 4.540 4.875 -0.335 1
1 802 . 15 1 1 A 64 64 ASP C C 64 174.900 175.569 -0.669 1
1 803 . 15 1 1 A 64 64 ASP CA C 64 54.900 53.917 0.983 1
1 804 . 15 1 1 A 64 64 ASP CB C 64 40.900 42.082 -1.182 1
1 805 . 15 1 1 A 64 64 ASP N N 64 122.600 121.810 0.790 1
1 806 . 15 1 1 A 65 65 VAL H H 65 8.180 8.610 -0.430 1
1 807 . 15 1 1 A 65 65 VAL HA H 65 4.670 4.541 0.129 1
1 815 . 15 1 1 A 65 65 VAL C C 65 175.900 175.805 0.095 1
1 816 . 15 1 1 A 65 65 VAL CA C 65 62.300 62.320 -0.020 1
1 817 . 15 1 1 A 65 65 VAL CB C 65 31.700 31.607 0.093 1
1 820 . 15 1 1 A 65 65 VAL N N 65 123.100 125.518 -2.418 1
1 821 . 15 1 1 A 66 66 VAL H H 66 8.770 8.816 -0.046 1
1 822 . 15 1 1 A 66 66 VAL HA H 66 5.160 5.160 0.000 1
1 830 . 15 1 1 A 66 66 VAL C C 66 173.600 173.349 0.251 1
1 831 . 15 1 1 A 66 66 VAL CA C 66 58.100 58.843 -0.743 1
1 832 . 15 1 1 A 66 66 VAL CB C 66 35.700 35.911 -0.211 1
1 835 . 15 1 1 A 66 66 VAL N N 66 118.100 121.041 -2.941 1
1 836 . 15 1 1 A 67 67 ARG H H 67 8.880 8.538 0.342 1
1 837 . 15 1 1 A 67 67 ARG HA H 67 5.110 5.294 -0.184 1
1 845 . 15 1 1 A 67 67 ARG C C 67 175.300 174.488 0.812 1
1 846 . 15 1 1 A 67 67 ARG CA C 67 54.200 54.291 -0.091 1
1 847 . 15 1 1 A 67 67 ARG CB C 67 32.200 33.450 -1.250 1
1 851 . 15 1 1 A 67 67 ARG N N 67 120.200 121.732 -1.532 1
1 853 . 15 1 1 A 68 68 ILE H H 68 9.220 8.882 0.338 1
1 854 . 15 1 1 A 68 68 ILE HA H 68 4.990 4.702 0.288 1
1 864 . 15 1 1 A 68 68 ILE C C 68 174.900 174.436 0.464 1
1 865 . 15 1 1 A 68 68 ILE CA C 68 58.600 59.843 -1.243 1
1 866 . 15 1 1 A 68 68 ILE CB C 68 39.300 38.766 0.534 1
1 870 . 15 1 1 A 68 68 ILE N N 68 127.200 128.436 -1.236 1
1 871 . 15 1 1 A 69 69 ASP H H 69 9.110 8.949 0.161 1
1 872 . 15 1 1 A 69 69 ASP HA H 69 5.370 5.046 0.324 1
1 875 . 15 1 1 A 69 69 ASP C C 69 175.800 175.881 -0.081 1
1 876 . 15 1 1 A 69 69 ASP CA C 69 52.400 53.068 -0.668 1
1 877 . 15 1 1 A 69 69 ASP CB C 69 43.700 42.917 0.783 1
1 878 . 15 1 1 A 69 69 ASP N N 69 123.400 127.555 -4.155 1
1 879 . 15 1 1 A 70 70 ASN H H 70 8.300 9.110 -0.810 1
1 880 . 15 1 1 A 70 70 ASN HA H 70 4.160 4.406 -0.246 1
1 885 . 15 1 1 A 70 70 ASN C C 70 176.300 174.661 1.639 1
1 886 . 15 1 1 A 70 70 ASN CA C 70 54.300 54.169 0.131 1
1 887 . 15 1 1 A 70 70 ASN CB C 70 37.500 37.533 -0.033 1
1 889 . 15 1 1 A 70 70 ASN N N 70 119.800 123.277 -3.477 1
1 891 . 15 1 1 A 71 71 ALA H H 71 9.100 7.849 1.251 1
1 892 . 15 1 1 A 71 71 ALA HA H 71 4.500 4.407 0.093 1
1 896 . 15 1 1 A 71 71 ALA C C 71 175.700 176.578 -0.878 1
1 897 . 15 1 1 A 71 71 ALA CA C 71 51.900 53.041 -1.141 1
1 898 . 15 1 1 A 71 71 ALA CB C 71 19.600 19.799 -0.199 1
1 899 . 15 1 1 A 71 71 ALA N N 71 123.000 121.286 1.714 1
1 900 . 15 1 1 A 72 72 ARG H H 72 8.490 8.584 -0.094 1
1 901 . 15 1 1 A 72 72 ARG HA H 72 4.720 4.881 -0.161 1
1 909 . 15 1 1 A 72 72 ARG C C 72 175.800 174.949 0.851 1
1 910 . 15 1 1 A 72 72 ARG CA C 72 54.400 54.862 -0.462 1
1 911 . 15 1 1 A 72 72 ARG CB C 72 32.700 31.719 0.981 1
1 915 . 15 1 1 A 72 72 ARG N N 72 122.500 122.804 -0.304 1
1 917 . 15 1 1 A 73 73 VAL H H 73 8.310 8.095 0.215 1
1 918 . 15 1 1 A 73 73 VAL HA H 73 4.250 4.492 -0.242 1
1 926 . 15 1 1 A 73 73 VAL C C 73 174.600 175.741 -1.141 1
1 927 . 15 1 1 A 73 73 VAL CA C 73 62.800 62.317 0.483 1
1 928 . 15 1 1 A 73 73 VAL CB C 73 32.100 31.998 0.102 1
1 931 . 15 1 1 A 73 73 VAL N N 73 127.100 127.144 -0.044 1
1 932 . 15 1 1 A 74 74 ALA H H 74 8.880 8.717 0.163 1
1 933 . 15 1 1 A 74 74 ALA HA H 74 4.500 4.852 -0.352 1
1 937 . 15 1 1 A 74 74 ALA C C 74 174.800 174.591 0.209 1
1 938 . 15 1 1 A 74 74 ALA CA C 74 50.500 50.636 -0.136 1
1 939 . 15 1 1 A 74 74 ALA CB C 74 22.500 23.514 -1.014 1
1 940 . 15 1 1 A 74 74 ALA N N 74 131.000 128.453 2.547 1
1 941 . 15 1 1 A 75 75 GLN H H 75 8.280 8.375 -0.095 1
1 942 . 15 1 1 A 75 75 GLN HA H 75 4.910 4.975 -0.065 1
1 949 . 15 1 1 A 75 75 GLN C C 75 175.100 174.110 0.990 1
1 950 . 15 1 1 A 75 75 GLN CA C 75 54.600 53.851 0.749 1
1 951 . 15 1 1 A 75 75 GLN CB C 75 31.400 31.739 -0.339 1
1 954 . 15 1 1 A 75 75 GLN N N 75 118.800 120.489 -1.689 1
1 956 . 15 1 1 A 76 76 PHE H H 76 8.710 9.340 -0.630 1
1 957 . 15 1 1 A 76 76 PHE HA H 76 4.660 4.889 -0.229 1
1 965 . 15 1 1 A 76 76 PHE C C 76 174.900 175.526 -0.626 1
1 966 . 15 1 1 A 76 76 PHE CA C 76 57.000 56.728 0.272 1
1 967 . 15 1 1 A 76 76 PHE CB C 76 41.000 41.780 -0.780 1
1 973 . 15 1 1 A 76 76 PHE N N 76 125.000 125.776 -0.776 1
1 974 . 15 1 1 A 77 77 ASN H H 77 9.040 8.961 0.079 1
1 975 . 15 1 1 A 77 77 ASN HA H 77 4.170 4.479 -0.309 1
1 980 . 15 1 1 A 77 77 ASN C C 77 174.200 175.712 -1.512 1
1 981 . 15 1 1 A 77 77 ASN CA C 77 53.800 54.506 -0.706 1
1 982 . 15 1 1 A 77 77 ASN CB C 77 37.400 37.575 -0.175 1
1 984 . 15 1 1 A 77 77 ASN N N 77 123.200 124.396 -1.196 1
1 986 . 15 1 1 A 78 78 GLY H H 78 8.370 8.598 -0.228 1
1 987 . 15 1 1 A 78 78 GLY HA2 H 78 3.410 3.606 -0.196 1
1 988 . 15 1 1 A 78 78 GLY HA3 H 78 3.980 3.706 0.274 1
1 989 . 15 1 1 A 78 78 GLY C C 78 173.800 173.146 0.654 1
1 990 . 15 1 1 A 78 78 GLY CA C 78 45.000 45.247 -0.247 1
1 991 . 15 1 1 A 78 78 GLY N N 78 103.300 104.778 -1.478 1
1 992 . 15 1 1 A 79 79 TYR H H 79 7.670 8.126 -0.456 1
1 993 . 15 1 1 A 79 79 TYR HA H 79 4.860 4.855 0.005 1
1 1000 . 15 1 1 A 79 79 TYR C C 79 174.800 175.582 -0.782 1
1 1001 . 15 1 1 A 79 79 TYR CA C 79 56.300 57.429 -1.129 1
1 1002 . 15 1 1 A 79 79 TYR CB C 79 40.800 40.793 0.007 1
1 1007 . 15 1 1 A 79 79 TYR N N 79 118.700 119.261 -0.561 1
1 1008 . 15 1 1 A 80 80 LEU H H 80 8.760 8.717 0.043 1
1 1009 . 15 1 1 A 80 80 LEU HA H 80 4.830 4.497 0.333 1
1 1019 . 15 1 1 A 80 80 LEU C C 80 176.200 176.254 -0.054 1
1 1020 . 15 1 1 A 80 80 LEU CA C 80 54.700 54.968 -0.268 1
1 1021 . 15 1 1 A 80 80 LEU CB C 80 43.500 42.430 1.070 1
1 1025 . 15 1 1 A 80 80 LEU N N 80 122.600 126.030 -3.430 1
1 1026 . 15 1 1 A 81 81 SER H H 81 8.650 8.889 -0.239 1
1 1027 . 15 1 1 A 81 81 SER HA H 81 4.860 5.276 -0.416 1
1 1030 . 15 1 1 A 81 81 SER C C 81 172.600 172.404 0.196 1
1 1031 . 15 1 1 A 81 81 SER CA C 81 56.600 57.335 -0.735 1
1 1032 . 15 1 1 A 81 81 SER CB C 81 66.300 66.572 -0.272 1
1 1033 . 15 1 1 A 81 81 SER N N 81 114.700 117.202 -2.502 1
1 1034 . 15 1 1 A 82 82 LEU H H 82 8.680 8.962 -0.282 1
1 1035 . 15 1 1 A 82 82 LEU HA H 82 5.190 5.035 0.155 1
1 1045 . 15 1 1 A 82 82 LEU C C 82 177.100 175.424 1.676 1
1 1046 . 15 1 1 A 82 82 LEU CA C 82 53.300 53.644 -0.344 1
1 1047 . 15 1 1 A 82 82 LEU CB C 82 43.800 42.937 0.863 1
1 1051 . 15 1 1 A 82 82 LEU N N 82 119.800 122.538 -2.738 1
1 1052 . 15 1 1 A 83 83 SER H H 83 9.560 9.518 0.042 1
1 1053 . 15 1 1 A 83 83 SER HA H 83 5.390 5.219 0.171 1
1 1056 . 15 1 1 A 83 83 SER C C 83 174.200 173.919 0.281 1
1 1057 . 15 1 1 A 83 83 SER CA C 83 57.100 58.017 -0.917 1
1 1058 . 15 1 1 A 83 83 SER CB C 83 64.400 64.440 -0.040 1
1 1059 . 15 1 1 A 83 83 SER N N 83 119.000 121.730 -2.730 1
1 1060 . 15 1 1 A 84 84 VAL H H 84 9.150 9.222 -0.072 1
1 1061 . 15 1 1 A 84 84 VAL HA H 84 4.490 4.651 -0.161 1
1 1069 . 15 1 1 A 84 84 VAL C C 84 174.700 175.934 -1.234 1
1 1070 . 15 1 1 A 84 84 VAL CA C 84 61.300 61.214 0.086 1
1 1071 . 15 1 1 A 84 84 VAL CB C 84 33.000 31.856 1.144 1
1 1074 . 15 1 1 A 84 84 VAL N N 84 128.300 126.527 1.773 1
1 1075 . 15 1 1 A 85 85 GLY H H 85 7.970 8.830 -0.860 1
1 1076 . 15 1 1 A 85 85 GLY HA2 H 85 4.030 4.350 -0.320 1
1 1077 . 15 1 1 A 85 85 GLY HA3 H 85 4.840 4.470 0.370 1
1 1078 . 15 1 1 A 85 85 GLY C C 85 175.800 175.159 0.641 1
1 1079 . 15 1 1 A 85 85 GLY CA C 85 44.800 44.167 0.633 1
1 1080 . 15 1 1 A 85 85 GLY N N 85 114.300 115.557 -1.257 1
1 1081 . 15 1 1 A 86 86 ASP H H 86 8.860 8.743 0.117 1
1 1082 . 15 1 1 A 86 86 ASP HA H 86 4.370 4.380 -0.010 1
1 1085 . 15 1 1 A 86 86 ASP C C 86 177.400 177.394 0.006 1
1 1086 . 15 1 1 A 86 86 ASP CA C 86 57.400 56.197 1.203 1
1 1087 . 15 1 1 A 86 86 ASP CB C 86 40.600 40.388 0.212 1
1 1088 . 15 1 1 A 86 86 ASP N N 86 122.500 119.593 2.907 1
1 1089 . 15 1 1 A 87 87 SER H H 87 8.540 7.689 0.851 1
1 1090 . 15 1 1 A 87 87 SER HA H 87 4.620 4.393 0.227 1
1 1093 . 15 1 1 A 87 87 SER C C 87 174.700 174.469 0.231 1
1 1094 . 15 1 1 A 87 87 SER CA C 87 58.200 58.817 -0.617 1
1 1095 . 15 1 1 A 87 87 SER CB C 87 63.300 63.701 -0.401 1
1 1096 . 15 1 1 A 87 87 SER N N 87 112.100 111.683 0.417 1
1 1097 . 15 1 1 A 88 88 SER H H 88 7.880 7.515 0.365 1
1 1098 . 15 1 1 A 88 88 SER HA H 88 5.050 4.576 0.474 1
1 1101 . 15 1 1 A 88 88 SER C C 88 172.700 173.554 -0.854 1
1 1102 . 15 1 1 A 88 88 SER CA C 88 57.600 57.450 0.150 1
1 1103 . 15 1 1 A 88 88 SER CB C 88 64.300 64.962 -0.662 1
1 1104 . 15 1 1 A 88 88 SER N N 88 119.200 118.201 0.999 1
1 1105 . 15 1 1 A 89 89 ARG H H 89 8.350 8.371 -0.021 1
1 1106 . 15 1 1 A 89 89 ARG HA H 89 4.720 5.187 -0.467 1
1 1114 . 15 1 1 A 89 89 ARG C C 89 174.200 174.042 0.158 1
1 1115 . 15 1 1 A 89 89 ARG CA C 89 55.000 54.403 0.597 1
1 1116 . 15 1 1 A 89 89 ARG CB C 89 33.500 33.830 -0.330 1
1 1120 . 15 1 1 A 89 89 ARG N N 89 122.800 124.724 -1.924 1
1 1122 . 15 1 1 A 90 90 ILE H H 90 8.530 9.040 -0.510 1
1 1123 . 15 1 1 A 90 90 ILE HA H 90 4.790 5.044 -0.254 1
1 1133 . 15 1 1 A 90 90 ILE C C 90 175.400 175.121 0.279 1
1 1134 . 15 1 1 A 90 90 ILE CA C 90 60.600 60.174 0.426 1
1 1135 . 15 1 1 A 90 90 ILE CB C 90 40.600 40.341 0.259 1
1 1139 . 15 1 1 A 90 90 ILE N N 90 123.100 126.934 -3.834 1
1 1140 . 15 1 1 A 91 91 GLU H H 91 9.000 8.900 0.100 1
1 1141 . 15 1 1 A 91 91 GLU HA H 91 4.730 4.896 -0.166 1
1 1146 . 15 1 1 A 91 91 GLU C C 91 175.100 175.682 -0.582 1
1 1147 . 15 1 1 A 91 91 GLU CA C 91 54.300 54.614 -0.314 1
1 1148 . 15 1 1 A 91 91 GLU CB C 91 32.400 32.245 0.155 1
1 1150 . 15 1 1 A 91 91 GLU N N 91 126.400 127.281 -0.881 1
1 1151 . 15 1 1 A 92 92 SER H H 92 8.830 8.958 -0.128 1
1 1152 . 15 1 1 A 92 92 SER HA H 92 4.700 4.682 0.018 1
1 1155 . 15 1 1 A 92 92 SER C C 92 174.600 173.958 0.642 1
1 1156 . 15 1 1 A 92 92 SER CA C 92 59.300 58.571 0.729 1
1 1157 . 15 1 1 A 92 92 SER CB C 92 63.100 63.844 -0.744 1
1 1158 . 15 1 1 A 92 92 SER N N 92 119.800 121.186 -1.386 1
1 1159 . 15 1 1 A 93 93 VAL H H 93 8.350 8.433 -0.083 1
1 1160 . 15 1 1 A 93 93 VAL HA H 93 4.290 4.488 -0.198 1
1 1168 . 15 1 1 A 93 93 VAL C C 93 175.100 174.610 0.490 1
1 1169 . 15 1 1 A 93 93 VAL CA C 93 61.300 60.899 0.401 1
1 1170 . 15 1 1 A 93 93 VAL CB C 93 33.900 32.114 1.786 1
1 1173 . 15 1 1 A 93 93 VAL N N 93 121.800 124.963 -3.163 1
1 1174 . 15 1 1 A 94 94 ASN H H 94 8.510 7.653 0.857 1
1 1175 . 15 1 1 A 94 94 ASN HA H 94 4.770 5.041 -0.271 1
1 1180 . 15 1 1 A 94 94 ASN C C 94 175.000 175.042 -0.042 1
1 1181 . 15 1 1 A 94 94 ASN CA C 94 52.700 52.547 0.153 1
1 1182 . 15 1 1 A 94 94 ASN CB C 94 38.500 40.093 -1.593 1
1 1184 . 15 1 1 A 94 94 ASN N N 94 121.800 120.961 0.839 1
1 1186 . 15 1 1 A 95 95 VAL H H 95 7.860 8.508 -0.648 1
1 1187 . 15 1 1 A 95 95 VAL HA H 95 4.100 3.686 0.414 1
1 1195 . 15 1 1 A 95 95 VAL C C 95 175.100 176.284 -1.184 1
1 1196 . 15 1 1 A 95 95 VAL CA C 95 61.700 65.146 -3.446 1
1 1197 . 15 1 1 A 95 95 VAL CB C 95 33.100 31.755 1.345 1
1 1200 . 15 1 1 A 95 95 VAL N N 95 119.700 124.640 -4.940 1
1 1201 . 15 1 1 A 96 96 ASN H H 96 8.490 8.558 -0.068 1
1 1202 . 15 1 1 A 96 96 ASN HA H 96 4.700 4.345 0.355 1
1 1207 . 15 1 1 A 96 96 ASN C C 96 174.600 173.687 0.913 1
1 1208 . 15 1 1 A 96 96 ASN CA C 96 53.000 54.432 -1.432 1
1 1209 . 15 1 1 A 96 96 ASN CB C 96 39.000 36.909 2.091 1
1 1211 . 15 1 1 A 96 96 ASN N N 96 122.200 119.253 2.947 1
1 1213 . 15 1 1 A 97 97 ILE H H 97 8.080 7.785 0.295 1
1 1214 . 15 1 1 A 97 97 ILE HA H 97 4.370 4.602 -0.232 1
1 1224 . 15 1 1 A 97 97 ILE CA C 97 58.600 58.550 0.050 1
1 1225 . 15 1 1 A 97 97 ILE CB C 97 38.600 38.632 -0.032 1
1 1229 . 15 1 1 A 97 97 ILE N N 97 123.500 118.978 4.522 1
1 1230 . 15 1 1 A 98 98 PRO HA H 98 4.360 4.585 -0.225 1
1 1237 . 15 1 1 A 98 98 PRO C C 98 176.600 176.918 -0.318 1
1 1238 . 15 1 1 A 98 98 PRO CA C 98 63.100 62.600 0.500 1
1 1239 . 15 1 1 A 98 98 PRO CB C 98 31.800 32.122 -0.322 1
1 1242 . 15 1 1 A 99 99 LEU H H 99 8.200 8.324 -0.124 1
1 1243 . 15 1 1 A 99 99 LEU HA H 99 4.200 4.500 -0.300 1
1 1253 . 15 1 1 A 99 99 LEU C C 99 177.300 177.059 0.241 1
1 1254 . 15 1 1 A 99 99 LEU CA C 99 55.000 54.935 0.065 1
1 1255 . 15 1 1 A 99 99 LEU CB C 99 42.400 42.743 -0.343 1
1 1259 . 15 1 1 A 99 99 LEU N N 99 122.500 123.821 -1.321 1
1 1260 . 15 1 1 A 100 100 GLU H H 100 8.250 8.701 -0.451 1
1 1261 . 15 1 1 A 100 100 GLU HA H 100 4.140 4.593 -0.453 1
1 1266 . 15 1 1 A 100 100 GLU C C 100 176.100 175.853 0.247 1
1 1267 . 15 1 1 A 100 100 GLU CA C 100 56.100 56.830 -0.730 1
1 1268 . 15 1 1 A 100 100 GLU CB C 100 29.900 30.571 -0.671 1
1 1270 . 15 1 1 A 100 100 GLU N N 100 121.000 124.601 -3.601 1
1 1271 . 15 1 1 A 101 101 HIS H H 101 8.540 8.890 -0.350 1
1 1272 . 15 1 1 A 101 101 HIS HA H 101 4.600 4.755 -0.155 1
1 1275 . 15 1 1 A 101 101 HIS C C 101 174.200 174.147 0.053 1
1 1276 . 15 1 1 A 101 101 HIS CA C 101 55.200 57.038 -1.838 1
1 1277 . 15 1 1 A 101 101 HIS CB C 101 29.000 31.533 -2.533 1
1 1278 . 15 1 1 A 101 101 HIS N N 101 119.400 124.926 -5.526 1
1 1279 . 15 1 1 A 102 102 HIS H H 102 8.660 8.201 0.459 1
1 1280 . 15 1 1 A 102 102 HIS HA H 102 4.630 4.470 0.160 1
1 1283 . 15 1 1 A 102 102 HIS C C 102 174.200 175.379 -1.179 1
1 1284 . 15 1 1 A 102 102 HIS CA C 102 55.200 55.975 -0.775 1
1 1285 . 15 1 1 A 102 102 HIS CB C 102 29.100 30.726 -1.626 1
1 1286 . 15 1 1 A 102 102 HIS N N 102 119.700 114.828 4.872 1
1 1287 . 15 1 1 A 103 103 HIS H H 103 8.680 8.595 0.085 1
1 1288 . 15 1 1 A 103 103 HIS HA H 103 4.640 4.358 0.282 1
1 1291 . 15 1 1 A 103 103 HIS C C 103 174.200 174.428 -0.228 1
1 1292 . 15 1 1 A 103 103 HIS CA C 103 55.200 58.316 -3.116 1
1 1293 . 15 1 1 A 103 103 HIS CB C 103 29.200 28.447 0.753 1
1 1294 . 15 1 1 A 103 103 HIS N N 103 120.500 117.978 2.522 1
1 1295 . 15 1 1 A 104 104 HIS H H 104 8.580 8.336 0.244 1
1 1296 . 15 1 1 A 104 104 HIS HA H 104 4.590 5.418 -0.828 1
1 1299 . 15 1 1 A 104 104 HIS C C 104 174.200 171.957 2.243 1
1 1300 . 15 1 1 A 104 104 HIS CA C 104 55.200 54.382 0.818 1
1 1301 . 15 1 1 A 104 104 HIS CB C 104 29.300 32.283 -2.983 1
1 1302 . 15 1 1 A 104 104 HIS N N 104 120.700 114.385 6.315 1
1 1303 . 15 1 1 A 105 105 HIS H H 105 8.550 8.922 -0.372 1
1 1304 . 15 1 1 A 105 105 HIS HA H 105 4.610 4.585 0.025 1
1 1307 . 15 1 1 A 105 105 HIS C C 105 173.500 174.637 -1.137 1
1 1308 . 15 1 1 A 105 105 HIS CA C 105 55.400 56.753 -1.353 1
1 1309 . 15 1 1 A 105 105 HIS CB C 105 28.800 30.701 -1.901 1
1 1310 . 15 1 1 A 105 105 HIS N N 105 119.000 120.091 -1.091 1
1 7 . 16 1 1 A 2 2 ASP H H 2 8.890 7.961 0.929 1
1 8 . 16 1 1 A 2 2 ASP HA H 2 4.740 4.744 -0.004 1
1 11 . 16 1 1 A 2 2 ASP C C 2 174.600 175.724 -1.124 1
1 12 . 16 1 1 A 2 2 ASP CA C 2 53.800 54.548 -0.748 1
1 13 . 16 1 1 A 2 2 ASP CB C 2 41.500 42.127 -0.627 1
1 14 . 16 1 1 A 2 2 ASP N N 2 122.100 122.629 -0.529 1
1 15 . 16 1 1 A 3 3 LEU H H 3 8.280 8.389 -0.109 1
1 16 . 16 1 1 A 3 3 LEU HA H 3 4.420 4.887 -0.467 1
1 26 . 16 1 1 A 3 3 LEU C C 3 176.900 176.175 0.725 1
1 27 . 16 1 1 A 3 3 LEU CA C 3 55.000 54.599 0.401 1
1 28 . 16 1 1 A 3 3 LEU CB C 3 42.700 42.923 -0.223 1
1 32 . 16 1 1 A 3 3 LEU N N 3 122.300 123.587 -1.287 1
1 33 . 16 1 1 A 4 4 VAL H H 4 8.640 8.605 0.035 1
1 34 . 16 1 1 A 4 4 VAL HA H 4 4.540 4.982 -0.442 1
1 42 . 16 1 1 A 4 4 VAL C C 4 175.800 174.876 0.924 1
1 43 . 16 1 1 A 4 4 VAL CA C 4 59.400 58.596 0.804 1
1 44 . 16 1 1 A 4 4 VAL CB C 4 35.400 35.852 -0.452 1
1 47 . 16 1 1 A 4 4 VAL N N 4 122.600 119.080 3.520 1
1 48 . 16 1 1 A 5 5 LYS H H 5 8.630 8.624 0.006 1
1 49 . 16 1 1 A 5 5 LYS HA H 5 4.450 4.357 0.093 1
1 58 . 16 1 1 A 5 5 LYS C C 5 179.400 178.453 0.947 1
1 59 . 16 1 1 A 5 5 LYS CA C 5 53.600 56.051 -2.451 1
1 60 . 16 1 1 A 5 5 LYS CB C 5 30.900 33.212 -2.312 1
1 64 . 16 1 1 A 5 5 LYS N N 5 121.100 121.613 -0.513 1
1 65 . 16 1 1 A 6 6 ILE H H 6 10.320 8.863 1.457 1
1 66 . 16 1 1 A 6 6 ILE HA H 6 3.440 3.708 -0.268 1
1 76 . 16 1 1 A 6 6 ILE C C 6 178.300 177.797 0.503 1
1 77 . 16 1 1 A 6 6 ILE CA C 6 65.700 64.998 0.702 1
1 78 . 16 1 1 A 6 6 ILE CB C 6 35.900 37.672 -1.772 1
1 82 . 16 1 1 A 6 6 ILE N N 6 125.400 122.506 2.894 1
1 83 . 16 1 1 A 7 7 ARG H H 7 8.210 8.559 -0.349 1
1 84 . 16 1 1 A 7 7 ARG HA H 7 3.850 4.170 -0.320 1
1 92 . 16 1 1 A 7 7 ARG C C 7 175.600 176.743 -1.143 1
1 93 . 16 1 1 A 7 7 ARG CA C 7 57.800 57.792 0.008 1
1 94 . 16 1 1 A 7 7 ARG CB C 7 30.300 29.030 1.270 1
1 98 . 16 1 1 A 7 7 ARG N N 7 118.800 120.672 -1.872 1
1 100 . 16 1 1 A 8 8 ASP H H 8 7.850 7.740 0.110 1
1 101 . 16 1 1 A 8 8 ASP HA H 8 4.700 4.678 0.022 1
1 104 . 16 1 1 A 8 8 ASP C C 8 176.100 176.482 -0.382 1
1 105 . 16 1 1 A 8 8 ASP CA C 8 54.100 54.597 -0.497 1
1 106 . 16 1 1 A 8 8 ASP CB C 8 41.200 41.350 -0.150 1
1 107 . 16 1 1 A 8 8 ASP N N 8 116.800 118.407 -1.607 1
1 108 . 16 1 1 A 9 9 VAL H H 9 7.240 7.420 -0.180 1
1 109 . 16 1 1 A 9 9 VAL HA H 9 3.710 3.951 -0.241 1
1 117 . 16 1 1 A 9 9 VAL C C 9 174.900 175.894 -0.994 1
1 118 . 16 1 1 A 9 9 VAL CA C 9 64.300 63.358 0.942 1
1 119 . 16 1 1 A 9 9 VAL CB C 9 31.500 31.679 -0.179 1
1 122 . 16 1 1 A 9 9 VAL N N 9 121.800 122.026 -0.226 1
1 123 . 16 1 1 A 10 10 SER H H 10 8.600 8.214 0.386 1
1 124 . 16 1 1 A 10 10 SER HA H 10 4.600 4.875 -0.275 1
1 127 . 16 1 1 A 10 10 SER CA C 10 56.700 57.357 -0.657 1
1 128 . 16 1 1 A 10 10 SER CB C 10 66.100 67.413 -1.313 1
1 129 . 16 1 1 A 10 10 SER N N 10 122.200 121.143 1.057 1
1 130 . 16 1 1 A 11 11 LEU H H 11 8.660 8.972 -0.312 1
1 131 . 16 1 1 A 11 11 LEU HA H 11 3.900 3.951 -0.051 1
1 141 . 16 1 1 A 11 11 LEU C C 11 178.100 179.208 -1.108 1
1 142 . 16 1 1 A 11 11 LEU CA C 11 56.700 58.059 -1.359 1
1 143 . 16 1 1 A 11 11 LEU CB C 11 41.400 41.184 0.216 1
1 147 . 16 1 1 A 11 11 LEU N N 11 120.300 125.650 -5.350 1
1 148 . 16 1 1 A 12 12 SER H H 12 8.160 8.079 0.081 1
1 149 . 16 1 1 A 12 12 SER HA H 12 4.270 4.276 -0.006 1
1 152 . 16 1 1 A 12 12 SER C C 12 174.200 175.005 -0.805 1
1 153 . 16 1 1 A 12 12 SER CA C 12 59.900 61.443 -1.543 1
1 154 . 16 1 1 A 12 12 SER CB C 12 63.100 62.889 0.211 1
1 155 . 16 1 1 A 12 12 SER N N 12 112.100 114.333 -2.233 1
1 156 . 16 1 1 A 13 13 THR H H 13 7.460 7.582 -0.122 1
1 157 . 16 1 1 A 13 13 THR HA H 13 4.760 4.650 0.110 1
1 162 . 16 1 1 A 13 13 THR CA C 13 56.600 58.995 -2.395 1
1 163 . 16 1 1 A 13 13 THR CB C 13 70.100 68.990 1.110 1
1 165 . 16 1 1 A 13 13 THR N N 13 114.700 111.451 3.249 1
1 166 . 16 1 1 A 14 14 PRO HA H 14 4.050 4.399 -0.349 1
1 173 . 16 1 1 A 14 14 PRO C C 14 175.800 175.802 -0.002 1
1 174 . 16 1 1 A 14 14 PRO CA C 14 65.100 64.384 0.716 1
1 175 . 16 1 1 A 14 14 PRO CB C 14 32.100 31.685 0.415 1
1 178 . 16 1 1 A 15 15 TYR H H 15 7.380 7.505 -0.125 1
1 179 . 16 1 1 A 15 15 TYR HA H 15 5.570 5.541 0.029 1
1 186 . 16 1 1 A 15 15 TYR C C 15 176.100 175.020 1.080 1
1 187 . 16 1 1 A 15 15 TYR CA C 15 56.400 56.772 -0.372 1
1 188 . 16 1 1 A 15 15 TYR CB C 15 41.500 40.358 1.142 1
1 193 . 16 1 1 A 15 15 TYR N N 15 113.800 117.766 -3.966 1
1 194 . 16 1 1 A 16 16 VAL H H 16 9.010 8.675 0.335 1
1 195 . 16 1 1 A 16 16 VAL HA H 16 4.920 5.035 -0.115 1
1 203 . 16 1 1 A 16 16 VAL C C 16 174.300 174.001 0.299 1
1 204 . 16 1 1 A 16 16 VAL CA C 16 59.600 59.593 0.007 1
1 205 . 16 1 1 A 16 16 VAL CB C 16 36.800 36.395 0.405 1
1 208 . 16 1 1 A 16 16 VAL N N 16 113.800 118.383 -4.583 1
1 209 . 16 1 1 A 17 17 SER H H 17 7.960 8.682 -0.722 1
1 210 . 16 1 1 A 17 17 SER HA H 17 5.860 5.540 0.320 1
1 213 . 16 1 1 A 17 17 SER C C 17 172.700 173.904 -1.204 1
1 214 . 16 1 1 A 17 17 SER CA C 17 57.300 57.574 -0.274 1
1 215 . 16 1 1 A 17 17 SER CB C 17 64.000 64.936 -0.936 1
1 216 . 16 1 1 A 17 17 SER N N 17 117.100 118.125 -1.025 1
1 217 . 16 1 1 A 18 18 VAL H H 18 8.570 8.706 -0.136 1
1 218 . 16 1 1 A 18 18 VAL HA H 18 4.900 5.128 -0.228 1
1 226 . 16 1 1 A 18 18 VAL C C 18 173.700 173.564 0.136 1
1 227 . 16 1 1 A 18 18 VAL CA C 18 58.800 59.112 -0.312 1
1 228 . 16 1 1 A 18 18 VAL CB C 18 36.700 36.034 0.666 1
1 231 . 16 1 1 A 18 18 VAL N N 18 113.500 119.100 -5.600 1
1 232 . 16 1 1 A 19 19 ILE H H 19 8.490 8.620 -0.130 1
1 233 . 16 1 1 A 19 19 ILE HA H 19 5.300 4.909 0.391 1
1 243 . 16 1 1 A 19 19 ILE C C 19 175.800 174.685 1.115 1
1 244 . 16 1 1 A 19 19 ILE CA C 19 59.700 59.261 0.439 1
1 245 . 16 1 1 A 19 19 ILE CB C 19 41.700 42.788 -1.088 1
1 249 . 16 1 1 A 19 19 ILE N N 19 120.600 122.366 -1.766 1
1 250 . 16 1 1 A 20 20 GLY H H 20 8.670 7.785 0.885 1
1 251 . 16 1 1 A 20 20 GLY HA2 H 20 3.760 4.240 -0.480 1
1 252 . 16 1 1 A 20 20 GLY HA3 H 20 4.190 4.246 -0.056 1
1 253 . 16 1 1 A 20 20 GLY C C 20 169.900 171.451 -1.551 1
1 254 . 16 1 1 A 20 20 GLY CA C 20 46.000 45.949 0.051 1
1 255 . 16 1 1 A 20 20 GLY N N 20 110.200 114.058 -3.858 1
1 256 . 16 1 1 A 21 21 LYS H H 21 8.920 8.378 0.542 1
1 257 . 16 1 1 A 21 21 LYS HA H 21 5.210 5.001 0.209 1
1 266 . 16 1 1 A 21 21 LYS C C 21 176.400 175.589 0.811 1
1 267 . 16 1 1 A 21 21 LYS CA C 21 54.400 54.609 -0.209 1
1 268 . 16 1 1 A 21 21 LYS CB C 21 35.400 35.093 0.307 1
1 272 . 16 1 1 A 21 21 LYS N N 21 119.100 120.985 -1.885 1
1 273 . 16 1 1 A 22 22 ILE H H 22 8.900 8.851 0.049 1
1 274 . 16 1 1 A 22 22 ILE HA H 22 5.050 4.548 0.502 1
1 284 . 16 1 1 A 22 22 ILE C C 22 176.900 175.522 1.378 1
1 285 . 16 1 1 A 22 22 ILE CA C 22 57.800 61.227 -3.427 1
1 286 . 16 1 1 A 22 22 ILE CB C 22 36.200 37.946 -1.746 1
1 290 . 16 1 1 A 22 22 ILE N N 22 130.000 128.115 1.885 1
1 291 . 16 1 1 A 23 23 THR H H 23 9.020 8.466 0.554 1
1 292 . 16 1 1 A 23 23 THR HA H 23 4.660 4.894 -0.234 1
1 297 . 16 1 1 A 23 23 THR C C 23 174.000 173.896 0.104 1
1 298 . 16 1 1 A 23 23 THR CA C 23 60.800 60.067 0.733 1
1 299 . 16 1 1 A 23 23 THR CB C 23 73.400 71.941 1.459 1
1 301 . 16 1 1 A 23 23 THR N N 23 118.200 117.942 0.258 1
1 302 . 16 1 1 A 24 24 GLY H H 24 8.430 8.748 -0.318 1
1 303 . 16 1 1 A 24 24 GLY HA2 H 24 3.910 3.858 0.052 1
1 304 . 16 1 1 A 24 24 GLY HA3 H 24 3.910 3.912 -0.002 1
1 305 . 16 1 1 A 24 24 GLY C C 24 175.400 174.678 0.722 1
1 306 . 16 1 1 A 24 24 GLY CA C 24 47.100 47.060 0.040 1
1 307 . 16 1 1 A 24 24 GLY N N 24 107.200 111.436 -4.236 1
1 308 . 16 1 1 A 25 25 ILE H H 25 9.370 8.307 1.063 1
1 309 . 16 1 1 A 25 25 ILE HA H 25 4.480 4.479 0.001 1
1 319 . 16 1 1 A 25 25 ILE C C 25 178.200 174.712 3.488 1
1 320 . 16 1 1 A 25 25 ILE CA C 25 59.200 60.858 -1.658 1
1 321 . 16 1 1 A 25 25 ILE CB C 25 35.400 39.265 -3.865 1
1 325 . 16 1 1 A 25 25 ILE N N 25 120.600 121.282 -0.682 1
1 326 . 16 1 1 A 26 26 HIS H H 26 9.000 8.914 0.086 1
1 327 . 16 1 1 A 26 26 HIS HA H 26 4.770 5.329 -0.559 1
1 330 . 16 1 1 A 26 26 HIS C C 26 172.700 172.623 0.077 1
1 331 . 16 1 1 A 26 26 HIS CA C 26 55.000 54.452 0.548 1
1 332 . 16 1 1 A 26 26 HIS CB C 26 31.100 33.135 -2.035 1
1 333 . 16 1 1 A 26 26 HIS N N 26 123.800 127.309 -3.509 1
1 334 . 16 1 1 A 27 27 LYS H H 27 8.930 9.019 -0.089 1
1 335 . 16 1 1 A 27 27 LYS HA H 27 4.770 4.511 0.259 1
1 344 . 16 1 1 A 27 27 LYS C C 27 175.300 175.172 0.128 1
1 345 . 16 1 1 A 27 27 LYS CA C 27 55.100 55.283 -0.183 1
1 346 . 16 1 1 A 27 27 LYS CB C 27 34.400 34.243 0.157 1
1 350 . 16 1 1 A 27 27 LYS N N 27 125.900 128.775 -2.875 1
1 351 . 16 1 1 A 28 28 LYS H H 28 8.880 8.865 0.015 1
1 352 . 16 1 1 A 28 28 LYS HA H 28 4.570 5.067 -0.497 1
1 361 . 16 1 1 A 28 28 LYS C C 28 174.500 174.743 -0.243 1
1 362 . 16 1 1 A 28 28 LYS CA C 28 54.600 54.435 0.165 1
1 363 . 16 1 1 A 28 28 LYS CB C 28 35.300 36.454 -1.154 1
1 367 . 16 1 1 A 28 28 LYS N N 28 127.400 125.157 2.243 1
1 368 . 16 1 1 A 29 29 GLU H H 29 8.440 8.373 0.067 1
1 369 . 16 1 1 A 29 29 GLU HA H 29 5.260 5.198 0.062 1
1 374 . 16 1 1 A 29 29 GLU C C 29 175.800 175.547 0.253 1
1 375 . 16 1 1 A 29 29 GLU CA C 29 54.800 54.842 -0.042 1
1 376 . 16 1 1 A 29 29 GLU CB C 29 31.500 32.846 -1.346 1
1 378 . 16 1 1 A 29 29 GLU N N 29 122.200 120.720 1.480 1
1 379 . 16 1 1 A 30 30 TYR H H 30 8.960 8.659 0.301 1
1 380 . 16 1 1 A 30 30 TYR HA H 30 4.820 5.340 -0.520 1
1 387 . 16 1 1 A 30 30 TYR C C 30 172.600 172.650 -0.050 1
1 388 . 16 1 1 A 30 30 TYR CA C 30 56.300 55.589 0.711 1
1 389 . 16 1 1 A 30 30 TYR CB C 30 40.500 41.498 -0.998 1
1 394 . 16 1 1 A 30 30 TYR N N 30 121.100 118.832 2.268 1
1 395 . 16 1 1 A 31 31 GLU H H 31 8.610 8.877 -0.267 1
1 396 . 16 1 1 A 31 31 GLU HA H 31 4.810 4.365 0.445 1
1 401 . 16 1 1 A 31 31 GLU C C 31 176.100 176.133 -0.033 1
1 402 . 16 1 1 A 31 31 GLU CA C 31 55.100 55.250 -0.150 1
1 403 . 16 1 1 A 31 31 GLU CB C 31 30.300 30.048 0.252 1
1 405 . 16 1 1 A 31 31 GLU N N 31 121.800 122.276 -0.476 1
1 406 . 16 1 1 A 32 32 SER H H 32 8.570 8.490 0.080 1
1 407 . 16 1 1 A 32 32 SER HA H 32 4.520 4.857 -0.337 1
1 410 . 16 1 1 A 32 32 SER C C 32 174.300 173.635 0.665 1
1 411 . 16 1 1 A 32 32 SER CA C 32 57.300 57.348 -0.048 1
1 412 . 16 1 1 A 32 32 SER CB C 32 64.100 63.896 0.204 1
1 413 . 16 1 1 A 32 32 SER N N 32 118.500 121.015 -2.515 1
1 414 . 16 1 1 A 33 33 ASP H H 33 9.290 8.612 0.678 1
1 415 . 16 1 1 A 33 33 ASP HA H 33 4.340 4.260 0.080 1
1 418 . 16 1 1 A 33 33 ASP C C 33 175.900 177.127 -1.227 1
1 419 . 16 1 1 A 33 33 ASP CA C 33 55.000 55.917 -0.917 1
1 420 . 16 1 1 A 33 33 ASP CB C 33 39.300 39.810 -0.510 1
1 421 . 16 1 1 A 33 33 ASP N N 33 125.700 119.655 6.045 1
1 422 . 16 1 1 A 34 34 GLY H H 34 8.690 8.930 -0.240 1
1 423 . 16 1 1 A 34 34 GLY HA2 H 34 3.660 3.854 -0.194 1
1 424 . 16 1 1 A 34 34 GLY HA3 H 34 4.140 3.856 0.284 1
1 425 . 16 1 1 A 34 34 GLY C C 34 174.200 173.519 0.681 1
1 426 . 16 1 1 A 34 34 GLY CA C 34 45.600 45.977 -0.377 1
1 427 . 16 1 1 A 34 34 GLY N N 34 104.800 108.782 -3.982 1
1 428 . 16 1 1 A 35 35 THR H H 35 7.840 7.665 0.175 1
1 429 . 16 1 1 A 35 35 THR HA H 35 4.660 4.708 -0.048 1
1 434 . 16 1 1 A 35 35 THR C C 35 173.000 173.285 -0.285 1
1 435 . 16 1 1 A 35 35 THR CA C 35 60.200 61.120 -0.920 1
1 436 . 16 1 1 A 35 35 THR CB C 35 71.200 72.186 -0.986 1
1 438 . 16 1 1 A 35 35 THR N N 35 114.800 115.252 -0.452 1
1 439 . 16 1 1 A 36 36 THR H H 36 8.480 8.663 -0.183 1
1 440 . 16 1 1 A 36 36 THR HA H 36 4.620 4.446 0.174 1
1 445 . 16 1 1 A 36 36 THR C C 36 173.800 174.267 -0.467 1
1 446 . 16 1 1 A 36 36 THR CA C 36 62.300 62.711 -0.411 1
1 447 . 16 1 1 A 36 36 THR CB C 36 69.500 69.216 0.284 1
1 449 . 16 1 1 A 36 36 THR N N 36 119.400 121.404 -2.004 1
1 450 . 16 1 1 A 37 37 LYS H H 37 8.880 8.326 0.554 1
1 451 . 16 1 1 A 37 37 LYS HA H 37 4.570 4.913 -0.343 1
1 460 . 16 1 1 A 37 37 LYS C C 37 174.500 175.906 -1.406 1
1 461 . 16 1 1 A 37 37 LYS CA C 37 54.600 54.034 0.566 1
1 462 . 16 1 1 A 37 37 LYS CB C 37 35.500 35.932 -0.432 1
1 466 . 16 1 1 A 37 37 LYS N N 37 128.000 125.805 2.195 1
1 467 . 16 1 1 A 38 38 SER H H 38 8.370 8.754 -0.384 1
1 468 . 16 1 1 A 38 38 SER HA H 38 5.250 5.178 0.072 1
1 471 . 16 1 1 A 38 38 SER C C 38 173.200 173.702 -0.502 1
1 472 . 16 1 1 A 38 38 SER CA C 38 57.900 57.114 0.786 1
1 473 . 16 1 1 A 38 38 SER CB C 38 65.500 64.761 0.739 1
1 474 . 16 1 1 A 38 38 SER N N 38 114.300 116.732 -2.432 1
1 475 . 16 1 1 A 39 39 VAL H H 39 9.020 8.975 0.045 1
1 476 . 16 1 1 A 39 39 VAL HA H 39 4.900 4.876 0.024 1
1 484 . 16 1 1 A 39 39 VAL C C 39 173.200 172.807 0.393 1
1 485 . 16 1 1 A 39 39 VAL CA C 39 59.200 59.565 -0.365 1
1 486 . 16 1 1 A 39 39 VAL CB C 39 34.600 35.173 -0.573 1
1 489 . 16 1 1 A 39 39 VAL N N 39 123.600 120.722 2.878 1
1 490 . 16 1 1 A 40 40 TYR H H 40 8.900 8.961 -0.061 1
1 491 . 16 1 1 A 40 40 TYR HA H 40 4.730 5.312 -0.582 1
1 498 . 16 1 1 A 40 40 TYR CA C 40 56.500 56.813 -0.313 1
1 499 . 16 1 1 A 40 40 TYR CB C 40 39.000 40.403 -1.403 1
1 504 . 16 1 1 A 40 40 TYR N N 40 126.300 127.452 -1.152 1
1 505 . 16 1 1 A 41 41 GLN H H 41 8.630 8.657 -0.027 1
1 506 . 16 1 1 A 41 41 GLN HA H 41 5.330 5.299 0.031 1
1 513 . 16 1 1 A 41 41 GLN C C 41 175.500 175.678 -0.178 1
1 514 . 16 1 1 A 41 41 GLN CA C 41 53.800 54.129 -0.329 1
1 515 . 16 1 1 A 41 41 GLN CB C 41 32.100 32.142 -0.042 1
1 518 . 16 1 1 A 41 41 GLN N N 41 122.000 121.562 0.438 1
1 520 . 16 1 1 A 42 42 GLY H H 42 8.560 7.833 0.727 1
1 521 . 16 1 1 A 42 42 GLY HA2 H 42 3.680 4.235 -0.555 1
1 522 . 16 1 1 A 42 42 GLY HA3 H 42 4.020 4.249 -0.229 1
1 523 . 16 1 1 A 42 42 GLY C C 42 171.600 171.043 0.557 1
1 524 . 16 1 1 A 42 42 GLY CA C 42 47.300 46.090 1.210 1
1 525 . 16 1 1 A 42 42 GLY N N 42 113.000 108.659 4.341 1
1 526 . 16 1 1 A 43 43 TYR H H 43 9.320 8.410 0.910 1
1 527 . 16 1 1 A 43 43 TYR HA H 43 5.280 5.380 -0.100 1
1 534 . 16 1 1 A 43 43 TYR C C 43 173.200 174.023 -0.823 1
1 535 . 16 1 1 A 43 43 TYR CA C 43 57.600 56.399 1.201 1
1 536 . 16 1 1 A 43 43 TYR CB C 43 42.400 42.181 0.219 1
1 541 . 16 1 1 A 43 43 TYR N N 43 126.300 118.623 7.677 1
1 542 . 16 1 1 A 44 44 ILE H H 44 9.160 8.809 0.351 1
1 543 . 16 1 1 A 44 44 ILE HA H 44 5.270 5.372 -0.102 1
1 553 . 16 1 1 A 44 44 ILE C C 44 172.900 173.703 -0.803 1
1 554 . 16 1 1 A 44 44 ILE CA C 44 59.000 59.515 -0.515 1
1 555 . 16 1 1 A 44 44 ILE CB C 44 42.200 41.603 0.597 1
1 559 . 16 1 1 A 44 44 ILE N N 44 117.700 123.631 -5.931 1
1 560 . 16 1 1 A 45 45 GLU H H 45 8.420 8.710 -0.290 1
1 561 . 16 1 1 A 45 45 GLU HA H 45 5.600 5.310 0.290 1
1 566 . 16 1 1 A 45 45 GLU C C 45 174.300 174.527 -0.227 1
1 567 . 16 1 1 A 45 45 GLU CA C 45 54.000 54.608 -0.608 1
1 568 . 16 1 1 A 45 45 GLU CB C 45 34.400 33.718 0.682 1
1 570 . 16 1 1 A 45 45 GLU N N 45 123.600 128.324 -4.724 1
1 571 . 16 1 1 A 46 46 ASP H H 46 8.530 8.442 0.088 1
1 572 . 16 1 1 A 46 46 ASP HA H 46 5.070 4.982 0.088 1
1 575 . 16 1 1 A 46 46 ASP C C 46 175.000 174.875 0.125 1
1 576 . 16 1 1 A 46 46 ASP CA C 46 51.800 52.746 -0.946 1
1 577 . 16 1 1 A 46 46 ASP CB C 46 41.300 44.165 -2.865 1
1 578 . 16 1 1 A 46 46 ASP N N 46 125.500 124.750 0.750 1
1 579 . 16 1 1 A 47 47 ASP H H 47 9.160 8.864 0.296 1
1 580 . 16 1 1 A 47 47 ASP HA H 47 4.430 4.457 -0.027 1
1 583 . 16 1 1 A 47 47 ASP C C 47 176.000 177.097 -1.097 1
1 584 . 16 1 1 A 47 47 ASP CA C 47 55.000 56.120 -1.120 1
1 585 . 16 1 1 A 47 47 ASP CB C 47 38.900 40.598 -1.698 1
1 586 . 16 1 1 A 47 47 ASP N N 47 114.200 121.482 -7.282 1
1 587 . 16 1 1 A 48 48 THR H H 48 9.470 7.716 1.754 1
1 588 . 16 1 1 A 48 48 THR HA H 48 4.520 4.241 0.279 1
1 593 . 16 1 1 A 48 48 THR C C 48 174.500 174.747 -0.247 1
1 594 . 16 1 1 A 48 48 THR CA C 48 62.600 64.579 -1.979 1
1 595 . 16 1 1 A 48 48 THR CB C 48 70.400 69.553 0.847 1
1 597 . 16 1 1 A 48 48 THR N N 48 111.800 112.007 -0.207 1
1 598 . 16 1 1 A 49 49 ALA H H 49 7.850 7.499 0.351 1
1 599 . 16 1 1 A 49 49 ALA HA H 49 4.440 4.442 -0.002 1
1 603 . 16 1 1 A 49 49 ALA C C 49 173.200 175.318 -2.118 1
1 604 . 16 1 1 A 49 49 ALA CA C 49 52.700 51.292 1.408 1
1 605 . 16 1 1 A 49 49 ALA CB C 49 21.300 20.935 0.365 1
1 606 . 16 1 1 A 49 49 ALA N N 49 123.400 117.909 5.491 1
1 607 . 16 1 1 A 50 50 ARG H H 50 8.160 8.780 -0.620 1
1 608 . 16 1 1 A 50 50 ARG HA H 50 5.350 5.516 -0.166 1
1 616 . 16 1 1 A 50 50 ARG C C 50 174.700 174.359 0.341 1
1 617 . 16 1 1 A 50 50 ARG CA C 50 54.000 54.297 -0.297 1
1 618 . 16 1 1 A 50 50 ARG CB C 50 34.500 34.642 -0.142 1
1 622 . 16 1 1 A 50 50 ARG N N 50 117.400 115.814 1.586 1
1 624 . 16 1 1 A 51 51 ILE H H 51 9.390 8.636 0.754 1
1 625 . 16 1 1 A 51 51 ILE HA H 51 4.790 4.960 -0.170 1
1 635 . 16 1 1 A 51 51 ILE C C 51 172.600 173.113 -0.513 1
1 636 . 16 1 1 A 51 51 ILE CA C 51 60.000 59.032 0.968 1
1 637 . 16 1 1 A 51 51 ILE CB C 51 42.800 41.825 0.975 1
1 641 . 16 1 1 A 51 51 ILE N N 51 124.600 121.027 3.573 1
1 642 . 16 1 1 A 52 52 ARG H H 52 7.980 8.581 -0.601 1
1 643 . 16 1 1 A 52 52 ARG HA H 52 4.170 4.245 -0.075 1
1 651 . 16 1 1 A 52 52 ARG C C 52 174.600 175.859 -1.259 1
1 652 . 16 1 1 A 52 52 ARG CA C 52 57.100 56.242 0.858 1
1 653 . 16 1 1 A 52 52 ARG CB C 52 31.300 31.114 0.186 1
1 657 . 16 1 1 A 52 52 ARG N N 52 125.900 127.920 -2.020 1
1 659 . 16 1 1 A 53 53 ILE H H 53 8.290 8.740 -0.450 1
1 660 . 16 1 1 A 53 53 ILE HA H 53 5.160 5.243 -0.083 1
1 670 . 16 1 1 A 53 53 ILE C C 53 172.400 174.166 -1.766 1
1 671 . 16 1 1 A 53 53 ILE CA C 53 58.600 59.205 -0.605 1
1 672 . 16 1 1 A 53 53 ILE CB C 53 41.900 42.382 -0.482 1
1 676 . 16 1 1 A 53 53 ILE N N 53 118.500 121.061 -2.561 1
1 677 . 16 1 1 A 54 54 SER H H 54 8.350 8.981 -0.631 1
1 678 . 16 1 1 A 54 54 SER HA H 54 5.070 5.201 -0.131 1
1 681 . 16 1 1 A 54 54 SER C C 54 172.400 172.524 -0.124 1
1 682 . 16 1 1 A 54 54 SER CA C 54 57.000 56.682 0.318 1
1 683 . 16 1 1 A 54 54 SER CB C 54 65.900 65.116 0.784 1
1 684 . 16 1 1 A 54 54 SER N N 54 120.700 118.411 2.289 1
1 685 . 16 1 1 A 55 55 SER H H 55 9.130 9.077 0.053 1
1 686 . 16 1 1 A 55 55 SER HA H 55 5.270 5.193 0.077 1
1 690 . 16 1 1 A 55 55 SER C C 55 174.400 172.544 1.856 1
1 691 . 16 1 1 A 55 55 SER CA C 55 55.500 56.391 -0.891 1
1 692 . 16 1 1 A 55 55 SER CB C 55 64.500 65.167 -0.667 1
1 693 . 16 1 1 A 55 55 SER N N 55 117.200 120.750 -3.550 1
1 694 . 16 1 1 A 56 56 PHE H H 56 8.970 8.812 0.158 1
1 695 . 16 1 1 A 56 56 PHE HA H 56 4.600 5.048 -0.448 1
1 703 . 16 1 1 A 56 56 PHE C C 56 176.500 176.911 -0.411 1
1 704 . 16 1 1 A 56 56 PHE CA C 56 58.300 57.067 1.233 1
1 705 . 16 1 1 A 56 56 PHE CB C 56 37.900 41.354 -3.454 1
1 711 . 16 1 1 A 56 56 PHE N N 56 129.400 125.218 4.182 1
1 712 . 16 1 1 A 57 57 GLY H H 57 8.570 8.751 -0.181 1
1 713 . 16 1 1 A 57 57 GLY HA2 H 57 4.020 4.150 -0.130 1
1 714 . 16 1 1 A 57 57 GLY HA3 H 57 4.380 4.169 0.211 1
1 715 . 16 1 1 A 57 57 GLY C C 57 173.700 174.316 -0.616 1
1 716 . 16 1 1 A 57 57 GLY CA C 57 46.300 45.706 0.594 1
1 717 . 16 1 1 A 57 57 GLY N N 57 112.500 112.325 0.175 1
1 718 . 16 1 1 A 58 58 LYS H H 58 6.800 8.191 -1.391 1
1 719 . 16 1 1 A 58 58 LYS HA H 58 4.410 4.323 0.087 1
1 728 . 16 1 1 A 58 58 LYS C C 58 174.800 175.988 -1.188 1
1 729 . 16 1 1 A 58 58 LYS CA C 58 55.200 56.635 -1.435 1
1 730 . 16 1 1 A 58 58 LYS CB C 58 33.300 33.411 -0.111 1
1 734 . 16 1 1 A 58 58 LYS N N 58 118.700 121.295 -2.595 1
1 735 . 16 1 1 A 59 59 GLN H H 59 8.390 8.688 -0.298 1
1 736 . 16 1 1 A 59 59 GLN HA H 59 1.830 4.013 -2.183 1
1 743 . 16 1 1 A 59 59 GLN C C 59 174.100 174.622 -0.522 1
1 744 . 16 1 1 A 59 59 GLN CA C 59 57.100 55.312 1.788 1
1 745 . 16 1 1 A 59 59 GLN CB C 59 28.900 29.617 -0.717 1
1 748 . 16 1 1 A 59 59 GLN N N 59 124.000 123.516 0.484 1
1 750 . 16 1 1 A 60 60 LEU H H 60 5.320 8.098 -2.778 1
1 751 . 16 1 1 A 60 60 LEU HA H 60 4.370 4.913 -0.543 1
1 761 . 16 1 1 A 60 60 LEU CA C 60 52.800 53.496 -0.696 1
1 762 . 16 1 1 A 60 60 LEU CB C 60 46.700 45.919 0.781 1
1 766 . 16 1 1 A 60 60 LEU N N 60 121.800 124.417 -2.617 1
1 767 . 16 1 1 A 61 61 GLN H H 61 8.660 8.777 -0.117 1
1 768 . 16 1 1 A 61 61 GLN HA H 61 4.440 4.880 -0.440 1
1 775 . 16 1 1 A 61 61 GLN C C 61 174.000 175.135 -1.135 1
1 776 . 16 1 1 A 61 61 GLN CA C 61 53.800 54.275 -0.475 1
1 777 . 16 1 1 A 61 61 GLN CB C 61 31.800 31.951 -0.151 1
1 780 . 16 1 1 A 61 61 GLN N N 61 120.300 120.183 0.117 1
1 782 . 16 1 1 A 62 62 ASP H H 62 8.450 8.661 -0.211 1
1 783 . 16 1 1 A 62 62 ASP HA H 62 4.130 4.474 -0.344 1
1 786 . 16 1 1 A 62 62 ASP C C 62 177.200 176.137 1.063 1
1 787 . 16 1 1 A 62 62 ASP CA C 62 55.700 54.364 1.336 1
1 788 . 16 1 1 A 62 62 ASP CB C 62 39.400 41.120 -1.720 1
1 789 . 16 1 1 A 62 62 ASP N N 62 122.400 122.808 -0.408 1
1 790 . 16 1 1 A 63 63 SER H H 63 9.210 9.031 0.179 1
1 791 . 16 1 1 A 63 63 SER HA H 63 3.850 4.387 -0.537 1
1 794 . 16 1 1 A 63 63 SER C C 63 173.200 173.369 -0.169 1
1 795 . 16 1 1 A 63 63 SER CA C 63 61.700 58.939 2.761 1
1 796 . 16 1 1 A 63 63 SER CB C 63 61.800 60.750 1.050 1
1 797 . 16 1 1 A 63 63 SER N N 63 114.300 117.138 -2.838 1
1 798 . 16 1 1 A 64 64 ASP H H 64 7.960 7.637 0.323 1
1 799 . 16 1 1 A 64 64 ASP HA H 64 4.540 4.831 -0.291 1
1 802 . 16 1 1 A 64 64 ASP C C 64 174.900 174.259 0.641 1
1 803 . 16 1 1 A 64 64 ASP CA C 64 54.900 53.757 1.143 1
1 804 . 16 1 1 A 64 64 ASP CB C 64 40.900 43.975 -3.075 1
1 805 . 16 1 1 A 64 64 ASP N N 64 122.600 124.263 -1.663 1
1 806 . 16 1 1 A 65 65 VAL H H 65 8.180 8.773 -0.593 1
1 807 . 16 1 1 A 65 65 VAL HA H 65 4.670 4.515 0.155 1
1 815 . 16 1 1 A 65 65 VAL C C 65 175.900 175.708 0.192 1
1 816 . 16 1 1 A 65 65 VAL CA C 65 62.300 62.560 -0.260 1
1 817 . 16 1 1 A 65 65 VAL CB C 65 31.700 30.984 0.716 1
1 820 . 16 1 1 A 65 65 VAL N N 65 123.100 126.515 -3.415 1
1 821 . 16 1 1 A 66 66 VAL H H 66 8.770 8.683 0.087 1
1 822 . 16 1 1 A 66 66 VAL HA H 66 5.160 5.143 0.017 1
1 830 . 16 1 1 A 66 66 VAL C C 66 173.600 173.280 0.320 1
1 831 . 16 1 1 A 66 66 VAL CA C 66 58.100 58.775 -0.675 1
1 832 . 16 1 1 A 66 66 VAL CB C 66 35.700 36.194 -0.494 1
1 835 . 16 1 1 A 66 66 VAL N N 66 118.100 120.782 -2.682 1
1 836 . 16 1 1 A 67 67 ARG H H 67 8.880 8.905 -0.025 1
1 837 . 16 1 1 A 67 67 ARG HA H 67 5.110 5.228 -0.118 1
1 845 . 16 1 1 A 67 67 ARG C C 67 175.300 174.458 0.842 1
1 846 . 16 1 1 A 67 67 ARG CA C 67 54.200 54.371 -0.171 1
1 847 . 16 1 1 A 67 67 ARG CB C 67 32.200 33.653 -1.453 1
1 851 . 16 1 1 A 67 67 ARG N N 67 120.200 121.572 -1.372 1
1 853 . 16 1 1 A 68 68 ILE H H 68 9.220 8.947 0.273 1
1 854 . 16 1 1 A 68 68 ILE HA H 68 4.990 4.664 0.326 1
1 864 . 16 1 1 A 68 68 ILE C C 68 174.900 174.143 0.757 1
1 865 . 16 1 1 A 68 68 ILE CA C 68 58.600 59.386 -0.786 1
1 866 . 16 1 1 A 68 68 ILE CB C 68 39.300 38.766 0.534 1
1 870 . 16 1 1 A 68 68 ILE N N 68 127.200 128.425 -1.225 1
1 871 . 16 1 1 A 69 69 ASP H H 69 9.110 8.959 0.151 1
1 872 . 16 1 1 A 69 69 ASP HA H 69 5.370 5.083 0.287 1
1 875 . 16 1 1 A 69 69 ASP C C 69 175.800 175.871 -0.071 1
1 876 . 16 1 1 A 69 69 ASP CA C 69 52.400 53.243 -0.843 1
1 877 . 16 1 1 A 69 69 ASP CB C 69 43.700 42.903 0.797 1
1 878 . 16 1 1 A 69 69 ASP N N 69 123.400 127.420 -4.020 1
1 879 . 16 1 1 A 70 70 ASN H H 70 8.300 8.688 -0.388 1
1 880 . 16 1 1 A 70 70 ASN HA H 70 4.160 4.399 -0.239 1
1 885 . 16 1 1 A 70 70 ASN C C 70 176.300 174.641 1.659 1
1 886 . 16 1 1 A 70 70 ASN CA C 70 54.300 54.158 0.142 1
1 887 . 16 1 1 A 70 70 ASN CB C 70 37.500 37.630 -0.130 1
1 889 . 16 1 1 A 70 70 ASN N N 70 119.800 122.955 -3.155 1
1 891 . 16 1 1 A 71 71 ALA H H 71 9.100 7.801 1.299 1
1 892 . 16 1 1 A 71 71 ALA HA H 71 4.500 4.460 0.040 1
1 896 . 16 1 1 A 71 71 ALA C C 71 175.700 176.408 -0.708 1
1 897 . 16 1 1 A 71 71 ALA CA C 71 51.900 52.968 -1.068 1
1 898 . 16 1 1 A 71 71 ALA CB C 71 19.600 19.922 -0.322 1
1 899 . 16 1 1 A 71 71 ALA N N 71 123.000 121.061 1.939 1
1 900 . 16 1 1 A 72 72 ARG H H 72 8.490 8.312 0.178 1
1 901 . 16 1 1 A 72 72 ARG HA H 72 4.720 4.931 -0.211 1
1 909 . 16 1 1 A 72 72 ARG C C 72 175.800 174.708 1.092 1
1 910 . 16 1 1 A 72 72 ARG CA C 72 54.400 54.876 -0.476 1
1 911 . 16 1 1 A 72 72 ARG CB C 72 32.700 32.354 0.346 1
1 915 . 16 1 1 A 72 72 ARG N N 72 122.500 122.639 -0.139 1
1 917 . 16 1 1 A 73 73 VAL H H 73 8.310 8.294 0.016 1
1 918 . 16 1 1 A 73 73 VAL HA H 73 4.250 4.606 -0.356 1
1 926 . 16 1 1 A 73 73 VAL C C 73 174.600 175.069 -0.469 1
1 927 . 16 1 1 A 73 73 VAL CA C 73 62.800 61.555 1.245 1
1 928 . 16 1 1 A 73 73 VAL CB C 73 32.100 32.452 -0.352 1
1 931 . 16 1 1 A 73 73 VAL N N 73 127.100 126.765 0.335 1
1 932 . 16 1 1 A 74 74 ALA H H 74 8.880 8.884 -0.004 1
1 933 . 16 1 1 A 74 74 ALA HA H 74 4.500 4.987 -0.487 1
1 937 . 16 1 1 A 74 74 ALA C C 74 174.800 174.738 0.062 1
1 938 . 16 1 1 A 74 74 ALA CA C 74 50.500 50.550 -0.050 1
1 939 . 16 1 1 A 74 74 ALA CB C 74 22.500 23.888 -1.388 1
1 940 . 16 1 1 A 74 74 ALA N N 74 131.000 128.340 2.660 1
1 941 . 16 1 1 A 75 75 GLN H H 75 8.280 8.406 -0.126 1
1 942 . 16 1 1 A 75 75 GLN HA H 75 4.910 4.984 -0.074 1
1 949 . 16 1 1 A 75 75 GLN C C 75 175.100 174.092 1.008 1
1 950 . 16 1 1 A 75 75 GLN CA C 75 54.600 54.021 0.579 1
1 951 . 16 1 1 A 75 75 GLN CB C 75 31.400 31.582 -0.182 1
1 954 . 16 1 1 A 75 75 GLN N N 75 118.800 120.517 -1.717 1
1 956 . 16 1 1 A 76 76 PHE H H 76 8.710 9.206 -0.496 1
1 957 . 16 1 1 A 76 76 PHE HA H 76 4.660 4.903 -0.243 1
1 965 . 16 1 1 A 76 76 PHE C C 76 174.900 175.474 -0.574 1
1 966 . 16 1 1 A 76 76 PHE CA C 76 57.000 56.669 0.331 1
1 967 . 16 1 1 A 76 76 PHE CB C 76 41.000 42.113 -1.113 1
1 973 . 16 1 1 A 76 76 PHE N N 76 125.000 125.279 -0.279 1
1 974 . 16 1 1 A 77 77 ASN H H 77 9.040 9.484 -0.444 1
1 975 . 16 1 1 A 77 77 ASN HA H 77 4.170 4.504 -0.334 1
1 980 . 16 1 1 A 77 77 ASN C C 77 174.200 175.653 -1.453 1
1 981 . 16 1 1 A 77 77 ASN CA C 77 53.800 54.526 -0.726 1
1 982 . 16 1 1 A 77 77 ASN CB C 77 37.400 37.539 -0.139 1
1 984 . 16 1 1 A 77 77 ASN N N 77 123.200 123.592 -0.392 1
1 986 . 16 1 1 A 78 78 GLY H H 78 8.370 8.605 -0.235 1
1 987 . 16 1 1 A 78 78 GLY HA2 H 78 3.410 3.586 -0.176 1
1 988 . 16 1 1 A 78 78 GLY HA3 H 78 3.980 3.698 0.282 1
1 989 . 16 1 1 A 78 78 GLY C C 78 173.800 173.107 0.693 1
1 990 . 16 1 1 A 78 78 GLY CA C 78 45.000 45.258 -0.258 1
1 991 . 16 1 1 A 78 78 GLY N N 78 103.300 104.709 -1.409 1
1 992 . 16 1 1 A 79 79 TYR H H 79 7.670 8.167 -0.497 1
1 993 . 16 1 1 A 79 79 TYR HA H 79 4.860 4.859 0.001 1
1 1000 . 16 1 1 A 79 79 TYR C C 79 174.800 175.700 -0.900 1
1 1001 . 16 1 1 A 79 79 TYR CA C 79 56.300 57.392 -1.092 1
1 1002 . 16 1 1 A 79 79 TYR CB C 79 40.800 40.731 0.069 1
1 1007 . 16 1 1 A 79 79 TYR N N 79 118.700 119.197 -0.497 1
1 1008 . 16 1 1 A 80 80 LEU H H 80 8.760 8.683 0.077 1
1 1009 . 16 1 1 A 80 80 LEU HA H 80 4.830 4.438 0.392 1
1 1019 . 16 1 1 A 80 80 LEU C C 80 176.200 176.267 -0.067 1
1 1020 . 16 1 1 A 80 80 LEU CA C 80 54.700 55.007 -0.307 1
1 1021 . 16 1 1 A 80 80 LEU CB C 80 43.500 42.599 0.901 1
1 1025 . 16 1 1 A 80 80 LEU N N 80 122.600 125.386 -2.786 1
1 1026 . 16 1 1 A 81 81 SER H H 81 8.650 8.936 -0.286 1
1 1027 . 16 1 1 A 81 81 SER HA H 81 4.860 5.296 -0.436 1
1 1030 . 16 1 1 A 81 81 SER C C 81 172.600 172.374 0.226 1
1 1031 . 16 1 1 A 81 81 SER CA C 81 56.600 57.295 -0.695 1
1 1032 . 16 1 1 A 81 81 SER CB C 81 66.300 66.569 -0.269 1
1 1033 . 16 1 1 A 81 81 SER N N 81 114.700 117.074 -2.374 1
1 1034 . 16 1 1 A 82 82 LEU H H 82 8.680 8.724 -0.044 1
1 1035 . 16 1 1 A 82 82 LEU HA H 82 5.190 5.248 -0.058 1
1 1045 . 16 1 1 A 82 82 LEU C C 82 177.100 175.104 1.996 1
1 1046 . 16 1 1 A 82 82 LEU CA C 82 53.300 53.775 -0.475 1
1 1047 . 16 1 1 A 82 82 LEU CB C 82 43.800 43.679 0.121 1
1 1051 . 16 1 1 A 82 82 LEU N N 82 119.800 122.288 -2.488 1
1 1052 . 16 1 1 A 83 83 SER H H 83 9.560 9.461 0.099 1
1 1053 . 16 1 1 A 83 83 SER HA H 83 5.390 5.424 -0.034 1
1 1056 . 16 1 1 A 83 83 SER C C 83 174.200 173.099 1.101 1
1 1057 . 16 1 1 A 83 83 SER CA C 83 57.100 56.857 0.243 1
1 1058 . 16 1 1 A 83 83 SER CB C 83 64.400 64.777 -0.377 1
1 1059 . 16 1 1 A 83 83 SER N N 83 119.000 120.354 -1.354 1
1 1060 . 16 1 1 A 84 84 VAL H H 84 9.150 9.380 -0.230 1
1 1061 . 16 1 1 A 84 84 VAL HA H 84 4.490 4.699 -0.209 1
1 1069 . 16 1 1 A 84 84 VAL C C 84 174.700 175.969 -1.269 1
1 1070 . 16 1 1 A 84 84 VAL CA C 84 61.300 61.171 0.129 1
1 1071 . 16 1 1 A 84 84 VAL CB C 84 33.000 32.209 0.791 1
1 1074 . 16 1 1 A 84 84 VAL N N 84 128.300 127.010 1.290 1
1 1075 . 16 1 1 A 85 85 GLY H H 85 7.970 8.807 -0.837 1
1 1076 . 16 1 1 A 85 85 GLY HA2 H 85 4.030 4.272 -0.242 1
1 1077 . 16 1 1 A 85 85 GLY HA3 H 85 4.840 4.331 0.509 1
1 1078 . 16 1 1 A 85 85 GLY C C 85 175.800 175.037 0.763 1
1 1079 . 16 1 1 A 85 85 GLY CA C 85 44.800 44.264 0.536 1
1 1080 . 16 1 1 A 85 85 GLY N N 85 114.300 115.311 -1.011 1
1 1081 . 16 1 1 A 86 86 ASP H H 86 8.860 8.719 0.141 1
1 1082 . 16 1 1 A 86 86 ASP HA H 86 4.370 4.396 -0.026 1
1 1085 . 16 1 1 A 86 86 ASP C C 86 177.400 177.410 -0.010 1
1 1086 . 16 1 1 A 86 86 ASP CA C 86 57.400 56.134 1.266 1
1 1087 . 16 1 1 A 86 86 ASP CB C 86 40.600 40.388 0.212 1
1 1088 . 16 1 1 A 86 86 ASP N N 86 122.500 119.593 2.907 1
1 1089 . 16 1 1 A 87 87 SER H H 87 8.540 7.840 0.700 1
1 1090 . 16 1 1 A 87 87 SER HA H 87 4.620 4.481 0.139 1
1 1093 . 16 1 1 A 87 87 SER C C 87 174.700 174.713 -0.013 1
1 1094 . 16 1 1 A 87 87 SER CA C 87 58.200 59.163 -0.963 1
1 1095 . 16 1 1 A 87 87 SER CB C 87 63.300 64.022 -0.722 1
1 1096 . 16 1 1 A 87 87 SER N N 87 112.100 113.386 -1.286 1
1 1097 . 16 1 1 A 88 88 SER H H 88 7.880 7.650 0.230 1
1 1098 . 16 1 1 A 88 88 SER HA H 88 5.050 4.706 0.344 1
1 1101 . 16 1 1 A 88 88 SER C C 88 172.700 173.241 -0.541 1
1 1102 . 16 1 1 A 88 88 SER CA C 88 57.600 58.365 -0.765 1
1 1103 . 16 1 1 A 88 88 SER CB C 88 64.300 65.073 -0.773 1
1 1104 . 16 1 1 A 88 88 SER N N 88 119.200 117.757 1.443 1
1 1105 . 16 1 1 A 89 89 ARG H H 89 8.350 8.331 0.019 1
1 1106 . 16 1 1 A 89 89 ARG HA H 89 4.720 5.246 -0.526 1
1 1114 . 16 1 1 A 89 89 ARG C C 89 174.200 174.761 -0.561 1
1 1115 . 16 1 1 A 89 89 ARG CA C 89 55.000 54.363 0.637 1
1 1116 . 16 1 1 A 89 89 ARG CB C 89 33.500 33.921 -0.421 1
1 1120 . 16 1 1 A 89 89 ARG N N 89 122.800 120.874 1.926 1
1 1122 . 16 1 1 A 90 90 ILE H H 90 8.530 8.905 -0.375 1
1 1123 . 16 1 1 A 90 90 ILE HA H 90 4.790 4.958 -0.168 1
1 1133 . 16 1 1 A 90 90 ILE C C 90 175.400 175.253 0.147 1
1 1134 . 16 1 1 A 90 90 ILE CA C 90 60.600 60.181 0.419 1
1 1135 . 16 1 1 A 90 90 ILE CB C 90 40.600 40.422 0.178 1
1 1139 . 16 1 1 A 90 90 ILE N N 90 123.100 123.326 -0.226 1
1 1140 . 16 1 1 A 91 91 GLU H H 91 9.000 8.932 0.068 1
1 1141 . 16 1 1 A 91 91 GLU HA H 91 4.730 4.978 -0.248 1
1 1146 . 16 1 1 A 91 91 GLU C C 91 175.100 176.601 -1.501 1
1 1147 . 16 1 1 A 91 91 GLU CA C 91 54.300 54.504 -0.204 1
1 1148 . 16 1 1 A 91 91 GLU CB C 91 32.400 32.234 0.166 1
1 1150 . 16 1 1 A 91 91 GLU N N 91 126.400 126.928 -0.528 1
1 1151 . 16 1 1 A 92 92 SER H H 92 8.830 8.881 -0.051 1
1 1152 . 16 1 1 A 92 92 SER HA H 92 4.700 4.909 -0.209 1
1 1155 . 16 1 1 A 92 92 SER C C 92 174.600 174.248 0.352 1
1 1156 . 16 1 1 A 92 92 SER CA C 92 59.300 57.844 1.456 1
1 1157 . 16 1 1 A 92 92 SER CB C 92 63.100 64.451 -1.351 1
1 1158 . 16 1 1 A 92 92 SER N N 92 119.800 119.825 -0.025 1
1 1159 . 16 1 1 A 93 93 VAL H H 93 8.350 8.228 0.122 1
1 1160 . 16 1 1 A 93 93 VAL HA H 93 4.290 4.563 -0.273 1
1 1168 . 16 1 1 A 93 93 VAL C C 93 175.100 174.736 0.364 1
1 1169 . 16 1 1 A 93 93 VAL CA C 93 61.300 60.986 0.314 1
1 1170 . 16 1 1 A 93 93 VAL CB C 93 33.900 34.514 -0.614 1
1 1173 . 16 1 1 A 93 93 VAL N N 93 121.800 122.400 -0.600 1
1 1174 . 16 1 1 A 94 94 ASN H H 94 8.510 8.972 -0.462 1
1 1175 . 16 1 1 A 94 94 ASN HA H 94 4.770 4.935 -0.165 1
1 1180 . 16 1 1 A 94 94 ASN C C 94 175.000 175.254 -0.254 1
1 1181 . 16 1 1 A 94 94 ASN CA C 94 52.700 53.116 -0.416 1
1 1182 . 16 1 1 A 94 94 ASN CB C 94 38.500 38.846 -0.346 1
1 1184 . 16 1 1 A 94 94 ASN N N 94 121.800 125.889 -4.089 1
1 1186 . 16 1 1 A 95 95 VAL H H 95 7.860 8.614 -0.754 1
1 1187 . 16 1 1 A 95 95 VAL HA H 95 4.100 4.206 -0.106 1
1 1195 . 16 1 1 A 95 95 VAL C C 95 175.100 175.697 -0.597 1
1 1196 . 16 1 1 A 95 95 VAL CA C 95 61.700 63.115 -1.415 1
1 1197 . 16 1 1 A 95 95 VAL CB C 95 33.100 33.306 -0.206 1
1 1200 . 16 1 1 A 95 95 VAL N N 95 119.700 123.885 -4.185 1
1 1201 . 16 1 1 A 96 96 ASN H H 96 8.490 8.018 0.472 1
1 1202 . 16 1 1 A 96 96 ASN HA H 96 4.700 4.647 0.053 1
1 1207 . 16 1 1 A 96 96 ASN C C 96 174.600 175.993 -1.393 1
1 1208 . 16 1 1 A 96 96 ASN CA C 96 53.000 54.082 -1.082 1
1 1209 . 16 1 1 A 96 96 ASN CB C 96 39.000 38.305 0.695 1
1 1211 . 16 1 1 A 96 96 ASN N N 96 122.200 119.696 2.504 1
1 1213 . 16 1 1 A 97 97 ILE H H 97 8.080 8.560 -0.480 1
1 1214 . 16 1 1 A 97 97 ILE HA H 97 4.370 3.983 0.387 1
1 1224 . 16 1 1 A 97 97 ILE CA C 97 58.600 66.433 -7.833 1
1 1225 . 16 1 1 A 97 97 ILE CB C 97 38.600 36.660 1.940 1
1 1229 . 16 1 1 A 97 97 ILE N N 97 123.500 121.881 1.619 1
1 1230 . 16 1 1 A 98 98 PRO HA H 98 4.360 4.485 -0.125 1
1 1237 . 16 1 1 A 98 98 PRO C C 98 176.600 176.593 0.007 1
1 1238 . 16 1 1 A 98 98 PRO CA C 98 63.100 62.902 0.198 1
1 1239 . 16 1 1 A 98 98 PRO CB C 98 31.800 31.887 -0.087 1
1 1242 . 16 1 1 A 99 99 LEU H H 99 8.200 8.281 -0.081 1
1 1243 . 16 1 1 A 99 99 LEU HA H 99 4.200 4.379 -0.179 1
1 1253 . 16 1 1 A 99 99 LEU C C 99 177.300 176.354 0.946 1
1 1254 . 16 1 1 A 99 99 LEU CA C 99 55.000 54.389 0.611 1
1 1255 . 16 1 1 A 99 99 LEU CB C 99 42.400 42.025 0.375 1
1 1259 . 16 1 1 A 99 99 LEU N N 99 122.500 123.426 -0.926 1
1 1260 . 16 1 1 A 100 100 GLU H H 100 8.250 8.499 -0.249 1
1 1261 . 16 1 1 A 100 100 GLU HA H 100 4.140 4.728 -0.588 1
1 1266 . 16 1 1 A 100 100 GLU C C 100 176.100 175.880 0.220 1
1 1267 . 16 1 1 A 100 100 GLU CA C 100 56.100 55.309 0.791 1
1 1268 . 16 1 1 A 100 100 GLU CB C 100 29.900 30.806 -0.906 1
1 1270 . 16 1 1 A 100 100 GLU N N 100 121.000 124.691 -3.691 1
1 1271 . 16 1 1 A 101 101 HIS H H 101 8.540 9.004 -0.464 1
1 1272 . 16 1 1 A 101 101 HIS HA H 101 4.600 4.782 -0.182 1
1 1275 . 16 1 1 A 101 101 HIS C C 101 174.200 174.861 -0.661 1
1 1276 . 16 1 1 A 101 101 HIS CA C 101 55.200 56.539 -1.339 1
1 1277 . 16 1 1 A 101 101 HIS CB C 101 29.000 30.612 -1.612 1
1 1278 . 16 1 1 A 101 101 HIS N N 101 119.400 122.618 -3.218 1
1 1279 . 16 1 1 A 102 102 HIS H H 102 8.660 8.866 -0.206 1
1 1280 . 16 1 1 A 102 102 HIS HA H 102 4.630 5.019 -0.389 1
1 1283 . 16 1 1 A 102 102 HIS C C 102 174.200 174.819 -0.619 1
1 1284 . 16 1 1 A 102 102 HIS CA C 102 55.200 55.605 -0.405 1
1 1285 . 16 1 1 A 102 102 HIS CB C 102 29.100 30.355 -1.255 1
1 1286 . 16 1 1 A 102 102 HIS N N 102 119.700 124.254 -4.554 1
1 1287 . 16 1 1 A 103 103 HIS H H 103 8.680 8.669 0.011 1
1 1288 . 16 1 1 A 103 103 HIS HA H 103 4.640 4.432 0.208 1
1 1291 . 16 1 1 A 103 103 HIS C C 103 174.200 175.563 -1.363 1
1 1292 . 16 1 1 A 103 103 HIS CA C 103 55.200 55.831 -0.631 1
1 1293 . 16 1 1 A 103 103 HIS CB C 103 29.200 30.989 -1.789 1
1 1294 . 16 1 1 A 103 103 HIS N N 103 120.500 121.635 -1.135 1
1 1295 . 16 1 1 A 104 104 HIS H H 104 8.580 6.942 1.638 1
1 1296 . 16 1 1 A 104 104 HIS HA H 104 4.590 4.174 0.416 1
1 1299 . 16 1 1 A 104 104 HIS C C 104 174.200 175.111 -0.911 1
1 1300 . 16 1 1 A 104 104 HIS CA C 104 55.200 57.381 -2.181 1
1 1301 . 16 1 1 A 104 104 HIS CB C 104 29.300 29.675 -0.375 1
1 1302 . 16 1 1 A 104 104 HIS N N 104 120.700 116.655 4.045 1
1 1303 . 16 1 1 A 105 105 HIS H H 105 8.550 7.648 0.902 1
1 1304 . 16 1 1 A 105 105 HIS HA H 105 4.610 4.614 -0.004 1
1 1307 . 16 1 1 A 105 105 HIS C C 105 173.500 175.243 -1.743 1
1 1308 . 16 1 1 A 105 105 HIS CA C 105 55.400 56.654 -1.254 1
1 1309 . 16 1 1 A 105 105 HIS CB C 105 28.800 31.291 -2.491 1
1 1310 . 16 1 1 A 105 105 HIS N N 105 119.000 117.302 1.698 1
1 7 . 17 1 1 A 2 2 ASP H H 2 8.890 8.374 0.516 1
1 8 . 17 1 1 A 2 2 ASP HA H 2 4.740 4.618 0.122 1
1 11 . 17 1 1 A 2 2 ASP C C 2 174.600 175.442 -0.842 1
1 12 . 17 1 1 A 2 2 ASP CA C 2 53.800 54.211 -0.411 1
1 13 . 17 1 1 A 2 2 ASP CB C 2 41.500 41.477 0.023 1
1 14 . 17 1 1 A 2 2 ASP N N 2 122.100 124.895 -2.795 1
1 15 . 17 1 1 A 3 3 LEU H H 3 8.280 8.370 -0.090 1
1 16 . 17 1 1 A 3 3 LEU HA H 3 4.420 4.640 -0.220 1
1 26 . 17 1 1 A 3 3 LEU C C 3 176.900 176.170 0.730 1
1 27 . 17 1 1 A 3 3 LEU CA C 3 55.000 55.714 -0.714 1
1 28 . 17 1 1 A 3 3 LEU CB C 3 42.700 42.410 0.290 1
1 32 . 17 1 1 A 3 3 LEU N N 3 122.300 126.259 -3.959 1
1 33 . 17 1 1 A 4 4 VAL H H 4 8.640 8.582 0.058 1
1 34 . 17 1 1 A 4 4 VAL HA H 4 4.540 4.938 -0.398 1
1 42 . 17 1 1 A 4 4 VAL C C 4 175.800 174.919 0.881 1
1 43 . 17 1 1 A 4 4 VAL CA C 4 59.400 58.600 0.800 1
1 44 . 17 1 1 A 4 4 VAL CB C 4 35.400 35.852 -0.452 1
1 47 . 17 1 1 A 4 4 VAL N N 4 122.600 119.271 3.329 1
1 48 . 17 1 1 A 5 5 LYS H H 5 8.630 8.631 -0.001 1
1 49 . 17 1 1 A 5 5 LYS HA H 5 4.450 4.332 0.118 1
1 58 . 17 1 1 A 5 5 LYS C C 5 179.400 178.404 0.996 1
1 59 . 17 1 1 A 5 5 LYS CA C 5 53.600 56.211 -2.611 1
1 60 . 17 1 1 A 5 5 LYS CB C 5 30.900 33.216 -2.316 1
1 64 . 17 1 1 A 5 5 LYS N N 5 121.100 121.649 -0.549 1
1 65 . 17 1 1 A 6 6 ILE H H 6 10.320 8.874 1.446 1
1 66 . 17 1 1 A 6 6 ILE HA H 6 3.440 3.703 -0.263 1
1 76 . 17 1 1 A 6 6 ILE C C 6 178.300 177.645 0.655 1
1 77 . 17 1 1 A 6 6 ILE CA C 6 65.700 65.019 0.681 1
1 78 . 17 1 1 A 6 6 ILE CB C 6 35.900 37.690 -1.790 1
1 82 . 17 1 1 A 6 6 ILE N N 6 125.400 122.489 2.911 1
1 83 . 17 1 1 A 7 7 ARG H H 7 8.210 7.974 0.236 1
1 84 . 17 1 1 A 7 7 ARG HA H 7 3.850 4.184 -0.334 1
1 92 . 17 1 1 A 7 7 ARG C C 7 175.600 177.174 -1.574 1
1 93 . 17 1 1 A 7 7 ARG CA C 7 57.800 58.821 -1.021 1
1 94 . 17 1 1 A 7 7 ARG CB C 7 30.300 30.061 0.239 1
1 98 . 17 1 1 A 7 7 ARG N N 7 118.800 120.669 -1.869 1
1 100 . 17 1 1 A 8 8 ASP H H 8 7.850 7.636 0.214 1
1 101 . 17 1 1 A 8 8 ASP HA H 8 4.700 4.706 -0.006 1
1 104 . 17 1 1 A 8 8 ASP C C 8 176.100 176.411 -0.311 1
1 105 . 17 1 1 A 8 8 ASP CA C 8 54.100 54.403 -0.303 1
1 106 . 17 1 1 A 8 8 ASP CB C 8 41.200 41.397 -0.197 1
1 107 . 17 1 1 A 8 8 ASP N N 8 116.800 117.413 -0.613 1
1 108 . 17 1 1 A 9 9 VAL H H 9 7.240 7.428 -0.188 1
1 109 . 17 1 1 A 9 9 VAL HA H 9 3.710 3.956 -0.246 1
1 117 . 17 1 1 A 9 9 VAL C C 9 174.900 175.533 -0.633 1
1 118 . 17 1 1 A 9 9 VAL CA C 9 64.300 63.333 0.967 1
1 119 . 17 1 1 A 9 9 VAL CB C 9 31.500 31.716 -0.216 1
1 122 . 17 1 1 A 9 9 VAL N N 9 121.800 122.136 -0.336 1
1 123 . 17 1 1 A 10 10 SER H H 10 8.600 8.453 0.147 1
1 124 . 17 1 1 A 10 10 SER HA H 10 4.600 4.634 -0.034 1
1 127 . 17 1 1 A 10 10 SER CA C 10 56.700 57.124 -0.424 1
1 128 . 17 1 1 A 10 10 SER CB C 10 66.100 65.570 0.530 1
1 129 . 17 1 1 A 10 10 SER N N 10 122.200 120.971 1.229 1
1 130 . 17 1 1 A 11 11 LEU H H 11 8.660 8.981 -0.321 1
1 131 . 17 1 1 A 11 11 LEU HA H 11 3.900 4.065 -0.165 1
1 141 . 17 1 1 A 11 11 LEU C C 11 178.100 178.969 -0.869 1
1 142 . 17 1 1 A 11 11 LEU CA C 11 56.700 57.230 -0.530 1
1 143 . 17 1 1 A 11 11 LEU CB C 11 41.400 41.572 -0.172 1
1 147 . 17 1 1 A 11 11 LEU N N 11 120.300 123.105 -2.805 1
1 148 . 17 1 1 A 12 12 SER H H 12 8.160 7.961 0.199 1
1 149 . 17 1 1 A 12 12 SER HA H 12 4.270 4.248 0.022 1
1 152 . 17 1 1 A 12 12 SER C C 12 174.200 174.805 -0.605 1
1 153 . 17 1 1 A 12 12 SER CA C 12 59.900 60.592 -0.692 1
1 154 . 17 1 1 A 12 12 SER CB C 12 63.100 62.752 0.348 1
1 155 . 17 1 1 A 12 12 SER N N 12 112.100 113.492 -1.392 1
1 156 . 17 1 1 A 13 13 THR H H 13 7.460 7.605 -0.145 1
1 157 . 17 1 1 A 13 13 THR HA H 13 4.760 4.686 0.074 1
1 162 . 17 1 1 A 13 13 THR CA C 13 56.600 58.931 -2.331 1
1 163 . 17 1 1 A 13 13 THR CB C 13 70.100 69.009 1.091 1
1 165 . 17 1 1 A 13 13 THR N N 13 114.700 109.710 4.990 1
1 166 . 17 1 1 A 14 14 PRO HA H 14 4.050 4.236 -0.186 1
1 173 . 17 1 1 A 14 14 PRO C C 14 175.800 175.940 -0.140 1
1 174 . 17 1 1 A 14 14 PRO CA C 14 65.100 64.695 0.405 1
1 175 . 17 1 1 A 14 14 PRO CB C 14 32.100 31.362 0.738 1
1 178 . 17 1 1 A 15 15 TYR H H 15 7.380 7.642 -0.262 1
1 179 . 17 1 1 A 15 15 TYR HA H 15 5.570 5.678 -0.108 1
1 186 . 17 1 1 A 15 15 TYR C C 15 176.100 175.241 0.859 1
1 187 . 17 1 1 A 15 15 TYR CA C 15 56.400 56.819 -0.419 1
1 188 . 17 1 1 A 15 15 TYR CB C 15 41.500 41.662 -0.162 1
1 193 . 17 1 1 A 15 15 TYR N N 15 113.800 117.132 -3.332 1
1 194 . 17 1 1 A 16 16 VAL H H 16 9.010 8.784 0.226 1
1 195 . 17 1 1 A 16 16 VAL HA H 16 4.920 5.056 -0.136 1
1 203 . 17 1 1 A 16 16 VAL C C 16 174.300 173.313 0.987 1
1 204 . 17 1 1 A 16 16 VAL CA C 16 59.600 59.532 0.068 1
1 205 . 17 1 1 A 16 16 VAL CB C 16 36.800 36.361 0.439 1
1 208 . 17 1 1 A 16 16 VAL N N 16 113.800 117.331 -3.531 1
1 209 . 17 1 1 A 17 17 SER H H 17 7.960 9.027 -1.067 1
1 210 . 17 1 1 A 17 17 SER HA H 17 5.860 5.609 0.251 1
1 213 . 17 1 1 A 17 17 SER C C 17 172.700 173.262 -0.562 1
1 214 . 17 1 1 A 17 17 SER CA C 17 57.300 56.528 0.772 1
1 215 . 17 1 1 A 17 17 SER CB C 17 64.000 65.079 -1.079 1
1 216 . 17 1 1 A 17 17 SER N N 17 117.100 117.285 -0.185 1
1 217 . 17 1 1 A 18 18 VAL H H 18 8.570 8.716 -0.146 1
1 218 . 17 1 1 A 18 18 VAL HA H 18 4.900 5.168 -0.268 1
1 226 . 17 1 1 A 18 18 VAL C C 18 173.700 173.749 -0.049 1
1 227 . 17 1 1 A 18 18 VAL CA C 18 58.800 59.069 -0.269 1
1 228 . 17 1 1 A 18 18 VAL CB C 18 36.700 36.022 0.678 1
1 231 . 17 1 1 A 18 18 VAL N N 18 113.500 118.998 -5.498 1
1 232 . 17 1 1 A 19 19 ILE H H 19 8.490 8.622 -0.132 1
1 233 . 17 1 1 A 19 19 ILE HA H 19 5.300 4.954 0.346 1
1 243 . 17 1 1 A 19 19 ILE C C 19 175.800 174.732 1.068 1
1 244 . 17 1 1 A 19 19 ILE CA C 19 59.700 59.283 0.417 1
1 245 . 17 1 1 A 19 19 ILE CB C 19 41.700 42.370 -0.670 1
1 249 . 17 1 1 A 19 19 ILE N N 19 120.600 121.642 -1.042 1
1 250 . 17 1 1 A 20 20 GLY H H 20 8.670 8.228 0.442 1
1 251 . 17 1 1 A 20 20 GLY HA2 H 20 3.760 4.199 -0.439 1
1 252 . 17 1 1 A 20 20 GLY HA3 H 20 4.190 4.203 -0.013 1
1 253 . 17 1 1 A 20 20 GLY C C 20 169.900 172.185 -2.285 1
1 254 . 17 1 1 A 20 20 GLY CA C 20 46.000 45.965 0.035 1
1 255 . 17 1 1 A 20 20 GLY N N 20 110.200 113.204 -3.004 1
1 256 . 17 1 1 A 21 21 LYS H H 21 8.920 8.361 0.559 1
1 257 . 17 1 1 A 21 21 LYS HA H 21 5.210 5.217 -0.007 1
1 266 . 17 1 1 A 21 21 LYS C C 21 176.400 175.033 1.367 1
1 267 . 17 1 1 A 21 21 LYS CA C 21 54.400 54.792 -0.392 1
1 268 . 17 1 1 A 21 21 LYS CB C 21 35.400 35.501 -0.101 1
1 272 . 17 1 1 A 21 21 LYS N N 21 119.100 117.300 1.800 1
1 273 . 17 1 1 A 22 22 ILE H H 22 8.900 8.476 0.424 1
1 274 . 17 1 1 A 22 22 ILE HA H 22 5.050 5.171 -0.121 1
1 284 . 17 1 1 A 22 22 ILE C C 22 176.900 175.339 1.561 1
1 285 . 17 1 1 A 22 22 ILE CA C 22 57.800 60.385 -2.585 1
1 286 . 17 1 1 A 22 22 ILE CB C 22 36.200 39.281 -3.081 1
1 290 . 17 1 1 A 22 22 ILE N N 22 130.000 124.728 5.272 1
1 291 . 17 1 1 A 23 23 THR H H 23 9.020 8.835 0.185 1
1 292 . 17 1 1 A 23 23 THR HA H 23 4.660 5.237 -0.577 1
1 297 . 17 1 1 A 23 23 THR C C 23 174.000 174.132 -0.132 1
1 298 . 17 1 1 A 23 23 THR CA C 23 60.800 59.755 1.045 1
1 299 . 17 1 1 A 23 23 THR CB C 23 73.400 71.882 1.518 1
1 301 . 17 1 1 A 23 23 THR N N 23 118.200 117.620 0.580 1
1 302 . 17 1 1 A 24 24 GLY H H 24 8.430 8.711 -0.281 1
1 303 . 17 1 1 A 24 24 GLY HA2 H 24 3.910 3.950 -0.040 1
1 304 . 17 1 1 A 24 24 GLY HA3 H 24 3.910 4.013 -0.103 1
1 305 . 17 1 1 A 24 24 GLY C C 24 175.400 175.007 0.393 1
1 306 . 17 1 1 A 24 24 GLY CA C 24 47.100 47.097 0.003 1
1 307 . 17 1 1 A 24 24 GLY N N 24 107.200 112.504 -5.304 1
1 308 . 17 1 1 A 25 25 ILE H H 25 9.370 8.268 1.102 1
1 309 . 17 1 1 A 25 25 ILE HA H 25 4.480 4.218 0.262 1
1 319 . 17 1 1 A 25 25 ILE C C 25 178.200 175.452 2.748 1
1 320 . 17 1 1 A 25 25 ILE CA C 25 59.200 61.282 -2.082 1
1 321 . 17 1 1 A 25 25 ILE CB C 25 35.400 37.947 -2.547 1
1 325 . 17 1 1 A 25 25 ILE N N 25 120.600 120.735 -0.135 1
1 326 . 17 1 1 A 26 26 HIS H H 26 9.000 9.093 -0.093 1
1 327 . 17 1 1 A 26 26 HIS HA H 26 4.770 5.316 -0.546 1
1 330 . 17 1 1 A 26 26 HIS C C 26 172.700 172.645 0.055 1
1 331 . 17 1 1 A 26 26 HIS CA C 26 55.000 54.293 0.707 1
1 332 . 17 1 1 A 26 26 HIS CB C 26 31.100 33.135 -2.035 1
1 333 . 17 1 1 A 26 26 HIS N N 26 123.800 127.225 -3.425 1
1 334 . 17 1 1 A 27 27 LYS H H 27 8.930 8.597 0.333 1
1 335 . 17 1 1 A 27 27 LYS HA H 27 4.770 4.661 0.109 1
1 344 . 17 1 1 A 27 27 LYS C C 27 175.300 174.741 0.559 1
1 345 . 17 1 1 A 27 27 LYS CA C 27 55.100 54.662 0.438 1
1 346 . 17 1 1 A 27 27 LYS CB C 27 34.400 34.525 -0.125 1
1 350 . 17 1 1 A 27 27 LYS N N 27 125.900 128.195 -2.295 1
1 351 . 17 1 1 A 28 28 LYS H H 28 8.880 8.189 0.691 1
1 352 . 17 1 1 A 28 28 LYS HA H 28 4.570 4.817 -0.247 1
1 361 . 17 1 1 A 28 28 LYS C C 28 174.500 173.791 0.709 1
1 362 . 17 1 1 A 28 28 LYS CA C 28 54.600 55.047 -0.447 1
1 363 . 17 1 1 A 28 28 LYS CB C 28 35.300 36.868 -1.568 1
1 367 . 17 1 1 A 28 28 LYS N N 28 127.400 126.310 1.090 1
1 368 . 17 1 1 A 29 29 GLU H H 29 8.440 8.497 -0.057 1
1 369 . 17 1 1 A 29 29 GLU HA H 29 5.260 5.230 0.030 1
1 374 . 17 1 1 A 29 29 GLU C C 29 175.800 175.726 0.074 1
1 375 . 17 1 1 A 29 29 GLU CA C 29 54.800 54.930 -0.130 1
1 376 . 17 1 1 A 29 29 GLU CB C 29 31.500 33.027 -1.527 1
1 378 . 17 1 1 A 29 29 GLU N N 29 122.200 124.204 -2.004 1
1 379 . 17 1 1 A 30 30 TYR H H 30 8.960 8.825 0.135 1
1 380 . 17 1 1 A 30 30 TYR HA H 30 4.820 5.267 -0.447 1
1 387 . 17 1 1 A 30 30 TYR C C 30 172.600 172.302 0.298 1
1 388 . 17 1 1 A 30 30 TYR CA C 30 56.300 55.511 0.789 1
1 389 . 17 1 1 A 30 30 TYR CB C 30 40.500 41.408 -0.908 1
1 394 . 17 1 1 A 30 30 TYR N N 30 121.100 118.832 2.268 1
1 395 . 17 1 1 A 31 31 GLU H H 31 8.610 8.762 -0.152 1
1 396 . 17 1 1 A 31 31 GLU HA H 31 4.810 4.559 0.251 1
1 401 . 17 1 1 A 31 31 GLU C C 31 176.100 175.334 0.766 1
1 402 . 17 1 1 A 31 31 GLU CA C 31 55.100 56.060 -0.960 1
1 403 . 17 1 1 A 31 31 GLU CB C 31 30.300 30.726 -0.426 1
1 405 . 17 1 1 A 31 31 GLU N N 31 121.800 121.331 0.469 1
1 406 . 17 1 1 A 32 32 SER H H 32 8.570 9.249 -0.679 1
1 407 . 17 1 1 A 32 32 SER HA H 32 4.520 4.768 -0.248 1
1 410 . 17 1 1 A 32 32 SER C C 32 174.300 172.944 1.356 1
1 411 . 17 1 1 A 32 32 SER CA C 32 57.300 57.502 -0.202 1
1 412 . 17 1 1 A 32 32 SER CB C 32 64.100 66.001 -1.901 1
1 413 . 17 1 1 A 32 32 SER N N 32 118.500 121.247 -2.747 1
1 414 . 17 1 1 A 33 33 ASP H H 33 9.290 9.386 -0.096 1
1 415 . 17 1 1 A 33 33 ASP HA H 33 4.340 4.340 0.000 1
1 418 . 17 1 1 A 33 33 ASP C C 33 175.900 176.327 -0.427 1
1 419 . 17 1 1 A 33 33 ASP CA C 33 55.000 55.347 -0.347 1
1 420 . 17 1 1 A 33 33 ASP CB C 33 39.300 39.510 -0.210 1
1 421 . 17 1 1 A 33 33 ASP N N 33 125.700 128.778 -3.078 1
1 422 . 17 1 1 A 34 34 GLY H H 34 8.690 8.637 0.053 1
1 423 . 17 1 1 A 34 34 GLY HA2 H 34 3.660 3.822 -0.162 1
1 424 . 17 1 1 A 34 34 GLY HA3 H 34 4.140 3.825 0.315 1
1 425 . 17 1 1 A 34 34 GLY C C 34 174.200 173.621 0.579 1
1 426 . 17 1 1 A 34 34 GLY CA C 34 45.600 45.637 -0.037 1
1 427 . 17 1 1 A 34 34 GLY N N 34 104.800 104.661 0.139 1
1 428 . 17 1 1 A 35 35 THR H H 35 7.840 7.760 0.080 1
1 429 . 17 1 1 A 35 35 THR HA H 35 4.660 4.893 -0.233 1
1 434 . 17 1 1 A 35 35 THR C C 35 173.000 173.174 -0.174 1
1 435 . 17 1 1 A 35 35 THR CA C 35 60.200 59.116 1.084 1
1 436 . 17 1 1 A 35 35 THR CB C 35 71.200 72.440 -1.240 1
1 438 . 17 1 1 A 35 35 THR N N 35 114.800 109.720 5.080 1
1 439 . 17 1 1 A 36 36 THR H H 36 8.480 8.619 -0.139 1
1 440 . 17 1 1 A 36 36 THR HA H 36 4.620 4.664 -0.044 1
1 445 . 17 1 1 A 36 36 THR C C 36 173.800 174.026 -0.226 1
1 446 . 17 1 1 A 36 36 THR CA C 36 62.300 61.893 0.407 1
1 447 . 17 1 1 A 36 36 THR CB C 36 69.500 69.648 -0.148 1
1 449 . 17 1 1 A 36 36 THR N N 36 119.400 117.533 1.867 1
1 450 . 17 1 1 A 37 37 LYS H H 37 8.880 8.286 0.594 1
1 451 . 17 1 1 A 37 37 LYS HA H 37 4.570 4.745 -0.175 1
1 460 . 17 1 1 A 37 37 LYS C C 37 174.500 175.603 -1.103 1
1 461 . 17 1 1 A 37 37 LYS CA C 37 54.600 54.208 0.392 1
1 462 . 17 1 1 A 37 37 LYS CB C 37 35.500 35.620 -0.120 1
1 466 . 17 1 1 A 37 37 LYS N N 37 128.000 126.061 1.939 1
1 467 . 17 1 1 A 38 38 SER H H 38 8.370 8.885 -0.515 1
1 468 . 17 1 1 A 38 38 SER HA H 38 5.250 4.984 0.266 1
1 471 . 17 1 1 A 38 38 SER C C 38 173.200 173.721 -0.521 1
1 472 . 17 1 1 A 38 38 SER CA C 38 57.900 58.425 -0.525 1
1 473 . 17 1 1 A 38 38 SER CB C 38 65.500 64.021 1.479 1
1 474 . 17 1 1 A 38 38 SER N N 38 114.300 119.149 -4.849 1
1 475 . 17 1 1 A 39 39 VAL H H 39 9.020 9.008 0.012 1
1 476 . 17 1 1 A 39 39 VAL HA H 39 4.900 5.020 -0.120 1
1 484 . 17 1 1 A 39 39 VAL C C 39 173.200 172.689 0.511 1
1 485 . 17 1 1 A 39 39 VAL CA C 39 59.200 59.652 -0.452 1
1 486 . 17 1 1 A 39 39 VAL CB C 39 34.600 35.342 -0.742 1
1 489 . 17 1 1 A 39 39 VAL N N 39 123.600 121.424 2.176 1
1 490 . 17 1 1 A 40 40 TYR H H 40 8.900 9.020 -0.120 1
1 491 . 17 1 1 A 40 40 TYR HA H 40 4.730 5.331 -0.601 1
1 498 . 17 1 1 A 40 40 TYR CA C 40 56.500 56.884 -0.384 1
1 499 . 17 1 1 A 40 40 TYR CB C 40 39.000 40.533 -1.533 1
1 504 . 17 1 1 A 40 40 TYR N N 40 126.300 127.627 -1.327 1
1 505 . 17 1 1 A 41 41 GLN H H 41 8.630 8.802 -0.172 1
1 506 . 17 1 1 A 41 41 GLN HA H 41 5.330 5.365 -0.035 1
1 513 . 17 1 1 A 41 41 GLN C C 41 175.500 175.619 -0.119 1
1 514 . 17 1 1 A 41 41 GLN CA C 41 53.800 54.189 -0.389 1
1 515 . 17 1 1 A 41 41 GLN CB C 41 32.100 32.246 -0.146 1
1 518 . 17 1 1 A 41 41 GLN N N 41 122.000 121.796 0.204 1
1 520 . 17 1 1 A 42 42 GLY H H 42 8.560 7.849 0.711 1
1 521 . 17 1 1 A 42 42 GLY HA2 H 42 3.680 4.224 -0.544 1
1 522 . 17 1 1 A 42 42 GLY HA3 H 42 4.020 4.261 -0.241 1
1 523 . 17 1 1 A 42 42 GLY C C 42 171.600 171.099 0.501 1
1 524 . 17 1 1 A 42 42 GLY CA C 42 47.300 46.101 1.199 1
1 525 . 17 1 1 A 42 42 GLY N N 42 113.000 108.692 4.308 1
1 526 . 17 1 1 A 43 43 TYR H H 43 9.320 8.589 0.731 1
1 527 . 17 1 1 A 43 43 TYR HA H 43 5.280 5.402 -0.122 1
1 534 . 17 1 1 A 43 43 TYR C C 43 173.200 174.249 -1.049 1
1 535 . 17 1 1 A 43 43 TYR CA C 43 57.600 56.430 1.170 1
1 536 . 17 1 1 A 43 43 TYR CB C 43 42.400 41.978 0.422 1
1 541 . 17 1 1 A 43 43 TYR N N 43 126.300 118.971 7.329 1
1 542 . 17 1 1 A 44 44 ILE H H 44 9.160 8.734 0.426 1
1 543 . 17 1 1 A 44 44 ILE HA H 44 5.270 5.356 -0.086 1
1 553 . 17 1 1 A 44 44 ILE C C 44 172.900 174.234 -1.334 1
1 554 . 17 1 1 A 44 44 ILE CA C 44 59.000 59.349 -0.349 1
1 555 . 17 1 1 A 44 44 ILE CB C 44 42.200 41.538 0.662 1
1 559 . 17 1 1 A 44 44 ILE N N 44 117.700 123.291 -5.591 1
1 560 . 17 1 1 A 45 45 GLU H H 45 8.420 8.857 -0.437 1
1 561 . 17 1 1 A 45 45 GLU HA H 45 5.600 5.438 0.162 1
1 566 . 17 1 1 A 45 45 GLU C C 45 174.300 174.622 -0.322 1
1 567 . 17 1 1 A 45 45 GLU CA C 45 54.000 54.376 -0.376 1
1 568 . 17 1 1 A 45 45 GLU CB C 45 34.400 33.910 0.490 1
1 570 . 17 1 1 A 45 45 GLU N N 45 123.600 127.493 -3.893 1
1 571 . 17 1 1 A 46 46 ASP H H 46 8.530 8.516 0.014 1
1 572 . 17 1 1 A 46 46 ASP HA H 46 5.070 4.904 0.166 1
1 575 . 17 1 1 A 46 46 ASP C C 46 175.000 175.565 -0.565 1
1 576 . 17 1 1 A 46 46 ASP CA C 46 51.800 53.127 -1.327 1
1 577 . 17 1 1 A 46 46 ASP CB C 46 41.300 41.049 0.251 1
1 578 . 17 1 1 A 46 46 ASP N N 46 125.500 119.324 6.176 1
1 579 . 17 1 1 A 47 47 ASP H H 47 9.160 9.079 0.081 1
1 580 . 17 1 1 A 47 47 ASP HA H 47 4.430 4.574 -0.144 1
1 583 . 17 1 1 A 47 47 ASP C C 47 176.000 177.297 -1.297 1
1 584 . 17 1 1 A 47 47 ASP CA C 47 55.000 55.115 -0.115 1
1 585 . 17 1 1 A 47 47 ASP CB C 47 38.900 39.962 -1.062 1
1 586 . 17 1 1 A 47 47 ASP N N 47 114.200 118.301 -4.101 1
1 587 . 17 1 1 A 48 48 THR H H 48 9.470 8.530 0.940 1
1 588 . 17 1 1 A 48 48 THR HA H 48 4.520 4.498 0.022 1
1 593 . 17 1 1 A 48 48 THR C C 48 174.500 175.089 -0.589 1
1 594 . 17 1 1 A 48 48 THR CA C 48 62.600 62.366 0.234 1
1 595 . 17 1 1 A 48 48 THR CB C 48 70.400 69.301 1.099 1
1 597 . 17 1 1 A 48 48 THR N N 48 111.800 108.909 2.891 1
1 598 . 17 1 1 A 49 49 ALA H H 49 7.850 7.353 0.497 1
1 599 . 17 1 1 A 49 49 ALA HA H 49 4.440 4.430 0.010 1
1 603 . 17 1 1 A 49 49 ALA C C 49 173.200 175.419 -2.219 1
1 604 . 17 1 1 A 49 49 ALA CA C 49 52.700 51.360 1.340 1
1 605 . 17 1 1 A 49 49 ALA CB C 49 21.300 20.163 1.137 1
1 606 . 17 1 1 A 49 49 ALA N N 49 123.400 120.517 2.883 1
1 607 . 17 1 1 A 50 50 ARG H H 50 8.160 8.661 -0.501 1
1 608 . 17 1 1 A 50 50 ARG HA H 50 5.350 5.542 -0.192 1
1 616 . 17 1 1 A 50 50 ARG C C 50 174.700 174.216 0.484 1
1 617 . 17 1 1 A 50 50 ARG CA C 50 54.000 54.322 -0.322 1
1 618 . 17 1 1 A 50 50 ARG CB C 50 34.500 34.424 0.076 1
1 622 . 17 1 1 A 50 50 ARG N N 50 117.400 114.943 2.457 1
1 624 . 17 1 1 A 51 51 ILE H H 51 9.390 8.604 0.786 1
1 625 . 17 1 1 A 51 51 ILE HA H 51 4.790 4.948 -0.158 1
1 635 . 17 1 1 A 51 51 ILE C C 51 172.600 174.541 -1.941 1
1 636 . 17 1 1 A 51 51 ILE CA C 51 60.000 59.162 0.838 1
1 637 . 17 1 1 A 51 51 ILE CB C 51 42.800 41.911 0.889 1
1 641 . 17 1 1 A 51 51 ILE N N 51 124.600 120.996 3.604 1
1 642 . 17 1 1 A 52 52 ARG H H 52 7.980 8.380 -0.400 1
1 643 . 17 1 1 A 52 52 ARG HA H 52 4.170 4.301 -0.131 1
1 651 . 17 1 1 A 52 52 ARG C C 52 174.600 176.239 -1.639 1
1 652 . 17 1 1 A 52 52 ARG CA C 52 57.100 56.105 0.995 1
1 653 . 17 1 1 A 52 52 ARG CB C 52 31.300 30.761 0.539 1
1 657 . 17 1 1 A 52 52 ARG N N 52 125.900 125.872 0.028 1
1 659 . 17 1 1 A 53 53 ILE H H 53 8.290 8.542 -0.252 1
1 660 . 17 1 1 A 53 53 ILE HA H 53 5.160 5.193 -0.033 1
1 670 . 17 1 1 A 53 53 ILE C C 53 172.400 174.650 -2.250 1
1 671 . 17 1 1 A 53 53 ILE CA C 53 58.600 59.264 -0.664 1
1 672 . 17 1 1 A 53 53 ILE CB C 53 41.900 42.338 -0.438 1
1 676 . 17 1 1 A 53 53 ILE N N 53 118.500 119.430 -0.930 1
1 677 . 17 1 1 A 54 54 SER H H 54 8.350 8.777 -0.427 1
1 678 . 17 1 1 A 54 54 SER HA H 54 5.070 5.379 -0.309 1
1 681 . 17 1 1 A 54 54 SER C C 54 172.400 173.178 -0.778 1
1 682 . 17 1 1 A 54 54 SER CA C 54 57.000 56.719 0.281 1
1 683 . 17 1 1 A 54 54 SER CB C 54 65.900 65.512 0.388 1
1 684 . 17 1 1 A 54 54 SER N N 54 120.700 118.114 2.586 1
1 685 . 17 1 1 A 55 55 SER H H 55 9.130 9.385 -0.255 1
1 686 . 17 1 1 A 55 55 SER HA H 55 5.270 5.332 -0.062 1
1 690 . 17 1 1 A 55 55 SER C C 55 174.400 173.056 1.344 1
1 691 . 17 1 1 A 55 55 SER CA C 55 55.500 56.183 -0.683 1
1 692 . 17 1 1 A 55 55 SER CB C 55 64.500 65.547 -1.047 1
1 693 . 17 1 1 A 55 55 SER N N 55 117.200 117.897 -0.697 1
1 694 . 17 1 1 A 56 56 PHE H H 56 8.970 8.570 0.400 1
1 695 . 17 1 1 A 56 56 PHE HA H 56 4.600 4.910 -0.310 1
1 703 . 17 1 1 A 56 56 PHE C C 56 176.500 177.264 -0.764 1
1 704 . 17 1 1 A 56 56 PHE CA C 56 58.300 57.674 0.626 1
1 705 . 17 1 1 A 56 56 PHE CB C 56 37.900 40.422 -2.522 1
1 711 . 17 1 1 A 56 56 PHE N N 56 129.400 123.135 6.265 1
1 712 . 17 1 1 A 57 57 GLY H H 57 8.570 9.013 -0.443 1
1 713 . 17 1 1 A 57 57 GLY HA2 H 57 4.020 4.141 -0.121 1
1 714 . 17 1 1 A 57 57 GLY HA3 H 57 4.380 4.206 0.174 1
1 715 . 17 1 1 A 57 57 GLY C C 57 173.700 173.975 -0.275 1
1 716 . 17 1 1 A 57 57 GLY CA C 57 46.300 45.721 0.579 1
1 717 . 17 1 1 A 57 57 GLY N N 57 112.500 112.556 -0.056 1
1 718 . 17 1 1 A 58 58 LYS H H 58 6.800 8.335 -1.535 1
1 719 . 17 1 1 A 58 58 LYS HA H 58 4.410 4.363 0.047 1
1 728 . 17 1 1 A 58 58 LYS C C 58 174.800 175.572 -0.772 1
1 729 . 17 1 1 A 58 58 LYS CA C 58 55.200 56.399 -1.199 1
1 730 . 17 1 1 A 58 58 LYS CB C 58 33.300 33.366 -0.066 1
1 734 . 17 1 1 A 58 58 LYS N N 58 118.700 121.076 -2.376 1
1 735 . 17 1 1 A 59 59 GLN H H 59 8.390 8.586 -0.196 1
1 736 . 17 1 1 A 59 59 GLN HA H 59 1.830 3.602 -1.772 1
1 743 . 17 1 1 A 59 59 GLN C C 59 174.100 174.412 -0.312 1
1 744 . 17 1 1 A 59 59 GLN CA C 59 57.100 54.980 2.120 1
1 745 . 17 1 1 A 59 59 GLN CB C 59 28.900 29.537 -0.637 1
1 748 . 17 1 1 A 59 59 GLN N N 59 124.000 123.392 0.608 1
1 750 . 17 1 1 A 60 60 LEU H H 60 5.320 8.323 -3.003 1
1 751 . 17 1 1 A 60 60 LEU HA H 60 4.370 4.960 -0.590 1
1 761 . 17 1 1 A 60 60 LEU CA C 60 52.800 53.482 -0.682 1
1 762 . 17 1 1 A 60 60 LEU CB C 60 46.700 45.281 1.419 1
1 766 . 17 1 1 A 60 60 LEU N N 60 121.800 123.855 -2.055 1
1 767 . 17 1 1 A 61 61 GLN H H 61 8.660 8.876 -0.216 1
1 768 . 17 1 1 A 61 61 GLN HA H 61 4.440 4.793 -0.353 1
1 775 . 17 1 1 A 61 61 GLN C C 61 174.000 174.840 -0.840 1
1 776 . 17 1 1 A 61 61 GLN CA C 61 53.800 54.096 -0.296 1
1 777 . 17 1 1 A 61 61 GLN CB C 61 31.800 32.144 -0.344 1
1 780 . 17 1 1 A 61 61 GLN N N 61 120.300 120.546 -0.246 1
1 782 . 17 1 1 A 62 62 ASP H H 62 8.450 8.784 -0.334 1
1 783 . 17 1 1 A 62 62 ASP HA H 62 4.130 4.550 -0.420 1
1 786 . 17 1 1 A 62 62 ASP C C 62 177.200 177.012 0.188 1
1 787 . 17 1 1 A 62 62 ASP CA C 62 55.700 55.306 0.394 1
1 788 . 17 1 1 A 62 62 ASP CB C 62 39.400 40.842 -1.442 1
1 789 . 17 1 1 A 62 62 ASP N N 62 122.400 124.314 -1.914 1
1 790 . 17 1 1 A 63 63 SER H H 63 9.210 9.422 -0.212 1
1 791 . 17 1 1 A 63 63 SER HA H 63 3.850 4.076 -0.226 1
1 794 . 17 1 1 A 63 63 SER C C 63 173.200 172.744 0.456 1
1 795 . 17 1 1 A 63 63 SER CA C 63 61.700 60.300 1.400 1
1 796 . 17 1 1 A 63 63 SER CB C 63 61.800 61.644 0.156 1
1 797 . 17 1 1 A 63 63 SER N N 63 114.300 115.710 -1.410 1
1 798 . 17 1 1 A 64 64 ASP H H 64 7.960 7.638 0.322 1
1 799 . 17 1 1 A 64 64 ASP HA H 64 4.540 4.745 -0.205 1
1 802 . 17 1 1 A 64 64 ASP C C 64 174.900 175.549 -0.649 1
1 803 . 17 1 1 A 64 64 ASP CA C 64 54.900 54.096 0.804 1
1 804 . 17 1 1 A 64 64 ASP CB C 64 40.900 41.892 -0.992 1
1 805 . 17 1 1 A 64 64 ASP N N 64 122.600 121.807 0.793 1
1 806 . 17 1 1 A 65 65 VAL H H 65 8.180 8.607 -0.427 1
1 807 . 17 1 1 A 65 65 VAL HA H 65 4.670 4.713 -0.043 1
1 815 . 17 1 1 A 65 65 VAL C C 65 175.900 175.610 0.290 1
1 816 . 17 1 1 A 65 65 VAL CA C 65 62.300 61.489 0.811 1
1 817 . 17 1 1 A 65 65 VAL CB C 65 31.700 32.855 -1.155 1
1 820 . 17 1 1 A 65 65 VAL N N 65 123.100 123.458 -0.358 1
1 821 . 17 1 1 A 66 66 VAL H H 66 8.770 8.868 -0.098 1
1 822 . 17 1 1 A 66 66 VAL HA H 66 5.160 5.138 0.022 1
1 830 . 17 1 1 A 66 66 VAL C C 66 173.600 173.381 0.219 1
1 831 . 17 1 1 A 66 66 VAL CA C 66 58.100 58.781 -0.681 1
1 832 . 17 1 1 A 66 66 VAL CB C 66 35.700 36.164 -0.464 1
1 835 . 17 1 1 A 66 66 VAL N N 66 118.100 122.226 -4.126 1
1 836 . 17 1 1 A 67 67 ARG H H 67 8.880 8.591 0.289 1
1 837 . 17 1 1 A 67 67 ARG HA H 67 5.110 5.219 -0.109 1
1 845 . 17 1 1 A 67 67 ARG C C 67 175.300 174.498 0.802 1
1 846 . 17 1 1 A 67 67 ARG CA C 67 54.200 54.379 -0.179 1
1 847 . 17 1 1 A 67 67 ARG CB C 67 32.200 33.323 -1.123 1
1 851 . 17 1 1 A 67 67 ARG N N 67 120.200 121.686 -1.486 1
1 853 . 17 1 1 A 68 68 ILE H H 68 9.220 8.819 0.401 1
1 854 . 17 1 1 A 68 68 ILE HA H 68 4.990 4.684 0.306 1
1 864 . 17 1 1 A 68 68 ILE C C 68 174.900 174.683 0.217 1
1 865 . 17 1 1 A 68 68 ILE CA C 68 58.600 59.464 -0.864 1
1 866 . 17 1 1 A 68 68 ILE CB C 68 39.300 38.840 0.460 1
1 870 . 17 1 1 A 68 68 ILE N N 68 127.200 128.569 -1.369 1
1 871 . 17 1 1 A 69 69 ASP H H 69 9.110 8.949 0.161 1
1 872 . 17 1 1 A 69 69 ASP HA H 69 5.370 5.078 0.292 1
1 875 . 17 1 1 A 69 69 ASP C C 69 175.800 176.326 -0.526 1
1 876 . 17 1 1 A 69 69 ASP CA C 69 52.400 52.694 -0.294 1
1 877 . 17 1 1 A 69 69 ASP CB C 69 43.700 43.526 0.174 1
1 878 . 17 1 1 A 69 69 ASP N N 69 123.400 125.659 -2.259 1
1 879 . 17 1 1 A 70 70 ASN H H 70 8.300 9.066 -0.766 1
1 880 . 17 1 1 A 70 70 ASN HA H 70 4.160 4.362 -0.202 1
1 885 . 17 1 1 A 70 70 ASN C C 70 176.300 174.567 1.733 1
1 886 . 17 1 1 A 70 70 ASN CA C 70 54.300 54.155 0.145 1
1 887 . 17 1 1 A 70 70 ASN CB C 70 37.500 37.591 -0.091 1
1 889 . 17 1 1 A 70 70 ASN N N 70 119.800 120.869 -1.069 1
1 891 . 17 1 1 A 71 71 ALA H H 71 9.100 7.772 1.328 1
1 892 . 17 1 1 A 71 71 ALA HA H 71 4.500 4.448 0.052 1
1 896 . 17 1 1 A 71 71 ALA C C 71 175.700 176.708 -1.008 1
1 897 . 17 1 1 A 71 71 ALA CA C 71 51.900 52.433 -0.533 1
1 898 . 17 1 1 A 71 71 ALA CB C 71 19.600 19.631 -0.031 1
1 899 . 17 1 1 A 71 71 ALA N N 71 123.000 121.186 1.814 1
1 900 . 17 1 1 A 72 72 ARG H H 72 8.490 8.457 0.033 1
1 901 . 17 1 1 A 72 72 ARG HA H 72 4.720 4.745 -0.025 1
1 909 . 17 1 1 A 72 72 ARG C C 72 175.800 175.787 0.013 1
1 910 . 17 1 1 A 72 72 ARG CA C 72 54.400 55.625 -1.225 1
1 911 . 17 1 1 A 72 72 ARG CB C 72 32.700 31.357 1.343 1
1 915 . 17 1 1 A 72 72 ARG N N 72 122.500 124.611 -2.111 1
1 917 . 17 1 1 A 73 73 VAL H H 73 8.310 8.327 -0.017 1
1 918 . 17 1 1 A 73 73 VAL HA H 73 4.250 4.528 -0.278 1
1 926 . 17 1 1 A 73 73 VAL C C 73 174.600 175.469 -0.869 1
1 927 . 17 1 1 A 73 73 VAL CA C 73 62.800 61.887 0.913 1
1 928 . 17 1 1 A 73 73 VAL CB C 73 32.100 32.078 0.022 1
1 931 . 17 1 1 A 73 73 VAL N N 73 127.100 126.452 0.648 1
1 932 . 17 1 1 A 74 74 ALA H H 74 8.880 8.906 -0.026 1
1 933 . 17 1 1 A 74 74 ALA HA H 74 4.500 5.003 -0.503 1
1 937 . 17 1 1 A 74 74 ALA C C 74 174.800 174.665 0.135 1
1 938 . 17 1 1 A 74 74 ALA CA C 74 50.500 50.639 -0.139 1
1 939 . 17 1 1 A 74 74 ALA CB C 74 22.500 23.903 -1.403 1
1 940 . 17 1 1 A 74 74 ALA N N 74 131.000 128.499 2.501 1
1 941 . 17 1 1 A 75 75 GLN H H 75 8.280 8.480 -0.200 1
1 942 . 17 1 1 A 75 75 GLN HA H 75 4.910 4.970 -0.060 1
1 949 . 17 1 1 A 75 75 GLN C C 75 175.100 174.113 0.987 1
1 950 . 17 1 1 A 75 75 GLN CA C 75 54.600 53.919 0.681 1
1 951 . 17 1 1 A 75 75 GLN CB C 75 31.400 31.491 -0.091 1
1 954 . 17 1 1 A 75 75 GLN N N 75 118.800 120.544 -1.744 1
1 956 . 17 1 1 A 76 76 PHE H H 76 8.710 9.139 -0.429 1
1 957 . 17 1 1 A 76 76 PHE HA H 76 4.660 4.909 -0.249 1
1 965 . 17 1 1 A 76 76 PHE C C 76 174.900 175.486 -0.586 1
1 966 . 17 1 1 A 76 76 PHE CA C 76 57.000 56.721 0.279 1
1 967 . 17 1 1 A 76 76 PHE CB C 76 41.000 42.064 -1.064 1
1 973 . 17 1 1 A 76 76 PHE N N 76 125.000 125.272 -0.272 1
1 974 . 17 1 1 A 77 77 ASN H H 77 9.040 9.480 -0.440 1
1 975 . 17 1 1 A 77 77 ASN HA H 77 4.170 4.508 -0.338 1
1 980 . 17 1 1 A 77 77 ASN C C 77 174.200 175.676 -1.476 1
1 981 . 17 1 1 A 77 77 ASN CA C 77 53.800 54.526 -0.726 1
1 982 . 17 1 1 A 77 77 ASN CB C 77 37.400 37.535 -0.135 1
1 984 . 17 1 1 A 77 77 ASN N N 77 123.200 123.758 -0.558 1
1 986 . 17 1 1 A 78 78 GLY H H 78 8.370 8.624 -0.254 1
1 987 . 17 1 1 A 78 78 GLY HA2 H 78 3.410 3.598 -0.188 1
1 988 . 17 1 1 A 78 78 GLY HA3 H 78 3.980 3.702 0.278 1
1 989 . 17 1 1 A 78 78 GLY C C 78 173.800 173.132 0.668 1
1 990 . 17 1 1 A 78 78 GLY CA C 78 45.000 45.269 -0.269 1
1 991 . 17 1 1 A 78 78 GLY N N 78 103.300 104.727 -1.427 1
1 992 . 17 1 1 A 79 79 TYR H H 79 7.670 8.104 -0.434 1
1 993 . 17 1 1 A 79 79 TYR HA H 79 4.860 4.848 0.012 1
1 1000 . 17 1 1 A 79 79 TYR C C 79 174.800 175.584 -0.784 1
1 1001 . 17 1 1 A 79 79 TYR CA C 79 56.300 57.431 -1.131 1
1 1002 . 17 1 1 A 79 79 TYR CB C 79 40.800 40.764 0.036 1
1 1007 . 17 1 1 A 79 79 TYR N N 79 118.700 119.261 -0.561 1
1 1008 . 17 1 1 A 80 80 LEU H H 80 8.760 8.708 0.052 1
1 1009 . 17 1 1 A 80 80 LEU HA H 80 4.830 4.457 0.373 1
1 1019 . 17 1 1 A 80 80 LEU C C 80 176.200 176.194 0.006 1
1 1020 . 17 1 1 A 80 80 LEU CA C 80 54.700 54.962 -0.262 1
1 1021 . 17 1 1 A 80 80 LEU CB C 80 43.500 42.437 1.063 1
1 1025 . 17 1 1 A 80 80 LEU N N 80 122.600 126.050 -3.450 1
1 1026 . 17 1 1 A 81 81 SER H H 81 8.650 8.972 -0.322 1
1 1027 . 17 1 1 A 81 81 SER HA H 81 4.860 5.207 -0.347 1
1 1030 . 17 1 1 A 81 81 SER C C 81 172.600 172.277 0.323 1
1 1031 . 17 1 1 A 81 81 SER CA C 81 56.600 57.307 -0.707 1
1 1032 . 17 1 1 A 81 81 SER CB C 81 66.300 66.518 -0.218 1
1 1033 . 17 1 1 A 81 81 SER N N 81 114.700 117.000 -2.300 1
1 1034 . 17 1 1 A 82 82 LEU H H 82 8.680 8.659 0.021 1
1 1035 . 17 1 1 A 82 82 LEU HA H 82 5.190 5.232 -0.042 1
1 1045 . 17 1 1 A 82 82 LEU C C 82 177.100 175.340 1.760 1
1 1046 . 17 1 1 A 82 82 LEU CA C 82 53.300 53.745 -0.445 1
1 1047 . 17 1 1 A 82 82 LEU CB C 82 43.800 43.815 -0.015 1
1 1051 . 17 1 1 A 82 82 LEU N N 82 119.800 121.986 -2.186 1
1 1052 . 17 1 1 A 83 83 SER H H 83 9.560 9.415 0.145 1
1 1053 . 17 1 1 A 83 83 SER HA H 83 5.390 5.283 0.107 1
1 1056 . 17 1 1 A 83 83 SER C C 83 174.200 173.098 1.102 1
1 1057 . 17 1 1 A 83 83 SER CA C 83 57.100 56.848 0.252 1
1 1058 . 17 1 1 A 83 83 SER CB C 83 64.400 64.618 -0.218 1
1 1059 . 17 1 1 A 83 83 SER N N 83 119.000 120.663 -1.663 1
1 1060 . 17 1 1 A 84 84 VAL H H 84 9.150 9.033 0.117 1
1 1061 . 17 1 1 A 84 84 VAL HA H 84 4.490 4.639 -0.149 1
1 1069 . 17 1 1 A 84 84 VAL C C 84 174.700 175.849 -1.149 1
1 1070 . 17 1 1 A 84 84 VAL CA C 84 61.300 61.251 0.049 1
1 1071 . 17 1 1 A 84 84 VAL CB C 84 33.000 31.632 1.368 1
1 1074 . 17 1 1 A 84 84 VAL N N 84 128.300 127.218 1.082 1
1 1075 . 17 1 1 A 85 85 GLY H H 85 7.970 8.830 -0.860 1
1 1076 . 17 1 1 A 85 85 GLY HA2 H 85 4.030 4.357 -0.327 1
1 1077 . 17 1 1 A 85 85 GLY HA3 H 85 4.840 4.464 0.376 1
1 1078 . 17 1 1 A 85 85 GLY C C 85 175.800 175.106 0.694 1
1 1079 . 17 1 1 A 85 85 GLY CA C 85 44.800 44.181 0.619 1
1 1080 . 17 1 1 A 85 85 GLY N N 85 114.300 115.349 -1.049 1
1 1081 . 17 1 1 A 86 86 ASP H H 86 8.860 8.765 0.095 1
1 1082 . 17 1 1 A 86 86 ASP HA H 86 4.370 4.403 -0.033 1
1 1085 . 17 1 1 A 86 86 ASP C C 86 177.400 177.413 -0.013 1
1 1086 . 17 1 1 A 86 86 ASP CA C 86 57.400 56.147 1.253 1
1 1087 . 17 1 1 A 86 86 ASP CB C 86 40.600 40.380 0.220 1
1 1088 . 17 1 1 A 86 86 ASP N N 86 122.500 119.607 2.893 1
1 1089 . 17 1 1 A 87 87 SER H H 87 8.540 7.877 0.663 1
1 1090 . 17 1 1 A 87 87 SER HA H 87 4.620 4.503 0.117 1
1 1093 . 17 1 1 A 87 87 SER C C 87 174.700 174.235 0.465 1
1 1094 . 17 1 1 A 87 87 SER CA C 87 58.200 59.000 -0.800 1
1 1095 . 17 1 1 A 87 87 SER CB C 87 63.300 63.905 -0.605 1
1 1096 . 17 1 1 A 87 87 SER N N 87 112.100 113.409 -1.309 1
1 1097 . 17 1 1 A 88 88 SER H H 88 7.880 7.538 0.342 1
1 1098 . 17 1 1 A 88 88 SER HA H 88 5.050 4.504 0.546 1
1 1101 . 17 1 1 A 88 88 SER C C 88 172.700 173.632 -0.932 1
1 1102 . 17 1 1 A 88 88 SER CA C 88 57.600 57.909 -0.309 1
1 1103 . 17 1 1 A 88 88 SER CB C 88 64.300 64.741 -0.441 1
1 1104 . 17 1 1 A 88 88 SER N N 88 119.200 117.504 1.696 1
1 1105 . 17 1 1 A 89 89 ARG H H 89 8.350 8.335 0.015 1
1 1106 . 17 1 1 A 89 89 ARG HA H 89 4.720 5.228 -0.508 1
1 1114 . 17 1 1 A 89 89 ARG C C 89 174.200 174.884 -0.684 1
1 1115 . 17 1 1 A 89 89 ARG CA C 89 55.000 54.483 0.517 1
1 1116 . 17 1 1 A 89 89 ARG CB C 89 33.500 34.190 -0.690 1
1 1120 . 17 1 1 A 89 89 ARG N N 89 122.800 122.433 0.367 1
1 1122 . 17 1 1 A 90 90 ILE H H 90 8.530 9.063 -0.533 1
1 1123 . 17 1 1 A 90 90 ILE HA H 90 4.790 4.877 -0.087 1
1 1133 . 17 1 1 A 90 90 ILE C C 90 175.400 174.384 1.016 1
1 1134 . 17 1 1 A 90 90 ILE CA C 90 60.600 60.140 0.460 1
1 1135 . 17 1 1 A 90 90 ILE CB C 90 40.600 40.607 -0.007 1
1 1139 . 17 1 1 A 90 90 ILE N N 90 123.100 123.264 -0.164 1
1 1140 . 17 1 1 A 91 91 GLU H H 91 9.000 9.097 -0.097 1
1 1141 . 17 1 1 A 91 91 GLU HA H 91 4.730 4.984 -0.254 1
1 1146 . 17 1 1 A 91 91 GLU C C 91 175.100 175.390 -0.290 1
1 1147 . 17 1 1 A 91 91 GLU CA C 91 54.300 54.496 -0.196 1
1 1148 . 17 1 1 A 91 91 GLU CB C 91 32.400 32.592 -0.192 1
1 1150 . 17 1 1 A 91 91 GLU N N 91 126.400 128.535 -2.135 1
1 1151 . 17 1 1 A 92 92 SER H H 92 8.830 8.857 -0.027 1
1 1152 . 17 1 1 A 92 92 SER HA H 92 4.700 4.647 0.053 1
1 1155 . 17 1 1 A 92 92 SER C C 92 174.600 174.185 0.415 1
1 1156 . 17 1 1 A 92 92 SER CA C 92 59.300 58.653 0.647 1
1 1157 . 17 1 1 A 92 92 SER CB C 92 63.100 63.820 -0.720 1
1 1158 . 17 1 1 A 92 92 SER N N 92 119.800 123.361 -3.561 1
1 1159 . 17 1 1 A 93 93 VAL H H 93 8.350 8.361 -0.011 1
1 1160 . 17 1 1 A 93 93 VAL HA H 93 4.290 4.684 -0.394 1
1 1168 . 17 1 1 A 93 93 VAL C C 93 175.100 175.341 -0.241 1
1 1169 . 17 1 1 A 93 93 VAL CA C 93 61.300 61.306 -0.006 1
1 1170 . 17 1 1 A 93 93 VAL CB C 93 33.900 33.993 -0.093 1
1 1173 . 17 1 1 A 93 93 VAL N N 93 121.800 124.659 -2.859 1
1 1174 . 17 1 1 A 94 94 ASN H H 94 8.510 8.758 -0.248 1
1 1175 . 17 1 1 A 94 94 ASN HA H 94 4.770 4.932 -0.162 1
1 1180 . 17 1 1 A 94 94 ASN C C 94 175.000 175.011 -0.011 1
1 1181 . 17 1 1 A 94 94 ASN CA C 94 52.700 53.827 -1.127 1
1 1182 . 17 1 1 A 94 94 ASN CB C 94 38.500 41.594 -3.094 1
1 1184 . 17 1 1 A 94 94 ASN N N 94 121.800 124.757 -2.957 1
1 1186 . 17 1 1 A 95 95 VAL H H 95 7.860 8.079 -0.219 1
1 1187 . 17 1 1 A 95 95 VAL HA H 95 4.100 4.111 -0.011 1
1 1195 . 17 1 1 A 95 95 VAL C C 95 175.100 175.811 -0.711 1
1 1196 . 17 1 1 A 95 95 VAL CA C 95 61.700 63.969 -2.269 1
1 1197 . 17 1 1 A 95 95 VAL CB C 95 33.100 30.580 2.520 1
1 1200 . 17 1 1 A 95 95 VAL N N 95 119.700 117.352 2.348 1
1 1201 . 17 1 1 A 96 96 ASN H H 96 8.490 9.108 -0.618 1
1 1202 . 17 1 1 A 96 96 ASN HA H 96 4.700 4.364 0.336 1
1 1207 . 17 1 1 A 96 96 ASN C C 96 174.600 174.688 -0.088 1
1 1208 . 17 1 1 A 96 96 ASN CA C 96 53.000 53.753 -0.753 1
1 1209 . 17 1 1 A 96 96 ASN CB C 96 39.000 37.451 1.549 1
1 1211 . 17 1 1 A 96 96 ASN N N 96 122.200 123.483 -1.283 1
1 1213 . 17 1 1 A 97 97 ILE H H 97 8.080 8.577 -0.497 1
1 1214 . 17 1 1 A 97 97 ILE HA H 97 4.370 3.855 0.515 1
1 1224 . 17 1 1 A 97 97 ILE CA C 97 58.600 62.056 -3.456 1
1 1225 . 17 1 1 A 97 97 ILE CB C 97 38.600 35.699 2.901 1
1 1229 . 17 1 1 A 97 97 ILE N N 97 123.500 123.695 -0.195 1
1 1230 . 17 1 1 A 98 98 PRO HA H 98 4.360 4.408 -0.048 1
1 1237 . 17 1 1 A 98 98 PRO C C 98 176.600 176.618 -0.018 1
1 1238 . 17 1 1 A 98 98 PRO CA C 98 63.100 63.402 -0.302 1
1 1239 . 17 1 1 A 98 98 PRO CB C 98 31.800 32.201 -0.401 1
1 1242 . 17 1 1 A 99 99 LEU H H 99 8.200 8.506 -0.306 1
1 1243 . 17 1 1 A 99 99 LEU HA H 99 4.200 4.022 0.178 1
1 1253 . 17 1 1 A 99 99 LEU C C 99 177.300 175.994 1.306 1
1 1254 . 17 1 1 A 99 99 LEU CA C 99 55.000 55.720 -0.720 1
1 1255 . 17 1 1 A 99 99 LEU CB C 99 42.400 40.964 1.436 1
1 1259 . 17 1 1 A 99 99 LEU N N 99 122.500 117.673 4.827 1
1 1260 . 17 1 1 A 100 100 GLU H H 100 8.250 8.546 -0.296 1
1 1261 . 17 1 1 A 100 100 GLU HA H 100 4.140 4.221 -0.081 1
1 1266 . 17 1 1 A 100 100 GLU C C 100 176.100 177.341 -1.241 1
1 1267 . 17 1 1 A 100 100 GLU CA C 100 56.100 57.181 -1.081 1
1 1268 . 17 1 1 A 100 100 GLU CB C 100 29.900 29.895 0.005 1
1 1270 . 17 1 1 A 100 100 GLU N N 100 121.000 123.441 -2.441 1
1 1271 . 17 1 1 A 101 101 HIS H H 101 8.540 8.905 -0.365 1
1 1272 . 17 1 1 A 101 101 HIS HA H 101 4.600 4.174 0.426 1
1 1275 . 17 1 1 A 101 101 HIS C C 101 174.200 175.120 -0.920 1
1 1276 . 17 1 1 A 101 101 HIS CA C 101 55.200 58.486 -3.286 1
1 1277 . 17 1 1 A 101 101 HIS CB C 101 29.000 28.597 0.403 1
1 1278 . 17 1 1 A 101 101 HIS N N 101 119.400 117.539 1.861 1
1 1279 . 17 1 1 A 102 102 HIS H H 102 8.660 8.573 0.087 1
1 1280 . 17 1 1 A 102 102 HIS HA H 102 4.630 4.209 0.421 1
1 1283 . 17 1 1 A 102 102 HIS C C 102 174.200 174.838 -0.638 1
1 1284 . 17 1 1 A 102 102 HIS CA C 102 55.200 56.724 -1.524 1
1 1285 . 17 1 1 A 102 102 HIS CB C 102 29.100 28.116 0.984 1
1 1286 . 17 1 1 A 102 102 HIS N N 102 119.700 117.774 1.926 1
1 1287 . 17 1 1 A 103 103 HIS H H 103 8.680 8.018 0.662 1
1 1288 . 17 1 1 A 103 103 HIS HA H 103 4.640 4.288 0.352 1
1 1291 . 17 1 1 A 103 103 HIS C C 103 174.200 174.970 -0.770 1
1 1292 . 17 1 1 A 103 103 HIS CA C 103 55.200 55.673 -0.473 1
1 1293 . 17 1 1 A 103 103 HIS CB C 103 29.200 31.248 -2.048 1
1 1294 . 17 1 1 A 103 103 HIS N N 103 120.500 124.272 -3.772 1
1 1295 . 17 1 1 A 104 104 HIS H H 104 8.580 7.201 1.379 1
1 1296 . 17 1 1 A 104 104 HIS HA H 104 4.590 3.880 0.710 1
1 1299 . 17 1 1 A 104 104 HIS C C 104 174.200 174.989 -0.789 1
1 1300 . 17 1 1 A 104 104 HIS CA C 104 55.200 55.868 -0.668 1
1 1301 . 17 1 1 A 104 104 HIS CB C 104 29.300 27.894 1.406 1
1 1302 . 17 1 1 A 104 104 HIS N N 104 120.700 117.450 3.250 1
1 1303 . 17 1 1 A 105 105 HIS H H 105 8.550 7.770 0.780 1
1 1304 . 17 1 1 A 105 105 HIS HA H 105 4.610 4.133 0.477 1
1 1307 . 17 1 1 A 105 105 HIS C C 105 173.500 178.175 -4.675 1
1 1308 . 17 1 1 A 105 105 HIS CA C 105 55.400 59.582 -4.182 1
1 1309 . 17 1 1 A 105 105 HIS CB C 105 28.800 29.820 -1.020 1
1 1310 . 17 1 1 A 105 105 HIS N N 105 119.000 120.343 -1.343 1
1 7 . 18 1 1 A 2 2 ASP H H 2 8.890 8.333 0.557 1
1 8 . 18 1 1 A 2 2 ASP HA H 2 4.740 4.758 -0.018 1
1 11 . 18 1 1 A 2 2 ASP C C 2 174.600 175.257 -0.657 1
1 12 . 18 1 1 A 2 2 ASP CA C 2 53.800 54.038 -0.238 1
1 13 . 18 1 1 A 2 2 ASP CB C 2 41.500 41.865 -0.365 1
1 14 . 18 1 1 A 2 2 ASP N N 2 122.100 126.380 -4.280 1
1 15 . 18 1 1 A 3 3 LEU H H 3 8.280 8.342 -0.062 1
1 16 . 18 1 1 A 3 3 LEU HA H 3 4.420 4.913 -0.493 1
1 26 . 18 1 1 A 3 3 LEU C C 3 176.900 176.131 0.769 1
1 27 . 18 1 1 A 3 3 LEU CA C 3 55.000 55.141 -0.141 1
1 28 . 18 1 1 A 3 3 LEU CB C 3 42.700 42.748 -0.048 1
1 32 . 18 1 1 A 3 3 LEU N N 3 122.300 126.212 -3.912 1
1 33 . 18 1 1 A 4 4 VAL H H 4 8.640 8.730 -0.090 1
1 34 . 18 1 1 A 4 4 VAL HA H 4 4.540 5.000 -0.460 1
1 42 . 18 1 1 A 4 4 VAL C C 4 175.800 175.013 0.787 1
1 43 . 18 1 1 A 4 4 VAL CA C 4 59.400 58.593 0.807 1
1 44 . 18 1 1 A 4 4 VAL CB C 4 35.400 35.803 -0.403 1
1 47 . 18 1 1 A 4 4 VAL N N 4 122.600 119.064 3.536 1
1 48 . 18 1 1 A 5 5 LYS H H 5 8.630 8.769 -0.139 1
1 49 . 18 1 1 A 5 5 LYS HA H 5 4.450 4.498 -0.048 1
1 58 . 18 1 1 A 5 5 LYS C C 5 179.400 178.536 0.864 1
1 59 . 18 1 1 A 5 5 LYS CA C 5 53.600 55.383 -1.783 1
1 60 . 18 1 1 A 5 5 LYS CB C 5 30.900 33.307 -2.407 1
1 64 . 18 1 1 A 5 5 LYS N N 5 121.100 121.304 -0.204 1
1 65 . 18 1 1 A 6 6 ILE H H 6 10.320 8.818 1.502 1
1 66 . 18 1 1 A 6 6 ILE HA H 6 3.440 3.707 -0.267 1
1 76 . 18 1 1 A 6 6 ILE C C 6 178.300 177.869 0.431 1
1 77 . 18 1 1 A 6 6 ILE CA C 6 65.700 65.139 0.561 1
1 78 . 18 1 1 A 6 6 ILE CB C 6 35.900 37.589 -1.689 1
1 82 . 18 1 1 A 6 6 ILE N N 6 125.400 122.687 2.713 1
1 83 . 18 1 1 A 7 7 ARG H H 7 8.210 8.179 0.031 1
1 84 . 18 1 1 A 7 7 ARG HA H 7 3.850 4.245 -0.395 1
1 92 . 18 1 1 A 7 7 ARG C C 7 175.600 176.821 -1.221 1
1 93 . 18 1 1 A 7 7 ARG CA C 7 57.800 58.668 -0.868 1
1 94 . 18 1 1 A 7 7 ARG CB C 7 30.300 29.974 0.326 1
1 98 . 18 1 1 A 7 7 ARG N N 7 118.800 120.863 -2.063 1
1 100 . 18 1 1 A 8 8 ASP H H 8 7.850 7.721 0.129 1
1 101 . 18 1 1 A 8 8 ASP HA H 8 4.700 4.733 -0.033 1
1 104 . 18 1 1 A 8 8 ASP C C 8 176.100 176.473 -0.373 1
1 105 . 18 1 1 A 8 8 ASP CA C 8 54.100 54.296 -0.196 1
1 106 . 18 1 1 A 8 8 ASP CB C 8 41.200 41.491 -0.291 1
1 107 . 18 1 1 A 8 8 ASP N N 8 116.800 117.658 -0.858 1
1 108 . 18 1 1 A 9 9 VAL H H 9 7.240 7.135 0.105 1
1 109 . 18 1 1 A 9 9 VAL HA H 9 3.710 3.930 -0.220 1
1 117 . 18 1 1 A 9 9 VAL C C 9 174.900 175.710 -0.810 1
1 118 . 18 1 1 A 9 9 VAL CA C 9 64.300 63.228 1.072 1
1 119 . 18 1 1 A 9 9 VAL CB C 9 31.500 31.634 -0.134 1
1 122 . 18 1 1 A 9 9 VAL N N 9 121.800 122.349 -0.549 1
1 123 . 18 1 1 A 10 10 SER H H 10 8.600 8.507 0.093 1
1 124 . 18 1 1 A 10 10 SER HA H 10 4.600 4.692 -0.092 1
1 127 . 18 1 1 A 10 10 SER CA C 10 56.700 56.925 -0.225 1
1 128 . 18 1 1 A 10 10 SER CB C 10 66.100 65.407 0.693 1
1 129 . 18 1 1 A 10 10 SER N N 10 122.200 120.536 1.664 1
1 130 . 18 1 1 A 11 11 LEU H H 11 8.660 8.937 -0.277 1
1 131 . 18 1 1 A 11 11 LEU HA H 11 3.900 4.107 -0.207 1
1 141 . 18 1 1 A 11 11 LEU C C 11 178.100 178.745 -0.645 1
1 142 . 18 1 1 A 11 11 LEU CA C 11 56.700 56.846 -0.146 1
1 143 . 18 1 1 A 11 11 LEU CB C 11 41.400 41.551 -0.151 1
1 147 . 18 1 1 A 11 11 LEU N N 11 120.300 122.938 -2.638 1
1 148 . 18 1 1 A 12 12 SER H H 12 8.160 7.767 0.393 1
1 149 . 18 1 1 A 12 12 SER HA H 12 4.270 4.268 0.002 1
1 152 . 18 1 1 A 12 12 SER C C 12 174.200 174.905 -0.705 1
1 153 . 18 1 1 A 12 12 SER CA C 12 59.900 60.978 -1.078 1
1 154 . 18 1 1 A 12 12 SER CB C 12 63.100 63.200 -0.100 1
1 155 . 18 1 1 A 12 12 SER N N 12 112.100 113.959 -1.859 1
1 156 . 18 1 1 A 13 13 THR H H 13 7.460 7.369 0.091 1
1 157 . 18 1 1 A 13 13 THR HA H 13 4.760 4.709 0.051 1
1 162 . 18 1 1 A 13 13 THR CA C 13 56.600 59.002 -2.402 1
1 163 . 18 1 1 A 13 13 THR CB C 13 70.100 69.011 1.089 1
1 165 . 18 1 1 A 13 13 THR N N 13 114.700 112.233 2.467 1
1 166 . 18 1 1 A 14 14 PRO HA H 14 4.050 4.245 -0.195 1
1 173 . 18 1 1 A 14 14 PRO C C 14 175.800 175.970 -0.170 1
1 174 . 18 1 1 A 14 14 PRO CA C 14 65.100 64.819 0.281 1
1 175 . 18 1 1 A 14 14 PRO CB C 14 32.100 31.484 0.616 1
1 178 . 18 1 1 A 15 15 TYR H H 15 7.380 7.687 -0.307 1
1 179 . 18 1 1 A 15 15 TYR HA H 15 5.570 5.675 -0.105 1
1 186 . 18 1 1 A 15 15 TYR C C 15 176.100 175.026 1.074 1
1 187 . 18 1 1 A 15 15 TYR CA C 15 56.400 56.804 -0.404 1
1 188 . 18 1 1 A 15 15 TYR CB C 15 41.500 41.563 -0.063 1
1 193 . 18 1 1 A 15 15 TYR N N 15 113.800 117.065 -3.265 1
1 194 . 18 1 1 A 16 16 VAL H H 16 9.010 8.745 0.265 1
1 195 . 18 1 1 A 16 16 VAL HA H 16 4.920 5.018 -0.098 1
1 203 . 18 1 1 A 16 16 VAL C C 16 174.300 173.751 0.549 1
1 204 . 18 1 1 A 16 16 VAL CA C 16 59.600 59.354 0.246 1
1 205 . 18 1 1 A 16 16 VAL CB C 16 36.800 36.038 0.762 1
1 208 . 18 1 1 A 16 16 VAL N N 16 113.800 117.657 -3.857 1
1 209 . 18 1 1 A 17 17 SER H H 17 7.960 8.712 -0.752 1
1 210 . 18 1 1 A 17 17 SER HA H 17 5.860 5.759 0.101 1
1 213 . 18 1 1 A 17 17 SER C C 17 172.700 174.038 -1.338 1
1 214 . 18 1 1 A 17 17 SER CA C 17 57.300 56.417 0.883 1
1 215 . 18 1 1 A 17 17 SER CB C 17 64.000 65.909 -1.909 1
1 216 . 18 1 1 A 17 17 SER N N 17 117.100 115.247 1.853 1
1 217 . 18 1 1 A 18 18 VAL H H 18 8.570 8.802 -0.232 1
1 218 . 18 1 1 A 18 18 VAL HA H 18 4.900 5.167 -0.267 1
1 226 . 18 1 1 A 18 18 VAL C C 18 173.700 174.731 -1.031 1
1 227 . 18 1 1 A 18 18 VAL CA C 18 58.800 59.075 -0.275 1
1 228 . 18 1 1 A 18 18 VAL CB C 18 36.700 35.987 0.713 1
1 231 . 18 1 1 A 18 18 VAL N N 18 113.500 118.618 -5.118 1
1 232 . 18 1 1 A 19 19 ILE H H 19 8.490 8.523 -0.033 1
1 233 . 18 1 1 A 19 19 ILE HA H 19 5.300 5.045 0.255 1
1 243 . 18 1 1 A 19 19 ILE C C 19 175.800 175.728 0.072 1
1 244 . 18 1 1 A 19 19 ILE CA C 19 59.700 59.702 -0.002 1
1 245 . 18 1 1 A 19 19 ILE CB C 19 41.700 41.648 0.052 1
1 249 . 18 1 1 A 19 19 ILE N N 19 120.600 121.812 -1.212 1
1 250 . 18 1 1 A 20 20 GLY H H 20 8.670 7.648 1.022 1
1 251 . 18 1 1 A 20 20 GLY HA2 H 20 3.760 4.195 -0.435 1
1 252 . 18 1 1 A 20 20 GLY HA3 H 20 4.190 4.198 -0.008 1
1 253 . 18 1 1 A 20 20 GLY C C 20 169.900 171.297 -1.397 1
1 254 . 18 1 1 A 20 20 GLY CA C 20 46.000 45.868 0.132 1
1 255 . 18 1 1 A 20 20 GLY N N 20 110.200 112.039 -1.839 1
1 256 . 18 1 1 A 21 21 LYS H H 21 8.920 8.231 0.689 1
1 257 . 18 1 1 A 21 21 LYS HA H 21 5.210 5.049 0.161 1
1 266 . 18 1 1 A 21 21 LYS C C 21 176.400 175.069 1.331 1
1 267 . 18 1 1 A 21 21 LYS CA C 21 54.400 54.846 -0.446 1
1 268 . 18 1 1 A 21 21 LYS CB C 21 35.400 34.989 0.411 1
1 272 . 18 1 1 A 21 21 LYS N N 21 119.100 120.508 -1.408 1
1 273 . 18 1 1 A 22 22 ILE H H 22 8.900 8.503 0.397 1
1 274 . 18 1 1 A 22 22 ILE HA H 22 5.050 4.952 0.098 1
1 284 . 18 1 1 A 22 22 ILE C C 22 176.900 175.383 1.517 1
1 285 . 18 1 1 A 22 22 ILE CA C 22 57.800 61.032 -3.232 1
1 286 . 18 1 1 A 22 22 ILE CB C 22 36.200 38.650 -2.450 1
1 290 . 18 1 1 A 22 22 ILE N N 22 130.000 128.484 1.516 1
1 291 . 18 1 1 A 23 23 THR H H 23 9.020 8.766 0.254 1
1 292 . 18 1 1 A 23 23 THR HA H 23 4.660 4.985 -0.325 1
1 297 . 18 1 1 A 23 23 THR C C 23 174.000 173.988 0.012 1
1 298 . 18 1 1 A 23 23 THR CA C 23 60.800 59.899 0.901 1
1 299 . 18 1 1 A 23 23 THR CB C 23 73.400 71.953 1.447 1
1 301 . 18 1 1 A 23 23 THR N N 23 118.200 117.944 0.256 1
1 302 . 18 1 1 A 24 24 GLY H H 24 8.430 8.739 -0.309 1
1 303 . 18 1 1 A 24 24 GLY HA2 H 24 3.910 3.951 -0.041 1
1 304 . 18 1 1 A 24 24 GLY HA3 H 24 3.910 3.985 -0.075 1
1 305 . 18 1 1 A 24 24 GLY C C 24 175.400 174.949 0.451 1
1 306 . 18 1 1 A 24 24 GLY CA C 24 47.100 47.034 0.066 1
1 307 . 18 1 1 A 24 24 GLY N N 24 107.200 111.706 -4.506 1
1 308 . 18 1 1 A 25 25 ILE H H 25 9.370 8.190 1.180 1
1 309 . 18 1 1 A 25 25 ILE HA H 25 4.480 4.323 0.157 1
1 319 . 18 1 1 A 25 25 ILE C C 25 178.200 175.626 2.574 1
1 320 . 18 1 1 A 25 25 ILE CA C 25 59.200 61.270 -2.070 1
1 321 . 18 1 1 A 25 25 ILE CB C 25 35.400 38.124 -2.724 1
1 325 . 18 1 1 A 25 25 ILE N N 25 120.600 120.565 0.035 1
1 326 . 18 1 1 A 26 26 HIS H H 26 9.000 9.150 -0.150 1
1 327 . 18 1 1 A 26 26 HIS HA H 26 4.770 5.381 -0.611 1
1 330 . 18 1 1 A 26 26 HIS C C 26 172.700 172.500 0.200 1
1 331 . 18 1 1 A 26 26 HIS CA C 26 55.000 54.392 0.608 1
1 332 . 18 1 1 A 26 26 HIS CB C 26 31.100 33.381 -2.281 1
1 333 . 18 1 1 A 26 26 HIS N N 26 123.800 127.367 -3.567 1
1 334 . 18 1 1 A 27 27 LYS H H 27 8.930 8.458 0.472 1
1 335 . 18 1 1 A 27 27 LYS HA H 27 4.770 4.613 0.157 1
1 344 . 18 1 1 A 27 27 LYS C C 27 175.300 174.556 0.744 1
1 345 . 18 1 1 A 27 27 LYS CA C 27 55.100 54.530 0.570 1
1 346 . 18 1 1 A 27 27 LYS CB C 27 34.400 34.524 -0.124 1
1 350 . 18 1 1 A 27 27 LYS N N 27 125.900 127.563 -1.663 1
1 351 . 18 1 1 A 28 28 LYS H H 28 8.880 8.574 0.306 1
1 352 . 18 1 1 A 28 28 LYS HA H 28 4.570 4.915 -0.345 1
1 361 . 18 1 1 A 28 28 LYS C C 28 174.500 174.445 0.055 1
1 362 . 18 1 1 A 28 28 LYS CA C 28 54.600 54.882 -0.282 1
1 363 . 18 1 1 A 28 28 LYS CB C 28 35.300 36.694 -1.394 1
1 367 . 18 1 1 A 28 28 LYS N N 28 127.400 125.930 1.470 1
1 368 . 18 1 1 A 29 29 GLU H H 29 8.440 8.771 -0.331 1
1 369 . 18 1 1 A 29 29 GLU HA H 29 5.260 5.390 -0.130 1
1 374 . 18 1 1 A 29 29 GLU C C 29 175.800 174.669 1.131 1
1 375 . 18 1 1 A 29 29 GLU CA C 29 54.800 54.675 0.125 1
1 376 . 18 1 1 A 29 29 GLU CB C 29 31.500 33.617 -2.117 1
1 378 . 18 1 1 A 29 29 GLU N N 29 122.200 122.083 0.117 1
1 379 . 18 1 1 A 30 30 TYR H H 30 8.960 8.709 0.251 1
1 380 . 18 1 1 A 30 30 TYR HA H 30 4.820 5.239 -0.419 1
1 387 . 18 1 1 A 30 30 TYR C C 30 172.600 173.260 -0.660 1
1 388 . 18 1 1 A 30 30 TYR CA C 30 56.300 55.722 0.578 1
1 389 . 18 1 1 A 30 30 TYR CB C 30 40.500 41.250 -0.750 1
1 394 . 18 1 1 A 30 30 TYR N N 30 121.100 117.339 3.761 1
1 395 . 18 1 1 A 31 31 GLU H H 31 8.610 8.519 0.091 1
1 396 . 18 1 1 A 31 31 GLU HA H 31 4.810 4.384 0.426 1
1 401 . 18 1 1 A 31 31 GLU C C 31 176.100 175.285 0.815 1
1 402 . 18 1 1 A 31 31 GLU CA C 31 55.100 56.069 -0.969 1
1 403 . 18 1 1 A 31 31 GLU CB C 31 30.300 30.143 0.157 1
1 405 . 18 1 1 A 31 31 GLU N N 31 121.800 120.135 1.665 1
1 406 . 18 1 1 A 32 32 SER H H 32 8.570 9.315 -0.745 1
1 407 . 18 1 1 A 32 32 SER HA H 32 4.520 4.747 -0.227 1
1 410 . 18 1 1 A 32 32 SER C C 32 174.300 173.397 0.903 1
1 411 . 18 1 1 A 32 32 SER CA C 32 57.300 57.554 -0.254 1
1 412 . 18 1 1 A 32 32 SER CB C 32 64.100 66.126 -2.026 1
1 413 . 18 1 1 A 32 32 SER N N 32 118.500 116.227 2.273 1
1 414 . 18 1 1 A 33 33 ASP H H 33 9.290 9.418 -0.128 1
1 415 . 18 1 1 A 33 33 ASP HA H 33 4.340 4.272 0.068 1
1 418 . 18 1 1 A 33 33 ASP C C 33 175.900 175.426 0.474 1
1 419 . 18 1 1 A 33 33 ASP CA C 33 55.000 55.004 -0.004 1
1 420 . 18 1 1 A 33 33 ASP CB C 33 39.300 39.765 -0.465 1
1 421 . 18 1 1 A 33 33 ASP N N 33 125.700 128.441 -2.741 1
1 422 . 18 1 1 A 34 34 GLY H H 34 8.690 8.632 0.058 1
1 423 . 18 1 1 A 34 34 GLY HA2 H 34 3.660 3.814 -0.154 1
1 424 . 18 1 1 A 34 34 GLY HA3 H 34 4.140 3.816 0.324 1
1 425 . 18 1 1 A 34 34 GLY C C 34 174.200 173.525 0.675 1
1 426 . 18 1 1 A 34 34 GLY CA C 34 45.600 45.662 -0.062 1
1 427 . 18 1 1 A 34 34 GLY N N 34 104.800 104.412 0.388 1
1 428 . 18 1 1 A 35 35 THR H H 35 7.840 7.751 0.089 1
1 429 . 18 1 1 A 35 35 THR HA H 35 4.660 4.928 -0.268 1
1 434 . 18 1 1 A 35 35 THR C C 35 173.000 173.054 -0.054 1
1 435 . 18 1 1 A 35 35 THR CA C 35 60.200 59.200 1.000 1
1 436 . 18 1 1 A 35 35 THR CB C 35 71.200 72.802 -1.602 1
1 438 . 18 1 1 A 35 35 THR N N 35 114.800 109.705 5.095 1
1 439 . 18 1 1 A 36 36 THR H H 36 8.480 8.806 -0.326 1
1 440 . 18 1 1 A 36 36 THR HA H 36 4.620 4.637 -0.017 1
1 445 . 18 1 1 A 36 36 THR C C 36 173.800 174.024 -0.224 1
1 446 . 18 1 1 A 36 36 THR CA C 36 62.300 62.426 -0.126 1
1 447 . 18 1 1 A 36 36 THR CB C 36 69.500 69.454 0.046 1
1 449 . 18 1 1 A 36 36 THR N N 36 119.400 118.463 0.937 1
1 450 . 18 1 1 A 37 37 LYS H H 37 8.880 8.561 0.319 1
1 451 . 18 1 1 A 37 37 LYS HA H 37 4.570 4.734 -0.164 1
1 460 . 18 1 1 A 37 37 LYS C C 37 174.500 175.629 -1.129 1
1 461 . 18 1 1 A 37 37 LYS CA C 37 54.600 54.360 0.240 1
1 462 . 18 1 1 A 37 37 LYS CB C 37 35.500 35.414 0.086 1
1 466 . 18 1 1 A 37 37 LYS N N 37 128.000 126.362 1.638 1
1 467 . 18 1 1 A 38 38 SER H H 38 8.370 8.781 -0.411 1
1 468 . 18 1 1 A 38 38 SER HA H 38 5.250 4.818 0.432 1
1 471 . 18 1 1 A 38 38 SER C C 38 173.200 173.595 -0.395 1
1 472 . 18 1 1 A 38 38 SER CA C 38 57.900 58.583 -0.683 1
1 473 . 18 1 1 A 38 38 SER CB C 38 65.500 63.906 1.594 1
1 474 . 18 1 1 A 38 38 SER N N 38 114.300 118.982 -4.682 1
1 475 . 18 1 1 A 39 39 VAL H H 39 9.020 8.954 0.066 1
1 476 . 18 1 1 A 39 39 VAL HA H 39 4.900 5.000 -0.100 1
1 484 . 18 1 1 A 39 39 VAL C C 39 173.200 172.872 0.328 1
1 485 . 18 1 1 A 39 39 VAL CA C 39 59.200 59.709 -0.509 1
1 486 . 18 1 1 A 39 39 VAL CB C 39 34.600 35.578 -0.978 1
1 489 . 18 1 1 A 39 39 VAL N N 39 123.600 121.866 1.734 1
1 490 . 18 1 1 A 40 40 TYR H H 40 8.900 8.876 0.024 1
1 491 . 18 1 1 A 40 40 TYR HA H 40 4.730 5.125 -0.395 1
1 498 . 18 1 1 A 40 40 TYR CA C 40 56.500 56.947 -0.447 1
1 499 . 18 1 1 A 40 40 TYR CB C 40 39.000 40.447 -1.447 1
1 504 . 18 1 1 A 40 40 TYR N N 40 126.300 127.557 -1.257 1
1 505 . 18 1 1 A 41 41 GLN H H 41 8.630 9.145 -0.515 1
1 506 . 18 1 1 A 41 41 GLN HA H 41 5.330 5.396 -0.066 1
1 513 . 18 1 1 A 41 41 GLN C C 41 175.500 175.681 -0.181 1
1 514 . 18 1 1 A 41 41 GLN CA C 41 53.800 54.243 -0.443 1
1 515 . 18 1 1 A 41 41 GLN CB C 41 32.100 32.178 -0.078 1
1 518 . 18 1 1 A 41 41 GLN N N 41 122.000 121.708 0.292 1
1 520 . 18 1 1 A 42 42 GLY H H 42 8.560 7.885 0.675 1
1 521 . 18 1 1 A 42 42 GLY HA2 H 42 3.680 4.245 -0.565 1
1 522 . 18 1 1 A 42 42 GLY HA3 H 42 4.020 4.260 -0.240 1
1 523 . 18 1 1 A 42 42 GLY C C 42 171.600 171.165 0.435 1
1 524 . 18 1 1 A 42 42 GLY CA C 42 47.300 46.106 1.194 1
1 525 . 18 1 1 A 42 42 GLY N N 42 113.000 108.429 4.571 1
1 526 . 18 1 1 A 43 43 TYR H H 43 9.320 8.309 1.011 1
1 527 . 18 1 1 A 43 43 TYR HA H 43 5.280 5.429 -0.149 1
1 534 . 18 1 1 A 43 43 TYR C C 43 173.200 174.337 -1.137 1
1 535 . 18 1 1 A 43 43 TYR CA C 43 57.600 56.437 1.163 1
1 536 . 18 1 1 A 43 43 TYR CB C 43 42.400 42.081 0.319 1
1 541 . 18 1 1 A 43 43 TYR N N 43 126.300 118.925 7.375 1
1 542 . 18 1 1 A 44 44 ILE H H 44 9.160 8.745 0.415 1
1 543 . 18 1 1 A 44 44 ILE HA H 44 5.270 5.421 -0.151 1
1 553 . 18 1 1 A 44 44 ILE C C 44 172.900 174.357 -1.457 1
1 554 . 18 1 1 A 44 44 ILE CA C 44 59.000 59.663 -0.663 1
1 555 . 18 1 1 A 44 44 ILE CB C 44 42.200 42.035 0.165 1
1 559 . 18 1 1 A 44 44 ILE N N 44 117.700 122.698 -4.998 1
1 560 . 18 1 1 A 45 45 GLU H H 45 8.420 8.870 -0.450 1
1 561 . 18 1 1 A 45 45 GLU HA H 45 5.600 5.293 0.307 1
1 566 . 18 1 1 A 45 45 GLU C C 45 174.300 174.068 0.232 1
1 567 . 18 1 1 A 45 45 GLU CA C 45 54.000 54.283 -0.283 1
1 568 . 18 1 1 A 45 45 GLU CB C 45 34.400 34.099 0.301 1
1 570 . 18 1 1 A 45 45 GLU N N 45 123.600 127.306 -3.706 1
1 571 . 18 1 1 A 46 46 ASP H H 46 8.530 8.599 -0.069 1
1 572 . 18 1 1 A 46 46 ASP HA H 46 5.070 4.949 0.121 1
1 575 . 18 1 1 A 46 46 ASP C C 46 175.000 175.151 -0.151 1
1 576 . 18 1 1 A 46 46 ASP CA C 46 51.800 53.008 -1.208 1
1 577 . 18 1 1 A 46 46 ASP CB C 46 41.300 43.181 -1.881 1
1 578 . 18 1 1 A 46 46 ASP N N 46 125.500 119.661 5.839 1
1 579 . 18 1 1 A 47 47 ASP H H 47 9.160 8.656 0.504 1
1 580 . 18 1 1 A 47 47 ASP HA H 47 4.430 4.466 -0.036 1
1 583 . 18 1 1 A 47 47 ASP C C 47 176.000 177.990 -1.990 1
1 584 . 18 1 1 A 47 47 ASP CA C 47 55.000 56.148 -1.148 1
1 585 . 18 1 1 A 47 47 ASP CB C 47 38.900 40.701 -1.801 1
1 586 . 18 1 1 A 47 47 ASP N N 47 114.200 121.043 -6.843 1
1 587 . 18 1 1 A 48 48 THR H H 48 9.470 7.805 1.665 1
1 588 . 18 1 1 A 48 48 THR HA H 48 4.520 4.430 0.090 1
1 593 . 18 1 1 A 48 48 THR C C 48 174.500 174.532 -0.032 1
1 594 . 18 1 1 A 48 48 THR CA C 48 62.600 62.533 0.067 1
1 595 . 18 1 1 A 48 48 THR CB C 48 70.400 69.045 1.355 1
1 597 . 18 1 1 A 48 48 THR N N 48 111.800 110.563 1.237 1
1 598 . 18 1 1 A 49 49 ALA H H 49 7.850 7.642 0.208 1
1 599 . 18 1 1 A 49 49 ALA HA H 49 4.440 4.455 -0.015 1
1 603 . 18 1 1 A 49 49 ALA C C 49 173.200 175.301 -2.101 1
1 604 . 18 1 1 A 49 49 ALA CA C 49 52.700 51.210 1.490 1
1 605 . 18 1 1 A 49 49 ALA CB C 49 21.300 20.441 0.859 1
1 606 . 18 1 1 A 49 49 ALA N N 49 123.400 121.086 2.314 1
1 607 . 18 1 1 A 50 50 ARG H H 50 8.160 8.894 -0.734 1
1 608 . 18 1 1 A 50 50 ARG HA H 50 5.350 5.592 -0.242 1
1 616 . 18 1 1 A 50 50 ARG C C 50 174.700 174.648 0.052 1
1 617 . 18 1 1 A 50 50 ARG CA C 50 54.000 54.419 -0.419 1
1 618 . 18 1 1 A 50 50 ARG CB C 50 34.500 34.592 -0.092 1
1 622 . 18 1 1 A 50 50 ARG N N 50 117.400 114.939 2.461 1
1 624 . 18 1 1 A 51 51 ILE H H 51 9.390 8.556 0.834 1
1 625 . 18 1 1 A 51 51 ILE HA H 51 4.790 4.915 -0.125 1
1 635 . 18 1 1 A 51 51 ILE C C 51 172.600 173.152 -0.552 1
1 636 . 18 1 1 A 51 51 ILE CA C 51 60.000 58.930 1.070 1
1 637 . 18 1 1 A 51 51 ILE CB C 51 42.800 41.649 1.151 1
1 641 . 18 1 1 A 51 51 ILE N N 51 124.600 120.783 3.817 1
1 642 . 18 1 1 A 52 52 ARG H H 52 7.980 8.597 -0.617 1
1 643 . 18 1 1 A 52 52 ARG HA H 52 4.170 4.330 -0.160 1
1 651 . 18 1 1 A 52 52 ARG C C 52 174.600 175.941 -1.341 1
1 652 . 18 1 1 A 52 52 ARG CA C 52 57.100 56.263 0.837 1
1 653 . 18 1 1 A 52 52 ARG CB C 52 31.300 31.158 0.142 1
1 657 . 18 1 1 A 52 52 ARG N N 52 125.900 127.679 -1.779 1
1 659 . 18 1 1 A 53 53 ILE H H 53 8.290 8.671 -0.381 1
1 660 . 18 1 1 A 53 53 ILE HA H 53 5.160 5.175 -0.015 1
1 670 . 18 1 1 A 53 53 ILE C C 53 172.400 174.638 -2.238 1
1 671 . 18 1 1 A 53 53 ILE CA C 53 58.600 59.110 -0.510 1
1 672 . 18 1 1 A 53 53 ILE CB C 53 41.900 42.383 -0.483 1
1 676 . 18 1 1 A 53 53 ILE N N 53 118.500 121.466 -2.966 1
1 677 . 18 1 1 A 54 54 SER H H 54 8.350 8.909 -0.559 1
1 678 . 18 1 1 A 54 54 SER HA H 54 5.070 5.352 -0.282 1
1 681 . 18 1 1 A 54 54 SER C C 54 172.400 171.939 0.461 1
1 682 . 18 1 1 A 54 54 SER CA C 54 57.000 56.836 0.164 1
1 683 . 18 1 1 A 54 54 SER CB C 54 65.900 65.584 0.316 1
1 684 . 18 1 1 A 54 54 SER N N 54 120.700 118.196 2.504 1
1 685 . 18 1 1 A 55 55 SER H H 55 9.130 9.238 -0.108 1
1 686 . 18 1 1 A 55 55 SER HA H 55 5.270 5.082 0.188 1
1 690 . 18 1 1 A 55 55 SER C C 55 174.400 172.832 1.568 1
1 691 . 18 1 1 A 55 55 SER CA C 55 55.500 56.446 -0.946 1
1 692 . 18 1 1 A 55 55 SER CB C 55 64.500 64.990 -0.490 1
1 693 . 18 1 1 A 55 55 SER N N 55 117.200 117.886 -0.686 1
1 694 . 18 1 1 A 56 56 PHE H H 56 8.970 8.479 0.491 1
1 695 . 18 1 1 A 56 56 PHE HA H 56 4.600 4.881 -0.281 1
1 703 . 18 1 1 A 56 56 PHE C C 56 176.500 177.057 -0.557 1
1 704 . 18 1 1 A 56 56 PHE CA C 56 58.300 57.390 0.910 1
1 705 . 18 1 1 A 56 56 PHE CB C 56 37.900 40.192 -2.292 1
1 711 . 18 1 1 A 56 56 PHE N N 56 129.400 126.062 3.338 1
1 712 . 18 1 1 A 57 57 GLY H H 57 8.570 8.791 -0.221 1
1 713 . 18 1 1 A 57 57 GLY HA2 H 57 4.020 4.138 -0.118 1
1 714 . 18 1 1 A 57 57 GLY HA3 H 57 4.380 4.164 0.216 1
1 715 . 18 1 1 A 57 57 GLY C C 57 173.700 174.318 -0.618 1
1 716 . 18 1 1 A 57 57 GLY CA C 57 46.300 45.720 0.580 1
1 717 . 18 1 1 A 57 57 GLY N N 57 112.500 112.230 0.270 1
1 718 . 18 1 1 A 58 58 LYS H H 58 6.800 8.168 -1.368 1
1 719 . 18 1 1 A 58 58 LYS HA H 58 4.410 4.353 0.057 1
1 728 . 18 1 1 A 58 58 LYS C C 58 174.800 176.457 -1.657 1
1 729 . 18 1 1 A 58 58 LYS CA C 58 55.200 56.267 -1.067 1
1 730 . 18 1 1 A 58 58 LYS CB C 58 33.300 33.112 0.188 1
1 734 . 18 1 1 A 58 58 LYS N N 58 118.700 121.150 -2.450 1
1 735 . 18 1 1 A 59 59 GLN H H 59 8.390 8.096 0.294 1
1 736 . 18 1 1 A 59 59 GLN HA H 59 1.830 3.422 -1.592 1
1 743 . 18 1 1 A 59 59 GLN C C 59 174.100 174.768 -0.668 1
1 744 . 18 1 1 A 59 59 GLN CA C 59 57.100 54.523 2.577 1
1 745 . 18 1 1 A 59 59 GLN CB C 59 28.900 29.321 -0.421 1
1 748 . 18 1 1 A 59 59 GLN N N 59 124.000 122.013 1.987 1
1 750 . 18 1 1 A 60 60 LEU H H 60 5.320 8.195 -2.875 1
1 751 . 18 1 1 A 60 60 LEU HA H 60 4.370 5.054 -0.684 1
1 761 . 18 1 1 A 60 60 LEU CA C 60 52.800 53.401 -0.601 1
1 762 . 18 1 1 A 60 60 LEU CB C 60 46.700 45.053 1.647 1
1 766 . 18 1 1 A 60 60 LEU N N 60 121.800 121.938 -0.138 1
1 767 . 18 1 1 A 61 61 GLN H H 61 8.660 8.651 0.009 1
1 768 . 18 1 1 A 61 61 GLN HA H 61 4.440 4.642 -0.202 1
1 775 . 18 1 1 A 61 61 GLN C C 61 174.000 175.150 -1.150 1
1 776 . 18 1 1 A 61 61 GLN CA C 61 53.800 53.877 -0.077 1
1 777 . 18 1 1 A 61 61 GLN CB C 61 31.800 30.768 1.032 1
1 780 . 18 1 1 A 61 61 GLN N N 61 120.300 120.648 -0.348 1
1 782 . 18 1 1 A 62 62 ASP H H 62 8.450 8.711 -0.261 1
1 783 . 18 1 1 A 62 62 ASP HA H 62 4.130 4.412 -0.282 1
1 786 . 18 1 1 A 62 62 ASP C C 62 177.200 176.513 0.687 1
1 787 . 18 1 1 A 62 62 ASP CA C 62 55.700 55.212 0.488 1
1 788 . 18 1 1 A 62 62 ASP CB C 62 39.400 40.797 -1.397 1
1 789 . 18 1 1 A 62 62 ASP N N 62 122.400 123.035 -0.635 1
1 790 . 18 1 1 A 63 63 SER H H 63 9.210 8.553 0.657 1
1 791 . 18 1 1 A 63 63 SER HA H 63 3.850 3.999 -0.149 1
1 794 . 18 1 1 A 63 63 SER C C 63 173.200 172.883 0.317 1
1 795 . 18 1 1 A 63 63 SER CA C 63 61.700 58.981 2.719 1
1 796 . 18 1 1 A 63 63 SER CB C 63 61.800 61.663 0.137 1
1 797 . 18 1 1 A 63 63 SER N N 63 114.300 117.164 -2.864 1
1 798 . 18 1 1 A 64 64 ASP H H 64 7.960 7.431 0.529 1
1 799 . 18 1 1 A 64 64 ASP HA H 64 4.540 5.242 -0.702 1
1 802 . 18 1 1 A 64 64 ASP C C 64 174.900 173.993 0.907 1
1 803 . 18 1 1 A 64 64 ASP CA C 64 54.900 52.678 2.222 1
1 804 . 18 1 1 A 64 64 ASP CB C 64 40.900 44.526 -3.626 1
1 805 . 18 1 1 A 64 64 ASP N N 64 122.600 117.223 5.377 1
1 806 . 18 1 1 A 65 65 VAL H H 65 8.180 8.783 -0.603 1
1 807 . 18 1 1 A 65 65 VAL HA H 65 4.670 4.577 0.093 1
1 815 . 18 1 1 A 65 65 VAL C C 65 175.900 175.749 0.151 1
1 816 . 18 1 1 A 65 65 VAL CA C 65 62.300 62.616 -0.316 1
1 817 . 18 1 1 A 65 65 VAL CB C 65 31.700 31.221 0.479 1
1 820 . 18 1 1 A 65 65 VAL N N 65 123.100 124.453 -1.353 1
1 821 . 18 1 1 A 66 66 VAL H H 66 8.770 8.719 0.051 1
1 822 . 18 1 1 A 66 66 VAL HA H 66 5.160 5.152 0.008 1
1 830 . 18 1 1 A 66 66 VAL C C 66 173.600 173.311 0.289 1
1 831 . 18 1 1 A 66 66 VAL CA C 66 58.100 58.689 -0.589 1
1 832 . 18 1 1 A 66 66 VAL CB C 66 35.700 36.073 -0.373 1
1 835 . 18 1 1 A 66 66 VAL N N 66 118.100 121.086 -2.986 1
1 836 . 18 1 1 A 67 67 ARG H H 67 8.880 8.850 0.030 1
1 837 . 18 1 1 A 67 67 ARG HA H 67 5.110 5.084 0.026 1
1 845 . 18 1 1 A 67 67 ARG C C 67 175.300 174.752 0.548 1
1 846 . 18 1 1 A 67 67 ARG CA C 67 54.200 54.486 -0.286 1
1 847 . 18 1 1 A 67 67 ARG CB C 67 32.200 33.530 -1.330 1
1 851 . 18 1 1 A 67 67 ARG N N 67 120.200 121.782 -1.582 1
1 853 . 18 1 1 A 68 68 ILE H H 68 9.220 8.885 0.335 1
1 854 . 18 1 1 A 68 68 ILE HA H 68 4.990 4.682 0.308 1
1 864 . 18 1 1 A 68 68 ILE C C 68 174.900 174.675 0.225 1
1 865 . 18 1 1 A 68 68 ILE CA C 68 58.600 59.901 -1.301 1
1 866 . 18 1 1 A 68 68 ILE CB C 68 39.300 39.280 0.020 1
1 870 . 18 1 1 A 68 68 ILE N N 68 127.200 127.999 -0.799 1
1 871 . 18 1 1 A 69 69 ASP H H 69 9.110 8.780 0.330 1
1 872 . 18 1 1 A 69 69 ASP HA H 69 5.370 5.059 0.311 1
1 875 . 18 1 1 A 69 69 ASP C C 69 175.800 176.425 -0.625 1
1 876 . 18 1 1 A 69 69 ASP CA C 69 52.400 52.679 -0.279 1
1 877 . 18 1 1 A 69 69 ASP CB C 69 43.700 43.084 0.616 1
1 878 . 18 1 1 A 69 69 ASP N N 69 123.400 125.795 -2.395 1
1 879 . 18 1 1 A 70 70 ASN H H 70 8.300 8.854 -0.554 1
1 880 . 18 1 1 A 70 70 ASN HA H 70 4.160 4.448 -0.288 1
1 885 . 18 1 1 A 70 70 ASN C C 70 176.300 174.691 1.609 1
1 886 . 18 1 1 A 70 70 ASN CA C 70 54.300 54.257 0.043 1
1 887 . 18 1 1 A 70 70 ASN CB C 70 37.500 37.733 -0.233 1
1 889 . 18 1 1 A 70 70 ASN N N 70 119.800 121.077 -1.277 1
1 891 . 18 1 1 A 71 71 ALA H H 71 9.100 8.229 0.871 1
1 892 . 18 1 1 A 71 71 ALA HA H 71 4.500 4.414 0.086 1
1 896 . 18 1 1 A 71 71 ALA C C 71 175.700 176.690 -0.990 1
1 897 . 18 1 1 A 71 71 ALA CA C 71 51.900 52.816 -0.916 1
1 898 . 18 1 1 A 71 71 ALA CB C 71 19.600 19.812 -0.212 1
1 899 . 18 1 1 A 71 71 ALA N N 71 123.000 121.151 1.849 1
1 900 . 18 1 1 A 72 72 ARG H H 72 8.490 8.473 0.017 1
1 901 . 18 1 1 A 72 72 ARG HA H 72 4.720 4.785 -0.065 1
1 909 . 18 1 1 A 72 72 ARG C C 72 175.800 174.934 0.866 1
1 910 . 18 1 1 A 72 72 ARG CA C 72 54.400 54.899 -0.499 1
1 911 . 18 1 1 A 72 72 ARG CB C 72 32.700 31.750 0.950 1
1 915 . 18 1 1 A 72 72 ARG N N 72 122.500 123.428 -0.928 1
1 917 . 18 1 1 A 73 73 VAL H H 73 8.310 8.166 0.144 1
1 918 . 18 1 1 A 73 73 VAL HA H 73 4.250 4.510 -0.260 1
1 926 . 18 1 1 A 73 73 VAL C C 73 174.600 175.586 -0.986 1
1 927 . 18 1 1 A 73 73 VAL CA C 73 62.800 62.175 0.625 1
1 928 . 18 1 1 A 73 73 VAL CB C 73 32.100 31.743 0.357 1
1 931 . 18 1 1 A 73 73 VAL N N 73 127.100 126.873 0.227 1
1 932 . 18 1 1 A 74 74 ALA H H 74 8.880 8.906 -0.026 1
1 933 . 18 1 1 A 74 74 ALA HA H 74 4.500 4.974 -0.474 1
1 937 . 18 1 1 A 74 74 ALA C C 74 174.800 175.573 -0.773 1
1 938 . 18 1 1 A 74 74 ALA CA C 74 50.500 50.721 -0.221 1
1 939 . 18 1 1 A 74 74 ALA CB C 74 22.500 22.995 -0.495 1
1 940 . 18 1 1 A 74 74 ALA N N 74 131.000 128.796 2.204 1
1 941 . 18 1 1 A 75 75 GLN H H 75 8.280 8.436 -0.156 1
1 942 . 18 1 1 A 75 75 GLN HA H 75 4.910 5.405 -0.495 1
1 949 . 18 1 1 A 75 75 GLN C C 75 175.100 174.243 0.857 1
1 950 . 18 1 1 A 75 75 GLN CA C 75 54.600 54.028 0.572 1
1 951 . 18 1 1 A 75 75 GLN CB C 75 31.400 31.725 -0.325 1
1 954 . 18 1 1 A 75 75 GLN N N 75 118.800 118.979 -0.179 1
1 956 . 18 1 1 A 76 76 PHE H H 76 8.710 9.029 -0.319 1
1 957 . 18 1 1 A 76 76 PHE HA H 76 4.660 4.997 -0.337 1
1 965 . 18 1 1 A 76 76 PHE C C 76 174.900 176.000 -1.100 1
1 966 . 18 1 1 A 76 76 PHE CA C 76 57.000 56.549 0.451 1
1 967 . 18 1 1 A 76 76 PHE CB C 76 41.000 42.098 -1.098 1
1 973 . 18 1 1 A 76 76 PHE N N 76 125.000 119.522 5.478 1
1 974 . 18 1 1 A 77 77 ASN H H 77 9.040 9.579 -0.539 1
1 975 . 18 1 1 A 77 77 ASN HA H 77 4.170 4.527 -0.357 1
1 980 . 18 1 1 A 77 77 ASN C C 77 174.200 174.884 -0.684 1
1 981 . 18 1 1 A 77 77 ASN CA C 77 53.800 54.211 -0.411 1
1 982 . 18 1 1 A 77 77 ASN CB C 77 37.400 37.621 -0.221 1
1 984 . 18 1 1 A 77 77 ASN N N 77 123.200 122.876 0.324 1
1 986 . 18 1 1 A 78 78 GLY H H 78 8.370 8.672 -0.302 1
1 987 . 18 1 1 A 78 78 GLY HA2 H 78 3.410 3.742 -0.332 1
1 988 . 18 1 1 A 78 78 GLY HA3 H 78 3.980 3.796 0.184 1
1 989 . 18 1 1 A 78 78 GLY C C 78 173.800 173.331 0.469 1
1 990 . 18 1 1 A 78 78 GLY CA C 78 45.000 46.137 -1.137 1
1 991 . 18 1 1 A 78 78 GLY N N 78 103.300 104.554 -1.254 1
1 992 . 18 1 1 A 79 79 TYR H H 79 7.670 7.735 -0.065 1
1 993 . 18 1 1 A 79 79 TYR HA H 79 4.860 5.002 -0.142 1
1 1000 . 18 1 1 A 79 79 TYR C C 79 174.800 175.233 -0.433 1
1 1001 . 18 1 1 A 79 79 TYR CA C 79 56.300 56.329 -0.029 1
1 1002 . 18 1 1 A 79 79 TYR CB C 79 40.800 41.901 -1.101 1
1 1007 . 18 1 1 A 79 79 TYR N N 79 118.700 118.407 0.293 1
1 1008 . 18 1 1 A 80 80 LEU H H 80 8.760 8.834 -0.074 1
1 1009 . 18 1 1 A 80 80 LEU HA H 80 4.830 4.360 0.470 1
1 1019 . 18 1 1 A 80 80 LEU C C 80 176.200 175.908 0.292 1
1 1020 . 18 1 1 A 80 80 LEU CA C 80 54.700 55.312 -0.612 1
1 1021 . 18 1 1 A 80 80 LEU CB C 80 43.500 42.476 1.024 1
1 1025 . 18 1 1 A 80 80 LEU N N 80 122.600 126.543 -3.943 1
1 1026 . 18 1 1 A 81 81 SER H H 81 8.650 8.622 0.028 1
1 1027 . 18 1 1 A 81 81 SER HA H 81 4.860 5.060 -0.200 1
1 1030 . 18 1 1 A 81 81 SER C C 81 172.600 172.512 0.088 1
1 1031 . 18 1 1 A 81 81 SER CA C 81 56.600 57.504 -0.904 1
1 1032 . 18 1 1 A 81 81 SER CB C 81 66.300 67.288 -0.988 1
1 1033 . 18 1 1 A 81 81 SER N N 81 114.700 115.585 -0.885 1
1 1034 . 18 1 1 A 82 82 LEU H H 82 8.680 8.660 0.020 1
1 1035 . 18 1 1 A 82 82 LEU HA H 82 5.190 5.108 0.082 1
1 1045 . 18 1 1 A 82 82 LEU C C 82 177.100 175.646 1.454 1
1 1046 . 18 1 1 A 82 82 LEU CA C 82 53.300 53.639 -0.339 1
1 1047 . 18 1 1 A 82 82 LEU CB C 82 43.800 43.508 0.292 1
1 1051 . 18 1 1 A 82 82 LEU N N 82 119.800 124.039 -4.239 1
1 1052 . 18 1 1 A 83 83 SER H H 83 9.560 9.507 0.053 1
1 1053 . 18 1 1 A 83 83 SER HA H 83 5.390 5.337 0.053 1
1 1056 . 18 1 1 A 83 83 SER C C 83 174.200 173.721 0.479 1
1 1057 . 18 1 1 A 83 83 SER CA C 83 57.100 57.836 -0.736 1
1 1058 . 18 1 1 A 83 83 SER CB C 83 64.400 64.448 -0.048 1
1 1059 . 18 1 1 A 83 83 SER N N 83 119.000 122.170 -3.170 1
1 1060 . 18 1 1 A 84 84 VAL H H 84 9.150 9.178 -0.028 1
1 1061 . 18 1 1 A 84 84 VAL HA H 84 4.490 4.633 -0.143 1
1 1069 . 18 1 1 A 84 84 VAL C C 84 174.700 176.108 -1.408 1
1 1070 . 18 1 1 A 84 84 VAL CA C 84 61.300 61.288 0.012 1
1 1071 . 18 1 1 A 84 84 VAL CB C 84 33.000 31.787 1.213 1
1 1074 . 18 1 1 A 84 84 VAL N N 84 128.300 126.969 1.331 1
1 1075 . 18 1 1 A 85 85 GLY H H 85 7.970 8.816 -0.846 1
1 1076 . 18 1 1 A 85 85 GLY HA2 H 85 4.030 4.319 -0.289 1
1 1077 . 18 1 1 A 85 85 GLY HA3 H 85 4.840 4.403 0.437 1
1 1078 . 18 1 1 A 85 85 GLY C C 85 175.800 174.594 1.206 1
1 1079 . 18 1 1 A 85 85 GLY CA C 85 44.800 44.429 0.371 1
1 1080 . 18 1 1 A 85 85 GLY N N 85 114.300 115.312 -1.012 1
1 1081 . 18 1 1 A 86 86 ASP H H 86 8.860 8.958 -0.098 1
1 1082 . 18 1 1 A 86 86 ASP HA H 86 4.370 4.486 -0.116 1
1 1085 . 18 1 1 A 86 86 ASP C C 86 177.400 176.858 0.542 1
1 1086 . 18 1 1 A 86 86 ASP CA C 86 57.400 56.373 1.027 1
1 1087 . 18 1 1 A 86 86 ASP CB C 86 40.600 40.167 0.433 1
1 1088 . 18 1 1 A 86 86 ASP N N 86 122.500 120.098 2.402 1
1 1089 . 18 1 1 A 87 87 SER H H 87 8.540 7.707 0.833 1
1 1090 . 18 1 1 A 87 87 SER HA H 87 4.620 4.381 0.239 1
1 1093 . 18 1 1 A 87 87 SER C C 87 174.700 174.680 0.020 1
1 1094 . 18 1 1 A 87 87 SER CA C 87 58.200 58.775 -0.575 1
1 1095 . 18 1 1 A 87 87 SER CB C 87 63.300 63.718 -0.418 1
1 1096 . 18 1 1 A 87 87 SER N N 87 112.100 112.030 0.070 1
1 1097 . 18 1 1 A 88 88 SER H H 88 7.880 7.624 0.256 1
1 1098 . 18 1 1 A 88 88 SER HA H 88 5.050 4.496 0.554 1
1 1101 . 18 1 1 A 88 88 SER C C 88 172.700 173.981 -1.281 1
1 1102 . 18 1 1 A 88 88 SER CA C 88 57.600 58.324 -0.724 1
1 1103 . 18 1 1 A 88 88 SER CB C 88 64.300 64.099 0.201 1
1 1104 . 18 1 1 A 88 88 SER N N 88 119.200 118.120 1.080 1
1 1105 . 18 1 1 A 89 89 ARG H H 89 8.350 8.268 0.082 1
1 1106 . 18 1 1 A 89 89 ARG HA H 89 4.720 5.013 -0.293 1
1 1114 . 18 1 1 A 89 89 ARG C C 89 174.200 174.552 -0.352 1
1 1115 . 18 1 1 A 89 89 ARG CA C 89 55.000 54.558 0.442 1
1 1116 . 18 1 1 A 89 89 ARG CB C 89 33.500 33.585 -0.085 1
1 1120 . 18 1 1 A 89 89 ARG N N 89 122.800 125.127 -2.327 1
1 1122 . 18 1 1 A 90 90 ILE H H 90 8.530 8.970 -0.440 1
1 1123 . 18 1 1 A 90 90 ILE HA H 90 4.790 4.861 -0.071 1
1 1133 . 18 1 1 A 90 90 ILE C C 90 175.400 174.594 0.806 1
1 1134 . 18 1 1 A 90 90 ILE CA C 90 60.600 60.214 0.386 1
1 1135 . 18 1 1 A 90 90 ILE CB C 90 40.600 40.148 0.452 1
1 1139 . 18 1 1 A 90 90 ILE N N 90 123.100 127.036 -3.936 1
1 1140 . 18 1 1 A 91 91 GLU H H 91 9.000 8.967 0.033 1
1 1141 . 18 1 1 A 91 91 GLU HA H 91 4.730 5.007 -0.277 1
1 1146 . 18 1 1 A 91 91 GLU C C 91 175.100 175.305 -0.205 1
1 1147 . 18 1 1 A 91 91 GLU CA C 91 54.300 54.563 -0.263 1
1 1148 . 18 1 1 A 91 91 GLU CB C 91 32.400 33.270 -0.870 1
1 1150 . 18 1 1 A 91 91 GLU N N 91 126.400 128.777 -2.377 1
1 1151 . 18 1 1 A 92 92 SER H H 92 8.830 8.876 -0.046 1
1 1152 . 18 1 1 A 92 92 SER HA H 92 4.700 4.870 -0.170 1
1 1155 . 18 1 1 A 92 92 SER C C 92 174.600 174.263 0.337 1
1 1156 . 18 1 1 A 92 92 SER CA C 92 59.300 58.774 0.526 1
1 1157 . 18 1 1 A 92 92 SER CB C 92 63.100 63.621 -0.521 1
1 1158 . 18 1 1 A 92 92 SER N N 92 119.800 124.972 -5.172 1
1 1159 . 18 1 1 A 93 93 VAL H H 93 8.350 8.535 -0.185 1
1 1160 . 18 1 1 A 93 93 VAL HA H 93 4.290 4.514 -0.224 1
1 1168 . 18 1 1 A 93 93 VAL C C 93 175.100 175.954 -0.854 1
1 1169 . 18 1 1 A 93 93 VAL CA C 93 61.300 61.163 0.137 1
1 1170 . 18 1 1 A 93 93 VAL CB C 93 33.900 34.345 -0.445 1
1 1173 . 18 1 1 A 93 93 VAL N N 93 121.800 125.865 -4.065 1
1 1174 . 18 1 1 A 94 94 ASN H H 94 8.510 8.750 -0.240 1
1 1175 . 18 1 1 A 94 94 ASN HA H 94 4.770 4.202 0.568 1
1 1180 . 18 1 1 A 94 94 ASN C C 94 175.000 174.159 0.841 1
1 1181 . 18 1 1 A 94 94 ASN CA C 94 52.700 54.184 -1.484 1
1 1182 . 18 1 1 A 94 94 ASN CB C 94 38.500 36.947 1.553 1
1 1184 . 18 1 1 A 94 94 ASN N N 94 121.800 122.965 -1.165 1
1 1186 . 18 1 1 A 95 95 VAL H H 95 7.860 7.846 0.014 1
1 1187 . 18 1 1 A 95 95 VAL HA H 95 4.100 4.007 0.093 1
1 1195 . 18 1 1 A 95 95 VAL C C 95 175.100 175.689 -0.589 1
1 1196 . 18 1 1 A 95 95 VAL CA C 95 61.700 62.496 -0.796 1
1 1197 . 18 1 1 A 95 95 VAL CB C 95 33.100 32.989 0.111 1
1 1200 . 18 1 1 A 95 95 VAL N N 95 119.700 118.262 1.438 1
1 1201 . 18 1 1 A 96 96 ASN H H 96 8.490 8.598 -0.108 1
1 1202 . 18 1 1 A 96 96 ASN HA H 96 4.700 5.239 -0.539 1
1 1207 . 18 1 1 A 96 96 ASN C C 96 174.600 174.545 0.055 1
1 1208 . 18 1 1 A 96 96 ASN CA C 96 53.000 52.615 0.385 1
1 1209 . 18 1 1 A 96 96 ASN CB C 96 39.000 40.790 -1.790 1
1 1211 . 18 1 1 A 96 96 ASN N N 96 122.200 125.787 -3.587 1
1 1213 . 18 1 1 A 97 97 ILE H H 97 8.080 8.982 -0.902 1
1 1214 . 18 1 1 A 97 97 ILE HA H 97 4.370 4.912 -0.542 1
1 1224 . 18 1 1 A 97 97 ILE CA C 97 58.600 58.532 0.068 1
1 1225 . 18 1 1 A 97 97 ILE CB C 97 38.600 39.127 -0.527 1
1 1229 . 18 1 1 A 97 97 ILE N N 97 123.500 122.302 1.198 1
1 1230 . 18 1 1 A 98 98 PRO HA H 98 4.360 4.565 -0.205 1
1 1237 . 18 1 1 A 98 98 PRO C C 98 176.600 176.776 -0.176 1
1 1238 . 18 1 1 A 98 98 PRO CA C 98 63.100 62.403 0.697 1
1 1239 . 18 1 1 A 98 98 PRO CB C 98 31.800 32.561 -0.761 1
1 1242 . 18 1 1 A 99 99 LEU H H 99 8.200 8.329 -0.129 1
1 1243 . 18 1 1 A 99 99 LEU HA H 99 4.200 4.194 0.006 1
1 1253 . 18 1 1 A 99 99 LEU C C 99 177.300 176.534 0.766 1
1 1254 . 18 1 1 A 99 99 LEU CA C 99 55.000 54.644 0.356 1
1 1255 . 18 1 1 A 99 99 LEU CB C 99 42.400 42.334 0.066 1
1 1259 . 18 1 1 A 99 99 LEU N N 99 122.500 121.945 0.555 1
1 1260 . 18 1 1 A 100 100 GLU H H 100 8.250 8.591 -0.341 1
1 1261 . 18 1 1 A 100 100 GLU HA H 100 4.140 4.548 -0.408 1
1 1266 . 18 1 1 A 100 100 GLU C C 100 176.100 175.765 0.335 1
1 1267 . 18 1 1 A 100 100 GLU CA C 100 56.100 57.248 -1.148 1
1 1268 . 18 1 1 A 100 100 GLU CB C 100 29.900 33.197 -3.297 1
1 1270 . 18 1 1 A 100 100 GLU N N 100 121.000 124.162 -3.162 1
1 1271 . 18 1 1 A 101 101 HIS H H 101 8.540 7.584 0.956 1
1 1272 . 18 1 1 A 101 101 HIS HA H 101 4.600 4.788 -0.188 1
1 1275 . 18 1 1 A 101 101 HIS C C 101 174.200 175.181 -0.981 1
1 1276 . 18 1 1 A 101 101 HIS CA C 101 55.200 55.187 0.013 1
1 1277 . 18 1 1 A 101 101 HIS CB C 101 29.000 31.390 -2.390 1
1 1278 . 18 1 1 A 101 101 HIS N N 101 119.400 116.066 3.334 1
1 1279 . 18 1 1 A 102 102 HIS H H 102 8.660 8.682 -0.022 1
1 1280 . 18 1 1 A 102 102 HIS HA H 102 4.630 5.038 -0.408 1
1 1283 . 18 1 1 A 102 102 HIS C C 102 174.200 174.933 -0.733 1
1 1284 . 18 1 1 A 102 102 HIS CA C 102 55.200 54.733 0.467 1
1 1285 . 18 1 1 A 102 102 HIS CB C 102 29.100 30.370 -1.270 1
1 1286 . 18 1 1 A 102 102 HIS N N 102 119.700 116.278 3.422 1
1 1287 . 18 1 1 A 103 103 HIS H H 103 8.680 7.995 0.685 1
1 1288 . 18 1 1 A 103 103 HIS HA H 103 4.640 4.749 -0.109 1
1 1291 . 18 1 1 A 103 103 HIS C C 103 174.200 176.587 -2.387 1
1 1292 . 18 1 1 A 103 103 HIS CA C 103 55.200 56.912 -1.712 1
1 1293 . 18 1 1 A 103 103 HIS CB C 103 29.200 31.299 -2.099 1
1 1294 . 18 1 1 A 103 103 HIS N N 103 120.500 117.037 3.463 1
1 1295 . 18 1 1 A 104 104 HIS H H 104 8.580 8.235 0.345 1
1 1296 . 18 1 1 A 104 104 HIS HA H 104 4.590 3.753 0.837 1
1 1299 . 18 1 1 A 104 104 HIS C C 104 174.200 174.108 0.092 1
1 1300 . 18 1 1 A 104 104 HIS CA C 104 55.200 59.083 -3.883 1
1 1301 . 18 1 1 A 104 104 HIS CB C 104 29.300 30.150 -0.850 1
1 1302 . 18 1 1 A 104 104 HIS N N 104 120.700 118.724 1.976 1
1 1303 . 18 1 1 A 105 105 HIS H H 105 8.550 7.794 0.756 1
1 1304 . 18 1 1 A 105 105 HIS HA H 105 4.610 4.112 0.498 1
1 1307 . 18 1 1 A 105 105 HIS C C 105 173.500 173.176 0.324 1
1 1308 . 18 1 1 A 105 105 HIS CA C 105 55.400 56.404 -1.004 1
1 1309 . 18 1 1 A 105 105 HIS CB C 105 28.800 29.760 -0.960 1
1 1310 . 18 1 1 A 105 105 HIS N N 105 119.000 116.663 2.337 1
1 7 . 19 1 1 A 2 2 ASP H H 2 8.890 7.712 1.178 1
1 8 . 19 1 1 A 2 2 ASP HA H 2 4.740 4.871 -0.131 1
1 11 . 19 1 1 A 2 2 ASP C C 2 174.600 174.055 0.545 1
1 12 . 19 1 1 A 2 2 ASP CA C 2 53.800 53.303 0.497 1
1 13 . 19 1 1 A 2 2 ASP CB C 2 41.500 43.543 -2.043 1
1 14 . 19 1 1 A 2 2 ASP N N 2 122.100 117.734 4.366 1
1 15 . 19 1 1 A 3 3 LEU H H 3 8.280 8.438 -0.158 1
1 16 . 19 1 1 A 3 3 LEU HA H 3 4.420 4.719 -0.299 1
1 26 . 19 1 1 A 3 3 LEU C C 3 176.900 175.985 0.915 1
1 27 . 19 1 1 A 3 3 LEU CA C 3 55.000 54.934 0.066 1
1 28 . 19 1 1 A 3 3 LEU CB C 3 42.700 42.775 -0.075 1
1 32 . 19 1 1 A 3 3 LEU N N 3 122.300 125.847 -3.547 1
1 33 . 19 1 1 A 4 4 VAL H H 4 8.640 8.581 0.059 1
1 34 . 19 1 1 A 4 4 VAL HA H 4 4.540 4.951 -0.411 1
1 42 . 19 1 1 A 4 4 VAL C C 4 175.800 174.926 0.874 1
1 43 . 19 1 1 A 4 4 VAL CA C 4 59.400 58.600 0.800 1
1 44 . 19 1 1 A 4 4 VAL CB C 4 35.400 35.850 -0.450 1
1 47 . 19 1 1 A 4 4 VAL N N 4 122.600 119.422 3.178 1
1 48 . 19 1 1 A 5 5 LYS H H 5 8.630 8.664 -0.034 1
1 49 . 19 1 1 A 5 5 LYS HA H 5 4.450 4.418 0.032 1
1 58 . 19 1 1 A 5 5 LYS C C 5 179.400 178.480 0.920 1
1 59 . 19 1 1 A 5 5 LYS CA C 5 53.600 55.775 -2.175 1
1 60 . 19 1 1 A 5 5 LYS CB C 5 30.900 33.235 -2.335 1
1 64 . 19 1 1 A 5 5 LYS N N 5 121.100 121.634 -0.534 1
1 65 . 19 1 1 A 6 6 ILE H H 6 10.320 8.893 1.427 1
1 66 . 19 1 1 A 6 6 ILE HA H 6 3.440 3.714 -0.274 1
1 76 . 19 1 1 A 6 6 ILE C C 6 178.300 177.650 0.650 1
1 77 . 19 1 1 A 6 6 ILE CA C 6 65.700 65.023 0.677 1
1 78 . 19 1 1 A 6 6 ILE CB C 6 35.900 37.691 -1.791 1
1 82 . 19 1 1 A 6 6 ILE N N 6 125.400 122.489 2.911 1
1 83 . 19 1 1 A 7 7 ARG H H 7 8.210 7.994 0.216 1
1 84 . 19 1 1 A 7 7 ARG HA H 7 3.850 4.192 -0.342 1
1 92 . 19 1 1 A 7 7 ARG C C 7 175.600 177.150 -1.550 1
1 93 . 19 1 1 A 7 7 ARG CA C 7 57.800 58.852 -1.052 1
1 94 . 19 1 1 A 7 7 ARG CB C 7 30.300 30.061 0.239 1
1 98 . 19 1 1 A 7 7 ARG N N 7 118.800 120.527 -1.727 1
1 100 . 19 1 1 A 8 8 ASP H H 8 7.850 7.911 -0.061 1
1 101 . 19 1 1 A 8 8 ASP HA H 8 4.700 4.702 -0.002 1
1 104 . 19 1 1 A 8 8 ASP C C 8 176.100 176.348 -0.248 1
1 105 . 19 1 1 A 8 8 ASP CA C 8 54.100 54.562 -0.462 1
1 106 . 19 1 1 A 8 8 ASP CB C 8 41.200 41.407 -0.207 1
1 107 . 19 1 1 A 8 8 ASP N N 8 116.800 117.484 -0.684 1
1 108 . 19 1 1 A 9 9 VAL H H 9 7.240 7.420 -0.180 1
1 109 . 19 1 1 A 9 9 VAL HA H 9 3.710 3.966 -0.256 1
1 117 . 19 1 1 A 9 9 VAL C C 9 174.900 175.446 -0.546 1
1 118 . 19 1 1 A 9 9 VAL CA C 9 64.300 63.295 1.005 1
1 119 . 19 1 1 A 9 9 VAL CB C 9 31.500 31.694 -0.194 1
1 122 . 19 1 1 A 9 9 VAL N N 9 121.800 121.845 -0.045 1
1 123 . 19 1 1 A 10 10 SER H H 10 8.600 8.527 0.073 1
1 124 . 19 1 1 A 10 10 SER HA H 10 4.600 4.684 -0.084 1
1 127 . 19 1 1 A 10 10 SER CA C 10 56.700 57.204 -0.504 1
1 128 . 19 1 1 A 10 10 SER CB C 10 66.100 65.603 0.497 1
1 129 . 19 1 1 A 10 10 SER N N 10 122.200 120.906 1.294 1
1 130 . 19 1 1 A 11 11 LEU H H 11 8.660 8.966 -0.306 1
1 131 . 19 1 1 A 11 11 LEU HA H 11 3.900 4.132 -0.232 1
1 141 . 19 1 1 A 11 11 LEU C C 11 178.100 178.858 -0.758 1
1 142 . 19 1 1 A 11 11 LEU CA C 11 56.700 56.601 0.099 1
1 143 . 19 1 1 A 11 11 LEU CB C 11 41.400 41.243 0.157 1
1 147 . 19 1 1 A 11 11 LEU N N 11 120.300 122.504 -2.204 1
1 148 . 19 1 1 A 12 12 SER H H 12 8.160 7.651 0.509 1
1 149 . 19 1 1 A 12 12 SER HA H 12 4.270 4.303 -0.033 1
1 152 . 19 1 1 A 12 12 SER C C 12 174.200 174.585 -0.385 1
1 153 . 19 1 1 A 12 12 SER CA C 12 59.900 61.426 -1.526 1
1 154 . 19 1 1 A 12 12 SER CB C 12 63.100 63.033 0.067 1
1 155 . 19 1 1 A 12 12 SER N N 12 112.100 113.526 -1.426 1
1 156 . 19 1 1 A 13 13 THR H H 13 7.460 7.384 0.076 1
1 157 . 19 1 1 A 13 13 THR HA H 13 4.760 4.695 0.065 1
1 162 . 19 1 1 A 13 13 THR CA C 13 56.600 58.386 -1.786 1
1 163 . 19 1 1 A 13 13 THR CB C 13 70.100 70.469 -0.369 1
1 165 . 19 1 1 A 13 13 THR N N 13 114.700 111.678 3.022 1
1 166 . 19 1 1 A 14 14 PRO HA H 14 4.050 4.291 -0.241 1
1 173 . 19 1 1 A 14 14 PRO C C 14 175.800 175.936 -0.136 1
1 174 . 19 1 1 A 14 14 PRO CA C 14 65.100 65.101 -0.001 1
1 175 . 19 1 1 A 14 14 PRO CB C 14 32.100 31.868 0.232 1
1 178 . 19 1 1 A 15 15 TYR H H 15 7.380 7.696 -0.316 1
1 179 . 19 1 1 A 15 15 TYR HA H 15 5.570 5.574 -0.004 1
1 186 . 19 1 1 A 15 15 TYR C C 15 176.100 175.373 0.727 1
1 187 . 19 1 1 A 15 15 TYR CA C 15 56.400 56.766 -0.366 1
1 188 . 19 1 1 A 15 15 TYR CB C 15 41.500 41.477 0.023 1
1 193 . 19 1 1 A 15 15 TYR N N 15 113.800 117.410 -3.610 1
1 194 . 19 1 1 A 16 16 VAL H H 16 9.010 9.114 -0.104 1
1 195 . 19 1 1 A 16 16 VAL HA H 16 4.920 5.290 -0.370 1
1 203 . 19 1 1 A 16 16 VAL C C 16 174.300 173.328 0.972 1
1 204 . 19 1 1 A 16 16 VAL CA C 16 59.600 59.493 0.107 1
1 205 . 19 1 1 A 16 16 VAL CB C 16 36.800 36.311 0.489 1
1 208 . 19 1 1 A 16 16 VAL N N 16 113.800 117.232 -3.432 1
1 209 . 19 1 1 A 17 17 SER H H 17 7.960 9.319 -1.359 1
1 210 . 19 1 1 A 17 17 SER HA H 17 5.860 5.674 0.186 1
1 213 . 19 1 1 A 17 17 SER C C 17 172.700 173.343 -0.643 1
1 214 . 19 1 1 A 17 17 SER CA C 17 57.300 56.599 0.701 1
1 215 . 19 1 1 A 17 17 SER CB C 17 64.000 65.067 -1.067 1
1 216 . 19 1 1 A 17 17 SER N N 17 117.100 117.302 -0.202 1
1 217 . 19 1 1 A 18 18 VAL H H 18 8.570 8.742 -0.172 1
1 218 . 19 1 1 A 18 18 VAL HA H 18 4.900 5.174 -0.274 1
1 226 . 19 1 1 A 18 18 VAL C C 18 173.700 173.616 0.084 1
1 227 . 19 1 1 A 18 18 VAL CA C 18 58.800 59.092 -0.292 1
1 228 . 19 1 1 A 18 18 VAL CB C 18 36.700 36.015 0.685 1
1 231 . 19 1 1 A 18 18 VAL N N 18 113.500 119.421 -5.921 1
1 232 . 19 1 1 A 19 19 ILE H H 19 8.490 8.636 -0.146 1
1 233 . 19 1 1 A 19 19 ILE HA H 19 5.300 4.965 0.335 1
1 243 . 19 1 1 A 19 19 ILE C C 19 175.800 174.877 0.923 1
1 244 . 19 1 1 A 19 19 ILE CA C 19 59.700 59.263 0.437 1
1 245 . 19 1 1 A 19 19 ILE CB C 19 41.700 42.600 -0.900 1
1 249 . 19 1 1 A 19 19 ILE N N 19 120.600 121.948 -1.348 1
1 250 . 19 1 1 A 20 20 GLY H H 20 8.670 8.100 0.570 1
1 251 . 19 1 1 A 20 20 GLY HA2 H 20 3.760 4.149 -0.389 1
1 252 . 19 1 1 A 20 20 GLY HA3 H 20 4.190 4.153 0.037 1
1 253 . 19 1 1 A 20 20 GLY C C 20 169.900 172.418 -2.518 1
1 254 . 19 1 1 A 20 20 GLY CA C 20 46.000 45.919 0.081 1
1 255 . 19 1 1 A 20 20 GLY N N 20 110.200 113.385 -3.185 1
1 256 . 19 1 1 A 21 21 LYS H H 21 8.920 8.415 0.505 1
1 257 . 19 1 1 A 21 21 LYS HA H 21 5.210 5.314 -0.104 1
1 266 . 19 1 1 A 21 21 LYS C C 21 176.400 175.153 1.247 1
1 267 . 19 1 1 A 21 21 LYS CA C 21 54.400 55.138 -0.738 1
1 268 . 19 1 1 A 21 21 LYS CB C 21 35.400 34.886 0.514 1
1 272 . 19 1 1 A 21 21 LYS N N 21 119.100 116.879 2.221 1
1 273 . 19 1 1 A 22 22 ILE H H 22 8.900 8.460 0.440 1
1 274 . 19 1 1 A 22 22 ILE HA H 22 5.050 4.956 0.094 1
1 284 . 19 1 1 A 22 22 ILE C C 22 176.900 175.247 1.653 1
1 285 . 19 1 1 A 22 22 ILE CA C 22 57.800 60.490 -2.690 1
1 286 . 19 1 1 A 22 22 ILE CB C 22 36.200 38.914 -2.714 1
1 290 . 19 1 1 A 22 22 ILE N N 22 130.000 125.115 4.885 1
1 291 . 19 1 1 A 23 23 THR H H 23 9.020 8.879 0.141 1
1 292 . 19 1 1 A 23 23 THR HA H 23 4.660 5.200 -0.540 1
1 297 . 19 1 1 A 23 23 THR C C 23 174.000 174.127 -0.127 1
1 298 . 19 1 1 A 23 23 THR CA C 23 60.800 59.962 0.838 1
1 299 . 19 1 1 A 23 23 THR CB C 23 73.400 71.782 1.618 1
1 301 . 19 1 1 A 23 23 THR N N 23 118.200 117.694 0.506 1
1 302 . 19 1 1 A 24 24 GLY H H 24 8.430 9.026 -0.596 1
1 303 . 19 1 1 A 24 24 GLY HA2 H 24 3.910 3.944 -0.034 1
1 304 . 19 1 1 A 24 24 GLY HA3 H 24 3.910 4.109 -0.199 1
1 305 . 19 1 1 A 24 24 GLY C C 24 175.400 175.073 0.327 1
1 306 . 19 1 1 A 24 24 GLY CA C 24 47.100 47.086 0.014 1
1 307 . 19 1 1 A 24 24 GLY N N 24 107.200 112.239 -5.039 1
1 308 . 19 1 1 A 25 25 ILE H H 25 9.370 8.153 1.217 1
1 309 . 19 1 1 A 25 25 ILE HA H 25 4.480 4.288 0.192 1
1 319 . 19 1 1 A 25 25 ILE C C 25 178.200 175.701 2.499 1
1 320 . 19 1 1 A 25 25 ILE CA C 25 59.200 61.181 -1.981 1
1 321 . 19 1 1 A 25 25 ILE CB C 25 35.400 38.064 -2.664 1
1 325 . 19 1 1 A 25 25 ILE N N 25 120.600 120.661 -0.061 1
1 326 . 19 1 1 A 26 26 HIS H H 26 9.000 9.322 -0.322 1
1 327 . 19 1 1 A 26 26 HIS HA H 26 4.770 5.172 -0.402 1
1 330 . 19 1 1 A 26 26 HIS C C 26 172.700 173.519 -0.819 1
1 331 . 19 1 1 A 26 26 HIS CA C 26 55.000 54.549 0.451 1
1 332 . 19 1 1 A 26 26 HIS CB C 26 31.100 33.617 -2.517 1
1 333 . 19 1 1 A 26 26 HIS N N 26 123.800 125.330 -1.530 1
1 334 . 19 1 1 A 27 27 LYS H H 27 8.930 8.956 -0.026 1
1 335 . 19 1 1 A 27 27 LYS HA H 27 4.770 4.809 -0.039 1
1 344 . 19 1 1 A 27 27 LYS C C 27 175.300 174.781 0.519 1
1 345 . 19 1 1 A 27 27 LYS CA C 27 55.100 54.754 0.346 1
1 346 . 19 1 1 A 27 27 LYS CB C 27 34.400 34.989 -0.589 1
1 350 . 19 1 1 A 27 27 LYS N N 27 125.900 123.679 2.221 1
1 351 . 19 1 1 A 28 28 LYS H H 28 8.880 8.210 0.670 1
1 352 . 19 1 1 A 28 28 LYS HA H 28 4.570 4.894 -0.324 1
1 361 . 19 1 1 A 28 28 LYS C C 28 174.500 173.745 0.755 1
1 362 . 19 1 1 A 28 28 LYS CA C 28 54.600 55.107 -0.507 1
1 363 . 19 1 1 A 28 28 LYS CB C 28 35.300 36.778 -1.478 1
1 367 . 19 1 1 A 28 28 LYS N N 28 127.400 126.398 1.002 1
1 368 . 19 1 1 A 29 29 GLU H H 29 8.440 8.522 -0.082 1
1 369 . 19 1 1 A 29 29 GLU HA H 29 5.260 5.155 0.105 1
1 374 . 19 1 1 A 29 29 GLU C C 29 175.800 175.695 0.105 1
1 375 . 19 1 1 A 29 29 GLU CA C 29 54.800 54.788 0.012 1
1 376 . 19 1 1 A 29 29 GLU CB C 29 31.500 33.181 -1.681 1
1 378 . 19 1 1 A 29 29 GLU N N 29 122.200 124.551 -2.351 1
1 379 . 19 1 1 A 30 30 TYR H H 30 8.960 8.850 0.110 1
1 380 . 19 1 1 A 30 30 TYR HA H 30 4.820 5.467 -0.647 1
1 387 . 19 1 1 A 30 30 TYR C C 30 172.600 172.948 -0.348 1
1 388 . 19 1 1 A 30 30 TYR CA C 30 56.300 55.464 0.836 1
1 389 . 19 1 1 A 30 30 TYR CB C 30 40.500 41.820 -1.320 1
1 394 . 19 1 1 A 30 30 TYR N N 30 121.100 118.851 2.249 1
1 395 . 19 1 1 A 31 31 GLU H H 31 8.610 8.827 -0.217 1
1 396 . 19 1 1 A 31 31 GLU HA H 31 4.810 4.506 0.304 1
1 401 . 19 1 1 A 31 31 GLU C C 31 176.100 176.180 -0.080 1
1 402 . 19 1 1 A 31 31 GLU CA C 31 55.100 55.701 -0.601 1
1 403 . 19 1 1 A 31 31 GLU CB C 31 30.300 29.829 0.471 1
1 405 . 19 1 1 A 31 31 GLU N N 31 121.800 120.848 0.952 1
1 406 . 19 1 1 A 32 32 SER H H 32 8.570 8.818 -0.248 1
1 407 . 19 1 1 A 32 32 SER HA H 32 4.520 4.618 -0.098 1
1 410 . 19 1 1 A 32 32 SER C C 32 174.300 173.043 1.257 1
1 411 . 19 1 1 A 32 32 SER CA C 32 57.300 56.778 0.522 1
1 412 . 19 1 1 A 32 32 SER CB C 32 64.100 64.961 -0.861 1
1 413 . 19 1 1 A 32 32 SER N N 32 118.500 120.299 -1.799 1
1 414 . 19 1 1 A 33 33 ASP H H 33 9.290 8.554 0.736 1
1 415 . 19 1 1 A 33 33 ASP HA H 33 4.340 4.483 -0.143 1
1 418 . 19 1 1 A 33 33 ASP C C 33 175.900 176.926 -1.026 1
1 419 . 19 1 1 A 33 33 ASP CA C 33 55.000 53.578 1.422 1
1 420 . 19 1 1 A 33 33 ASP CB C 33 39.300 39.365 -0.065 1
1 421 . 19 1 1 A 33 33 ASP N N 33 125.700 123.195 2.505 1
1 422 . 19 1 1 A 34 34 GLY H H 34 8.690 9.058 -0.368 1
1 423 . 19 1 1 A 34 34 GLY HA2 H 34 3.660 3.881 -0.221 1
1 424 . 19 1 1 A 34 34 GLY HA3 H 34 4.140 3.883 0.257 1
1 425 . 19 1 1 A 34 34 GLY C C 34 174.200 173.643 0.557 1
1 426 . 19 1 1 A 34 34 GLY CA C 34 45.600 46.113 -0.513 1
1 427 . 19 1 1 A 34 34 GLY N N 34 104.800 111.609 -6.809 1
1 428 . 19 1 1 A 35 35 THR H H 35 7.840 7.649 0.191 1
1 429 . 19 1 1 A 35 35 THR HA H 35 4.660 4.772 -0.112 1
1 434 . 19 1 1 A 35 35 THR C C 35 173.000 173.300 -0.300 1
1 435 . 19 1 1 A 35 35 THR CA C 35 60.200 61.181 -0.981 1
1 436 . 19 1 1 A 35 35 THR CB C 35 71.200 72.123 -0.923 1
1 438 . 19 1 1 A 35 35 THR N N 35 114.800 114.963 -0.163 1
1 439 . 19 1 1 A 36 36 THR H H 36 8.480 8.720 -0.240 1
1 440 . 19 1 1 A 36 36 THR HA H 36 4.620 4.567 0.053 1
1 445 . 19 1 1 A 36 36 THR C C 36 173.800 174.141 -0.341 1
1 446 . 19 1 1 A 36 36 THR CA C 36 62.300 62.703 -0.403 1
1 447 . 19 1 1 A 36 36 THR CB C 36 69.500 69.308 0.192 1
1 449 . 19 1 1 A 36 36 THR N N 36 119.400 121.501 -2.101 1
1 450 . 19 1 1 A 37 37 LYS H H 37 8.880 8.526 0.354 1
1 451 . 19 1 1 A 37 37 LYS HA H 37 4.570 4.913 -0.343 1
1 460 . 19 1 1 A 37 37 LYS C C 37 174.500 176.020 -1.520 1
1 461 . 19 1 1 A 37 37 LYS CA C 37 54.600 54.039 0.561 1
1 462 . 19 1 1 A 37 37 LYS CB C 37 35.500 36.032 -0.532 1
1 466 . 19 1 1 A 37 37 LYS N N 37 128.000 126.075 1.925 1
1 467 . 19 1 1 A 38 38 SER H H 38 8.370 8.751 -0.381 1
1 468 . 19 1 1 A 38 38 SER HA H 38 5.250 5.058 0.192 1
1 471 . 19 1 1 A 38 38 SER C C 38 173.200 173.751 -0.551 1
1 472 . 19 1 1 A 38 38 SER CA C 38 57.900 57.190 0.710 1
1 473 . 19 1 1 A 38 38 SER CB C 38 65.500 64.669 0.831 1
1 474 . 19 1 1 A 38 38 SER N N 38 114.300 117.088 -2.788 1
1 475 . 19 1 1 A 39 39 VAL H H 39 9.020 8.783 0.237 1
1 476 . 19 1 1 A 39 39 VAL HA H 39 4.900 5.004 -0.104 1
1 484 . 19 1 1 A 39 39 VAL C C 39 173.200 172.913 0.287 1
1 485 . 19 1 1 A 39 39 VAL CA C 39 59.200 59.704 -0.504 1
1 486 . 19 1 1 A 39 39 VAL CB C 39 34.600 35.500 -0.900 1
1 489 . 19 1 1 A 39 39 VAL N N 39 123.600 120.847 2.753 1
1 490 . 19 1 1 A 40 40 TYR H H 40 8.900 8.786 0.114 1
1 491 . 19 1 1 A 40 40 TYR HA H 40 4.730 5.206 -0.476 1
1 498 . 19 1 1 A 40 40 TYR CA C 40 56.500 57.065 -0.565 1
1 499 . 19 1 1 A 40 40 TYR CB C 40 39.000 40.161 -1.161 1
1 504 . 19 1 1 A 40 40 TYR N N 40 126.300 127.048 -0.748 1
1 505 . 19 1 1 A 41 41 GLN H H 41 8.630 8.762 -0.132 1
1 506 . 19 1 1 A 41 41 GLN HA H 41 5.330 5.397 -0.067 1
1 513 . 19 1 1 A 41 41 GLN C C 41 175.500 175.656 -0.156 1
1 514 . 19 1 1 A 41 41 GLN CA C 41 53.800 54.259 -0.459 1
1 515 . 19 1 1 A 41 41 GLN CB C 41 32.100 32.443 -0.343 1
1 518 . 19 1 1 A 41 41 GLN N N 41 122.000 121.632 0.368 1
1 520 . 19 1 1 A 42 42 GLY H H 42 8.560 7.858 0.702 1
1 521 . 19 1 1 A 42 42 GLY HA2 H 42 3.680 4.300 -0.620 1
1 522 . 19 1 1 A 42 42 GLY HA3 H 42 4.020 4.327 -0.307 1
1 523 . 19 1 1 A 42 42 GLY C C 42 171.600 171.100 0.500 1
1 524 . 19 1 1 A 42 42 GLY CA C 42 47.300 46.158 1.142 1
1 525 . 19 1 1 A 42 42 GLY N N 42 113.000 108.630 4.370 1
1 526 . 19 1 1 A 43 43 TYR H H 43 9.320 8.611 0.709 1
1 527 . 19 1 1 A 43 43 TYR HA H 43 5.280 5.420 -0.140 1
1 534 . 19 1 1 A 43 43 TYR C C 43 173.200 174.058 -0.858 1
1 535 . 19 1 1 A 43 43 TYR CA C 43 57.600 56.378 1.222 1
1 536 . 19 1 1 A 43 43 TYR CB C 43 42.400 42.185 0.215 1
1 541 . 19 1 1 A 43 43 TYR N N 43 126.300 118.936 7.364 1
1 542 . 19 1 1 A 44 44 ILE H H 44 9.160 8.743 0.417 1
1 543 . 19 1 1 A 44 44 ILE HA H 44 5.270 5.390 -0.120 1
1 553 . 19 1 1 A 44 44 ILE C C 44 172.900 173.538 -0.638 1
1 554 . 19 1 1 A 44 44 ILE CA C 44 59.000 59.543 -0.543 1
1 555 . 19 1 1 A 44 44 ILE CB C 44 42.200 41.996 0.204 1
1 559 . 19 1 1 A 44 44 ILE N N 44 117.700 123.210 -5.510 1
1 560 . 19 1 1 A 45 45 GLU H H 45 8.420 8.728 -0.308 1
1 561 . 19 1 1 A 45 45 GLU HA H 45 5.600 5.460 0.140 1
1 566 . 19 1 1 A 45 45 GLU C C 45 174.300 174.391 -0.091 1
1 567 . 19 1 1 A 45 45 GLU CA C 45 54.000 54.637 -0.637 1
1 568 . 19 1 1 A 45 45 GLU CB C 45 34.400 33.727 0.673 1
1 570 . 19 1 1 A 45 45 GLU N N 45 123.600 128.000 -4.400 1
1 571 . 19 1 1 A 46 46 ASP H H 46 8.530 8.571 -0.041 1
1 572 . 19 1 1 A 46 46 ASP HA H 46 5.070 4.912 0.158 1
1 575 . 19 1 1 A 46 46 ASP C C 46 175.000 175.283 -0.283 1
1 576 . 19 1 1 A 46 46 ASP CA C 46 51.800 52.996 -1.196 1
1 577 . 19 1 1 A 46 46 ASP CB C 46 41.300 43.389 -2.089 1
1 578 . 19 1 1 A 46 46 ASP N N 46 125.500 124.168 1.332 1
1 579 . 19 1 1 A 47 47 ASP H H 47 9.160 8.675 0.485 1
1 580 . 19 1 1 A 47 47 ASP HA H 47 4.430 4.561 -0.131 1
1 583 . 19 1 1 A 47 47 ASP C C 47 176.000 177.516 -1.516 1
1 584 . 19 1 1 A 47 47 ASP CA C 47 55.000 55.500 -0.500 1
1 585 . 19 1 1 A 47 47 ASP CB C 47 38.900 40.835 -1.935 1
1 586 . 19 1 1 A 47 47 ASP N N 47 114.200 121.970 -7.770 1
1 587 . 19 1 1 A 48 48 THR H H 48 9.470 7.725 1.745 1
1 588 . 19 1 1 A 48 48 THR HA H 48 4.520 4.558 -0.038 1
1 593 . 19 1 1 A 48 48 THR C C 48 174.500 175.052 -0.552 1
1 594 . 19 1 1 A 48 48 THR CA C 48 62.600 62.305 0.295 1
1 595 . 19 1 1 A 48 48 THR CB C 48 70.400 69.739 0.661 1
1 597 . 19 1 1 A 48 48 THR N N 48 111.800 107.067 4.733 1
1 598 . 19 1 1 A 49 49 ALA H H 49 7.850 7.503 0.347 1
1 599 . 19 1 1 A 49 49 ALA HA H 49 4.440 4.421 0.019 1
1 603 . 19 1 1 A 49 49 ALA C C 49 173.200 175.381 -2.181 1
1 604 . 19 1 1 A 49 49 ALA CA C 49 52.700 51.382 1.318 1
1 605 . 19 1 1 A 49 49 ALA CB C 49 21.300 20.083 1.217 1
1 606 . 19 1 1 A 49 49 ALA N N 49 123.400 120.911 2.489 1
1 607 . 19 1 1 A 50 50 ARG H H 50 8.160 8.705 -0.545 1
1 608 . 19 1 1 A 50 50 ARG HA H 50 5.350 5.518 -0.168 1
1 616 . 19 1 1 A 50 50 ARG C C 50 174.700 174.363 0.337 1
1 617 . 19 1 1 A 50 50 ARG CA C 50 54.000 54.342 -0.342 1
1 618 . 19 1 1 A 50 50 ARG CB C 50 34.500 34.297 0.203 1
1 622 . 19 1 1 A 50 50 ARG N N 50 117.400 114.932 2.468 1
1 624 . 19 1 1 A 51 51 ILE H H 51 9.390 8.652 0.738 1
1 625 . 19 1 1 A 51 51 ILE HA H 51 4.790 5.084 -0.294 1
1 635 . 19 1 1 A 51 51 ILE C C 51 172.600 174.751 -2.151 1
1 636 . 19 1 1 A 51 51 ILE CA C 51 60.000 58.874 1.126 1
1 637 . 19 1 1 A 51 51 ILE CB C 51 42.800 42.111 0.689 1
1 641 . 19 1 1 A 51 51 ILE N N 51 124.600 120.937 3.663 1
1 642 . 19 1 1 A 52 52 ARG H H 52 7.980 8.341 -0.361 1
1 643 . 19 1 1 A 52 52 ARG HA H 52 4.170 4.252 -0.082 1
1 651 . 19 1 1 A 52 52 ARG C C 52 174.600 176.324 -1.724 1
1 652 . 19 1 1 A 52 52 ARG CA C 52 57.100 56.052 1.048 1
1 653 . 19 1 1 A 52 52 ARG CB C 52 31.300 30.848 0.452 1
1 657 . 19 1 1 A 52 52 ARG N N 52 125.900 125.623 0.277 1
1 659 . 19 1 1 A 53 53 ILE H H 53 8.290 8.588 -0.298 1
1 660 . 19 1 1 A 53 53 ILE HA H 53 5.160 5.244 -0.084 1
1 670 . 19 1 1 A 53 53 ILE C C 53 172.400 174.125 -1.725 1
1 671 . 19 1 1 A 53 53 ILE CA C 53 58.600 59.332 -0.732 1
1 672 . 19 1 1 A 53 53 ILE CB C 53 41.900 42.456 -0.556 1
1 676 . 19 1 1 A 53 53 ILE N N 53 118.500 119.452 -0.952 1
1 677 . 19 1 1 A 54 54 SER H H 54 8.350 8.757 -0.407 1
1 678 . 19 1 1 A 54 54 SER HA H 54 5.070 5.332 -0.262 1
1 681 . 19 1 1 A 54 54 SER C C 54 172.400 172.851 -0.451 1
1 682 . 19 1 1 A 54 54 SER CA C 54 57.000 56.884 0.116 1
1 683 . 19 1 1 A 54 54 SER CB C 54 65.900 65.289 0.611 1
1 684 . 19 1 1 A 54 54 SER N N 54 120.700 119.093 1.607 1
1 685 . 19 1 1 A 55 55 SER H H 55 9.130 8.813 0.317 1
1 686 . 19 1 1 A 55 55 SER HA H 55 5.270 5.277 -0.007 1
1 690 . 19 1 1 A 55 55 SER C C 55 174.400 172.793 1.607 1
1 691 . 19 1 1 A 55 55 SER CA C 55 55.500 56.229 -0.729 1
1 692 . 19 1 1 A 55 55 SER CB C 55 64.500 65.831 -1.331 1
1 693 . 19 1 1 A 55 55 SER N N 55 117.200 118.112 -0.912 1
1 694 . 19 1 1 A 56 56 PHE H H 56 8.970 8.590 0.380 1
1 695 . 19 1 1 A 56 56 PHE HA H 56 4.600 4.942 -0.342 1
1 703 . 19 1 1 A 56 56 PHE C C 56 176.500 177.153 -0.653 1
1 704 . 19 1 1 A 56 56 PHE CA C 56 58.300 57.493 0.807 1
1 705 . 19 1 1 A 56 56 PHE CB C 56 37.900 40.751 -2.851 1
1 711 . 19 1 1 A 56 56 PHE N N 56 129.400 122.932 6.468 1
1 712 . 19 1 1 A 57 57 GLY H H 57 8.570 8.906 -0.336 1
1 713 . 19 1 1 A 57 57 GLY HA2 H 57 4.020 4.151 -0.131 1
1 714 . 19 1 1 A 57 57 GLY HA3 H 57 4.380 4.191 0.189 1
1 715 . 19 1 1 A 57 57 GLY C C 57 173.700 174.094 -0.394 1
1 716 . 19 1 1 A 57 57 GLY CA C 57 46.300 45.755 0.545 1
1 717 . 19 1 1 A 57 57 GLY N N 57 112.500 112.223 0.277 1
1 718 . 19 1 1 A 58 58 LYS H H 58 6.800 8.570 -1.770 1
1 719 . 19 1 1 A 58 58 LYS HA H 58 4.410 4.349 0.061 1
1 728 . 19 1 1 A 58 58 LYS C C 58 174.800 175.433 -0.633 1
1 729 . 19 1 1 A 58 58 LYS CA C 58 55.200 56.431 -1.231 1
1 730 . 19 1 1 A 58 58 LYS CB C 58 33.300 33.363 -0.063 1
1 734 . 19 1 1 A 58 58 LYS N N 58 118.700 121.116 -2.416 1
1 735 . 19 1 1 A 59 59 GLN H H 59 8.390 8.469 -0.079 1
1 736 . 19 1 1 A 59 59 GLN HA H 59 1.830 3.707 -1.877 1
1 743 . 19 1 1 A 59 59 GLN C C 59 174.100 174.309 -0.209 1
1 744 . 19 1 1 A 59 59 GLN CA C 59 57.100 54.298 2.802 1
1 745 . 19 1 1 A 59 59 GLN CB C 59 28.900 29.747 -0.847 1
1 748 . 19 1 1 A 59 59 GLN N N 59 124.000 123.074 0.926 1
1 750 . 19 1 1 A 60 60 LEU H H 60 5.320 8.273 -2.953 1
1 751 . 19 1 1 A 60 60 LEU HA H 60 4.370 5.064 -0.694 1
1 761 . 19 1 1 A 60 60 LEU CA C 60 52.800 53.479 -0.679 1
1 762 . 19 1 1 A 60 60 LEU CB C 60 46.700 45.096 1.604 1
1 766 . 19 1 1 A 60 60 LEU N N 60 121.800 123.893 -2.093 1
1 767 . 19 1 1 A 61 61 GLN H H 61 8.660 8.908 -0.248 1
1 768 . 19 1 1 A 61 61 GLN HA H 61 4.440 4.727 -0.287 1
1 775 . 19 1 1 A 61 61 GLN C C 61 174.000 174.889 -0.889 1
1 776 . 19 1 1 A 61 61 GLN CA C 61 53.800 53.847 -0.047 1
1 777 . 19 1 1 A 61 61 GLN CB C 61 31.800 31.680 0.120 1
1 780 . 19 1 1 A 61 61 GLN N N 61 120.300 120.336 -0.036 1
1 782 . 19 1 1 A 62 62 ASP H H 62 8.450 8.727 -0.277 1
1 783 . 19 1 1 A 62 62 ASP HA H 62 4.130 4.357 -0.227 1
1 786 . 19 1 1 A 62 62 ASP C C 62 177.200 176.907 0.293 1
1 787 . 19 1 1 A 62 62 ASP CA C 62 55.700 55.370 0.330 1
1 788 . 19 1 1 A 62 62 ASP CB C 62 39.400 40.791 -1.391 1
1 789 . 19 1 1 A 62 62 ASP N N 62 122.400 123.987 -1.587 1
1 790 . 19 1 1 A 63 63 SER H H 63 9.210 8.862 0.348 1
1 791 . 19 1 1 A 63 63 SER HA H 63 3.850 4.172 -0.322 1
1 794 . 19 1 1 A 63 63 SER C C 63 173.200 173.068 0.132 1
1 795 . 19 1 1 A 63 63 SER CA C 63 61.700 58.961 2.739 1
1 796 . 19 1 1 A 63 63 SER CB C 63 61.800 60.724 1.076 1
1 797 . 19 1 1 A 63 63 SER N N 63 114.300 120.616 -6.316 1
1 798 . 19 1 1 A 64 64 ASP H H 64 7.960 7.660 0.300 1
1 799 . 19 1 1 A 64 64 ASP HA H 64 4.540 5.247 -0.707 1
1 802 . 19 1 1 A 64 64 ASP C C 64 174.900 174.340 0.560 1
1 803 . 19 1 1 A 64 64 ASP CA C 64 54.900 53.473 1.427 1
1 804 . 19 1 1 A 64 64 ASP CB C 64 40.900 43.888 -2.988 1
1 805 . 19 1 1 A 64 64 ASP N N 64 122.600 120.883 1.717 1
1 806 . 19 1 1 A 65 65 VAL H H 65 8.180 8.801 -0.621 1
1 807 . 19 1 1 A 65 65 VAL HA H 65 4.670 4.625 0.045 1
1 815 . 19 1 1 A 65 65 VAL C C 65 175.900 175.674 0.226 1
1 816 . 19 1 1 A 65 65 VAL CA C 65 62.300 62.417 -0.117 1
1 817 . 19 1 1 A 65 65 VAL CB C 65 31.700 30.955 0.745 1
1 820 . 19 1 1 A 65 65 VAL N N 65 123.100 124.703 -1.603 1
1 821 . 19 1 1 A 66 66 VAL H H 66 8.770 8.881 -0.111 1
1 822 . 19 1 1 A 66 66 VAL HA H 66 5.160 5.136 0.024 1
1 830 . 19 1 1 A 66 66 VAL C C 66 173.600 173.337 0.263 1
1 831 . 19 1 1 A 66 66 VAL CA C 66 58.100 58.742 -0.642 1
1 832 . 19 1 1 A 66 66 VAL CB C 66 35.700 35.995 -0.295 1
1 835 . 19 1 1 A 66 66 VAL N N 66 118.100 120.881 -2.781 1
1 836 . 19 1 1 A 67 67 ARG H H 67 8.880 9.062 -0.182 1
1 837 . 19 1 1 A 67 67 ARG HA H 67 5.110 5.105 0.005 1
1 845 . 19 1 1 A 67 67 ARG C C 67 175.300 174.691 0.609 1
1 846 . 19 1 1 A 67 67 ARG CA C 67 54.200 54.389 -0.189 1
1 847 . 19 1 1 A 67 67 ARG CB C 67 32.200 33.621 -1.421 1
1 851 . 19 1 1 A 67 67 ARG N N 67 120.200 121.769 -1.569 1
1 853 . 19 1 1 A 68 68 ILE H H 68 9.220 8.987 0.233 1
1 854 . 19 1 1 A 68 68 ILE HA H 68 4.990 4.689 0.301 1
1 864 . 19 1 1 A 68 68 ILE C C 68 174.900 174.697 0.203 1
1 865 . 19 1 1 A 68 68 ILE CA C 68 58.600 59.649 -1.049 1
1 866 . 19 1 1 A 68 68 ILE CB C 68 39.300 38.660 0.640 1
1 870 . 19 1 1 A 68 68 ILE N N 68 127.200 128.282 -1.082 1
1 871 . 19 1 1 A 69 69 ASP H H 69 9.110 8.884 0.226 1
1 872 . 19 1 1 A 69 69 ASP HA H 69 5.370 5.053 0.317 1
1 875 . 19 1 1 A 69 69 ASP C C 69 175.800 176.402 -0.602 1
1 876 . 19 1 1 A 69 69 ASP CA C 69 52.400 52.678 -0.278 1
1 877 . 19 1 1 A 69 69 ASP CB C 69 43.700 43.147 0.553 1
1 878 . 19 1 1 A 69 69 ASP N N 69 123.400 125.821 -2.421 1
1 879 . 19 1 1 A 70 70 ASN H H 70 8.300 9.092 -0.792 1
1 880 . 19 1 1 A 70 70 ASN HA H 70 4.160 4.397 -0.237 1
1 885 . 19 1 1 A 70 70 ASN C C 70 176.300 174.598 1.702 1
1 886 . 19 1 1 A 70 70 ASN CA C 70 54.300 54.300 0.000 1
1 887 . 19 1 1 A 70 70 ASN CB C 70 37.500 37.718 -0.218 1
1 889 . 19 1 1 A 70 70 ASN N N 70 119.800 121.141 -1.341 1
1 891 . 19 1 1 A 71 71 ALA H H 71 9.100 7.880 1.220 1
1 892 . 19 1 1 A 71 71 ALA HA H 71 4.500 4.491 0.009 1
1 896 . 19 1 1 A 71 71 ALA C C 71 175.700 176.670 -0.970 1
1 897 . 19 1 1 A 71 71 ALA CA C 71 51.900 52.399 -0.499 1
1 898 . 19 1 1 A 71 71 ALA CB C 71 19.600 19.696 -0.096 1
1 899 . 19 1 1 A 71 71 ALA N N 71 123.000 121.192 1.808 1
1 900 . 19 1 1 A 72 72 ARG H H 72 8.490 8.467 0.023 1
1 901 . 19 1 1 A 72 72 ARG HA H 72 4.720 4.612 0.108 1
1 909 . 19 1 1 A 72 72 ARG C C 72 175.800 175.563 0.237 1
1 910 . 19 1 1 A 72 72 ARG CA C 72 54.400 55.185 -0.785 1
1 911 . 19 1 1 A 72 72 ARG CB C 72 32.700 31.362 1.338 1
1 915 . 19 1 1 A 72 72 ARG N N 72 122.500 124.078 -1.578 1
1 917 . 19 1 1 A 73 73 VAL H H 73 8.310 8.248 0.062 1
1 918 . 19 1 1 A 73 73 VAL HA H 73 4.250 4.494 -0.244 1
1 926 . 19 1 1 A 73 73 VAL C C 73 174.600 175.465 -0.865 1
1 927 . 19 1 1 A 73 73 VAL CA C 73 62.800 61.804 0.996 1
1 928 . 19 1 1 A 73 73 VAL CB C 73 32.100 31.895 0.205 1
1 931 . 19 1 1 A 73 73 VAL N N 73 127.100 126.488 0.612 1
1 932 . 19 1 1 A 74 74 ALA H H 74 8.880 9.110 -0.230 1
1 933 . 19 1 1 A 74 74 ALA HA H 74 4.500 5.095 -0.595 1
1 937 . 19 1 1 A 74 74 ALA C C 74 174.800 174.769 0.031 1
1 938 . 19 1 1 A 74 74 ALA CA C 74 50.500 50.103 0.397 1
1 939 . 19 1 1 A 74 74 ALA CB C 74 22.500 23.889 -1.389 1
1 940 . 19 1 1 A 74 74 ALA N N 74 131.000 129.067 1.933 1
1 941 . 19 1 1 A 75 75 GLN H H 75 8.280 8.591 -0.311 1
1 942 . 19 1 1 A 75 75 GLN HA H 75 4.910 4.974 -0.064 1
1 949 . 19 1 1 A 75 75 GLN C C 75 175.100 175.185 -0.085 1
1 950 . 19 1 1 A 75 75 GLN CA C 75 54.600 54.188 0.412 1
1 951 . 19 1 1 A 75 75 GLN CB C 75 31.400 32.137 -0.737 1
1 954 . 19 1 1 A 75 75 GLN N N 75 118.800 120.450 -1.650 1
1 956 . 19 1 1 A 76 76 PHE H H 76 8.710 9.503 -0.793 1
1 957 . 19 1 1 A 76 76 PHE HA H 76 4.660 4.859 -0.199 1
1 965 . 19 1 1 A 76 76 PHE C C 76 174.900 177.402 -2.502 1
1 966 . 19 1 1 A 76 76 PHE CA C 76 57.000 57.987 -0.987 1
1 967 . 19 1 1 A 76 76 PHE CB C 76 41.000 40.097 0.903 1
1 973 . 19 1 1 A 76 76 PHE N N 76 125.000 125.043 -0.043 1
1 974 . 19 1 1 A 77 77 ASN H H 77 9.040 9.108 -0.068 1
1 975 . 19 1 1 A 77 77 ASN HA H 77 4.170 4.502 -0.332 1
1 980 . 19 1 1 A 77 77 ASN C C 77 174.200 176.032 -1.832 1
1 981 . 19 1 1 A 77 77 ASN CA C 77 53.800 55.600 -1.800 1
1 982 . 19 1 1 A 77 77 ASN CB C 77 37.400 38.570 -1.170 1
1 984 . 19 1 1 A 77 77 ASN N N 77 123.200 119.701 3.499 1
1 986 . 19 1 1 A 78 78 GLY H H 78 8.370 7.657 0.713 1
1 987 . 19 1 1 A 78 78 GLY HA2 H 78 3.410 3.851 -0.441 1
1 988 . 19 1 1 A 78 78 GLY HA3 H 78 3.980 3.987 -0.007 1
1 989 . 19 1 1 A 78 78 GLY C C 78 173.800 172.863 0.937 1
1 990 . 19 1 1 A 78 78 GLY CA C 78 45.000 45.167 -0.167 1
1 991 . 19 1 1 A 78 78 GLY N N 78 103.300 105.555 -2.255 1
1 992 . 19 1 1 A 79 79 TYR H H 79 7.670 8.107 -0.437 1
1 993 . 19 1 1 A 79 79 TYR HA H 79 4.860 5.187 -0.327 1
1 1000 . 19 1 1 A 79 79 TYR C C 79 174.800 175.408 -0.608 1
1 1001 . 19 1 1 A 79 79 TYR CA C 79 56.300 56.370 -0.070 1
1 1002 . 19 1 1 A 79 79 TYR CB C 79 40.800 42.728 -1.928 1
1 1007 . 19 1 1 A 79 79 TYR N N 79 118.700 118.383 0.317 1
1 1008 . 19 1 1 A 80 80 LEU H H 80 8.760 8.550 0.210 1
1 1009 . 19 1 1 A 80 80 LEU HA H 80 4.830 4.463 0.367 1
1 1019 . 19 1 1 A 80 80 LEU C C 80 176.200 176.234 -0.034 1
1 1020 . 19 1 1 A 80 80 LEU CA C 80 54.700 55.104 -0.404 1
1 1021 . 19 1 1 A 80 80 LEU CB C 80 43.500 42.721 0.779 1
1 1025 . 19 1 1 A 80 80 LEU N N 80 122.600 125.540 -2.940 1
1 1026 . 19 1 1 A 81 81 SER H H 81 8.650 8.647 0.003 1
1 1027 . 19 1 1 A 81 81 SER HA H 81 4.860 5.322 -0.462 1
1 1030 . 19 1 1 A 81 81 SER C C 81 172.600 172.393 0.207 1
1 1031 . 19 1 1 A 81 81 SER CA C 81 56.600 57.370 -0.770 1
1 1032 . 19 1 1 A 81 81 SER CB C 81 66.300 66.427 -0.127 1
1 1033 . 19 1 1 A 81 81 SER N N 81 114.700 116.926 -2.226 1
1 1034 . 19 1 1 A 82 82 LEU H H 82 8.680 8.718 -0.038 1
1 1035 . 19 1 1 A 82 82 LEU HA H 82 5.190 5.315 -0.125 1
1 1045 . 19 1 1 A 82 82 LEU C C 82 177.100 175.547 1.553 1
1 1046 . 19 1 1 A 82 82 LEU CA C 82 53.300 53.840 -0.540 1
1 1047 . 19 1 1 A 82 82 LEU CB C 82 43.800 44.245 -0.445 1
1 1051 . 19 1 1 A 82 82 LEU N N 82 119.800 122.394 -2.594 1
1 1052 . 19 1 1 A 83 83 SER H H 83 9.560 9.360 0.200 1
1 1053 . 19 1 1 A 83 83 SER HA H 83 5.390 5.652 -0.262 1
1 1056 . 19 1 1 A 83 83 SER C C 83 174.200 173.558 0.642 1
1 1057 . 19 1 1 A 83 83 SER CA C 83 57.100 56.525 0.575 1
1 1058 . 19 1 1 A 83 83 SER CB C 83 64.400 64.772 -0.372 1
1 1059 . 19 1 1 A 83 83 SER N N 83 119.000 118.816 0.184 1
1 1060 . 19 1 1 A 84 84 VAL H H 84 9.150 9.349 -0.199 1
1 1061 . 19 1 1 A 84 84 VAL HA H 84 4.490 4.729 -0.239 1
1 1069 . 19 1 1 A 84 84 VAL C C 84 174.700 175.990 -1.290 1
1 1070 . 19 1 1 A 84 84 VAL CA C 84 61.300 61.236 0.064 1
1 1071 . 19 1 1 A 84 84 VAL CB C 84 33.000 32.672 0.328 1
1 1074 . 19 1 1 A 84 84 VAL N N 84 128.300 125.385 2.915 1
1 1075 . 19 1 1 A 85 85 GLY H H 85 7.970 8.809 -0.839 1
1 1076 . 19 1 1 A 85 85 GLY HA2 H 85 4.030 4.297 -0.267 1
1 1077 . 19 1 1 A 85 85 GLY HA3 H 85 4.840 4.402 0.438 1
1 1078 . 19 1 1 A 85 85 GLY C C 85 175.800 174.531 1.269 1
1 1079 . 19 1 1 A 85 85 GLY CA C 85 44.800 44.359 0.441 1
1 1080 . 19 1 1 A 85 85 GLY N N 85 114.300 115.226 -0.926 1
1 1081 . 19 1 1 A 86 86 ASP H H 86 8.860 8.945 -0.085 1
1 1082 . 19 1 1 A 86 86 ASP HA H 86 4.370 4.502 -0.132 1
1 1085 . 19 1 1 A 86 86 ASP C C 86 177.400 176.880 0.520 1
1 1086 . 19 1 1 A 86 86 ASP CA C 86 57.400 56.422 0.978 1
1 1087 . 19 1 1 A 86 86 ASP CB C 86 40.600 40.254 0.346 1
1 1088 . 19 1 1 A 86 86 ASP N N 86 122.500 120.109 2.391 1
1 1089 . 19 1 1 A 87 87 SER H H 87 8.540 7.704 0.836 1
1 1090 . 19 1 1 A 87 87 SER HA H 87 4.620 4.433 0.187 1
1 1093 . 19 1 1 A 87 87 SER C C 87 174.700 174.588 0.112 1
1 1094 . 19 1 1 A 87 87 SER CA C 87 58.200 58.721 -0.521 1
1 1095 . 19 1 1 A 87 87 SER CB C 87 63.300 63.848 -0.548 1
1 1096 . 19 1 1 A 87 87 SER N N 87 112.100 112.086 0.014 1
1 1097 . 19 1 1 A 88 88 SER H H 88 7.880 7.424 0.456 1
1 1098 . 19 1 1 A 88 88 SER HA H 88 5.050 4.516 0.534 1
1 1101 . 19 1 1 A 88 88 SER C C 88 172.700 173.720 -1.020 1
1 1102 . 19 1 1 A 88 88 SER CA C 88 57.600 58.028 -0.428 1
1 1103 . 19 1 1 A 88 88 SER CB C 88 64.300 64.482 -0.182 1
1 1104 . 19 1 1 A 88 88 SER N N 88 119.200 118.778 0.422 1
1 1105 . 19 1 1 A 89 89 ARG H H 89 8.350 8.255 0.095 1
1 1106 . 19 1 1 A 89 89 ARG HA H 89 4.720 5.255 -0.535 1
1 1114 . 19 1 1 A 89 89 ARG C C 89 174.200 174.823 -0.623 1
1 1115 . 19 1 1 A 89 89 ARG CA C 89 55.000 54.404 0.596 1
1 1116 . 19 1 1 A 89 89 ARG CB C 89 33.500 34.222 -0.722 1
1 1120 . 19 1 1 A 89 89 ARG N N 89 122.800 122.116 0.684 1
1 1122 . 19 1 1 A 90 90 ILE H H 90 8.530 8.932 -0.402 1
1 1123 . 19 1 1 A 90 90 ILE HA H 90 4.790 4.895 -0.105 1
1 1133 . 19 1 1 A 90 90 ILE C C 90 175.400 175.368 0.032 1
1 1134 . 19 1 1 A 90 90 ILE CA C 90 60.600 60.157 0.443 1
1 1135 . 19 1 1 A 90 90 ILE CB C 90 40.600 40.852 -0.252 1
1 1139 . 19 1 1 A 90 90 ILE N N 90 123.100 123.023 0.077 1
1 1140 . 19 1 1 A 91 91 GLU H H 91 9.000 9.121 -0.121 1
1 1141 . 19 1 1 A 91 91 GLU HA H 91 4.730 4.966 -0.236 1
1 1146 . 19 1 1 A 91 91 GLU C C 91 175.100 176.496 -1.396 1
1 1147 . 19 1 1 A 91 91 GLU CA C 91 54.300 54.613 -0.313 1
1 1148 . 19 1 1 A 91 91 GLU CB C 91 32.400 32.007 0.393 1
1 1150 . 19 1 1 A 91 91 GLU N N 91 126.400 127.025 -0.625 1
1 1151 . 19 1 1 A 92 92 SER H H 92 8.830 8.746 0.084 1
1 1152 . 19 1 1 A 92 92 SER HA H 92 4.700 4.960 -0.260 1
1 1155 . 19 1 1 A 92 92 SER C C 92 174.600 174.475 0.125 1
1 1156 . 19 1 1 A 92 92 SER CA C 92 59.300 57.790 1.510 1
1 1157 . 19 1 1 A 92 92 SER CB C 92 63.100 64.740 -1.640 1
1 1158 . 19 1 1 A 92 92 SER N N 92 119.800 119.792 0.008 1
1 1159 . 19 1 1 A 93 93 VAL H H 93 8.350 8.302 0.048 1
1 1160 . 19 1 1 A 93 93 VAL HA H 93 4.290 4.473 -0.183 1
1 1168 . 19 1 1 A 93 93 VAL C C 93 175.100 175.282 -0.182 1
1 1169 . 19 1 1 A 93 93 VAL CA C 93 61.300 61.792 -0.492 1
1 1170 . 19 1 1 A 93 93 VAL CB C 93 33.900 33.140 0.760 1
1 1173 . 19 1 1 A 93 93 VAL N N 93 121.800 121.487 0.313 1
1 1174 . 19 1 1 A 94 94 ASN H H 94 8.510 8.731 -0.221 1
1 1175 . 19 1 1 A 94 94 ASN HA H 94 4.770 4.915 -0.145 1
1 1180 . 19 1 1 A 94 94 ASN C C 94 175.000 175.195 -0.195 1
1 1181 . 19 1 1 A 94 94 ASN CA C 94 52.700 54.805 -2.105 1
1 1182 . 19 1 1 A 94 94 ASN CB C 94 38.500 40.130 -1.630 1
1 1184 . 19 1 1 A 94 94 ASN N N 94 121.800 124.321 -2.521 1
1 1186 . 19 1 1 A 95 95 VAL H H 95 7.860 7.576 0.284 1
1 1187 . 19 1 1 A 95 95 VAL HA H 95 4.100 4.624 -0.524 1
1 1195 . 19 1 1 A 95 95 VAL C C 95 175.100 175.635 -0.535 1
1 1196 . 19 1 1 A 95 95 VAL CA C 95 61.700 60.127 1.573 1
1 1197 . 19 1 1 A 95 95 VAL CB C 95 33.100 34.318 -1.218 1
1 1200 . 19 1 1 A 95 95 VAL N N 95 119.700 114.610 5.090 1
1 1201 . 19 1 1 A 96 96 ASN H H 96 8.490 8.750 -0.260 1
1 1202 . 19 1 1 A 96 96 ASN HA H 96 4.700 4.581 0.119 1
1 1207 . 19 1 1 A 96 96 ASN C C 96 174.600 176.204 -1.604 1
1 1208 . 19 1 1 A 96 96 ASN CA C 96 53.000 53.534 -0.534 1
1 1209 . 19 1 1 A 96 96 ASN CB C 96 39.000 39.171 -0.171 1
1 1211 . 19 1 1 A 96 96 ASN N N 96 122.200 122.448 -0.248 1
1 1213 . 19 1 1 A 97 97 ILE H H 97 8.080 8.881 -0.801 1
1 1214 . 19 1 1 A 97 97 ILE HA H 97 4.370 3.920 0.450 1
1 1224 . 19 1 1 A 97 97 ILE CA C 97 58.600 62.026 -3.426 1
1 1225 . 19 1 1 A 97 97 ILE CB C 97 38.600 35.603 2.997 1
1 1229 . 19 1 1 A 97 97 ILE N N 97 123.500 122.746 0.754 1
1 1230 . 19 1 1 A 98 98 PRO HA H 98 4.360 4.506 -0.146 1
1 1237 . 19 1 1 A 98 98 PRO C C 98 176.600 177.029 -0.429 1
1 1238 . 19 1 1 A 98 98 PRO CA C 98 63.100 63.059 0.041 1
1 1239 . 19 1 1 A 98 98 PRO CB C 98 31.800 32.486 -0.686 1
1 1242 . 19 1 1 A 99 99 LEU H H 99 8.200 8.715 -0.515 1
1 1243 . 19 1 1 A 99 99 LEU HA H 99 4.200 4.364 -0.164 1
1 1253 . 19 1 1 A 99 99 LEU C C 99 177.300 177.158 0.142 1
1 1254 . 19 1 1 A 99 99 LEU CA C 99 55.000 55.255 -0.255 1
1 1255 . 19 1 1 A 99 99 LEU CB C 99 42.400 41.622 0.778 1
1 1259 . 19 1 1 A 99 99 LEU N N 99 122.500 120.505 1.995 1
1 1260 . 19 1 1 A 100 100 GLU H H 100 8.250 7.945 0.305 1
1 1261 . 19 1 1 A 100 100 GLU HA H 100 4.140 4.396 -0.256 1
1 1266 . 19 1 1 A 100 100 GLU C C 100 176.100 176.046 0.054 1
1 1267 . 19 1 1 A 100 100 GLU CA C 100 56.100 56.597 -0.497 1
1 1268 . 19 1 1 A 100 100 GLU CB C 100 29.900 30.264 -0.364 1
1 1270 . 19 1 1 A 100 100 GLU N N 100 121.000 119.810 1.190 1
1 1271 . 19 1 1 A 101 101 HIS H H 101 8.540 8.631 -0.091 1
1 1272 . 19 1 1 A 101 101 HIS HA H 101 4.600 5.085 -0.485 1
1 1275 . 19 1 1 A 101 101 HIS C C 101 174.200 175.158 -0.958 1
1 1276 . 19 1 1 A 101 101 HIS CA C 101 55.200 54.515 0.685 1
1 1277 . 19 1 1 A 101 101 HIS CB C 101 29.000 30.866 -1.866 1
1 1278 . 19 1 1 A 101 101 HIS N N 101 119.400 119.936 -0.536 1
1 1279 . 19 1 1 A 102 102 HIS H H 102 8.660 8.532 0.128 1
1 1280 . 19 1 1 A 102 102 HIS HA H 102 4.630 4.019 0.611 1
1 1283 . 19 1 1 A 102 102 HIS C C 102 174.200 176.408 -2.208 1
1 1284 . 19 1 1 A 102 102 HIS CA C 102 55.200 58.253 -3.053 1
1 1285 . 19 1 1 A 102 102 HIS CB C 102 29.100 28.327 0.773 1
1 1286 . 19 1 1 A 102 102 HIS N N 102 119.700 119.997 -0.297 1
1 1287 . 19 1 1 A 103 103 HIS H H 103 8.680 8.765 -0.085 1
1 1288 . 19 1 1 A 103 103 HIS HA H 103 4.640 4.302 0.338 1
1 1291 . 19 1 1 A 103 103 HIS C C 103 174.200 175.375 -1.175 1
1 1292 . 19 1 1 A 103 103 HIS CA C 103 55.200 59.391 -4.191 1
1 1293 . 19 1 1 A 103 103 HIS CB C 103 29.200 30.206 -1.006 1
1 1294 . 19 1 1 A 103 103 HIS N N 103 120.500 120.642 -0.142 1
1 1295 . 19 1 1 A 104 104 HIS H H 104 8.580 7.700 0.880 1
1 1296 . 19 1 1 A 104 104 HIS HA H 104 4.590 4.664 -0.074 1
1 1299 . 19 1 1 A 104 104 HIS C C 104 174.200 174.353 -0.153 1
1 1300 . 19 1 1 A 104 104 HIS CA C 104 55.200 56.921 -1.721 1
1 1301 . 19 1 1 A 104 104 HIS CB C 104 29.300 31.117 -1.817 1
1 1302 . 19 1 1 A 104 104 HIS N N 104 120.700 113.863 6.837 1
1 1303 . 19 1 1 A 105 105 HIS H H 105 8.550 8.197 0.353 1
1 1304 . 19 1 1 A 105 105 HIS HA H 105 4.610 4.530 0.080 1
1 1307 . 19 1 1 A 105 105 HIS C C 105 173.500 175.228 -1.728 1
1 1308 . 19 1 1 A 105 105 HIS CA C 105 55.400 55.281 0.119 1
1 1309 . 19 1 1 A 105 105 HIS CB C 105 28.800 29.905 -1.105 1
1 1310 . 19 1 1 A 105 105 HIS N N 105 119.000 115.109 3.891 1
1 7 . 20 1 1 A 2 2 ASP H H 2 8.890 8.269 0.621 1
1 8 . 20 1 1 A 2 2 ASP HA H 2 4.740 4.735 0.005 1
1 11 . 20 1 1 A 2 2 ASP C C 2 174.600 176.021 -1.421 1
1 12 . 20 1 1 A 2 2 ASP CA C 2 53.800 54.732 -0.932 1
1 13 . 20 1 1 A 2 2 ASP CB C 2 41.500 41.396 0.104 1
1 14 . 20 1 1 A 2 2 ASP N N 2 122.100 123.841 -1.741 1
1 15 . 20 1 1 A 3 3 LEU H H 3 8.280 8.374 -0.094 1
1 16 . 20 1 1 A 3 3 LEU HA H 3 4.420 4.753 -0.333 1
1 26 . 20 1 1 A 3 3 LEU C C 3 176.900 176.127 0.773 1
1 27 . 20 1 1 A 3 3 LEU CA C 3 55.000 55.364 -0.364 1
1 28 . 20 1 1 A 3 3 LEU CB C 3 42.700 42.636 0.064 1
1 32 . 20 1 1 A 3 3 LEU N N 3 122.300 124.939 -2.639 1
1 33 . 20 1 1 A 4 4 VAL H H 4 8.640 8.644 -0.004 1
1 34 . 20 1 1 A 4 4 VAL HA H 4 4.540 4.936 -0.396 1
1 42 . 20 1 1 A 4 4 VAL C C 4 175.800 174.902 0.898 1
1 43 . 20 1 1 A 4 4 VAL CA C 4 59.400 58.617 0.783 1
1 44 . 20 1 1 A 4 4 VAL CB C 4 35.400 35.815 -0.415 1
1 47 . 20 1 1 A 4 4 VAL N N 4 122.600 119.407 3.193 1
1 48 . 20 1 1 A 5 5 LYS H H 5 8.630 9.093 -0.463 1
1 49 . 20 1 1 A 5 5 LYS HA H 5 4.450 4.301 0.149 1
1 58 . 20 1 1 A 5 5 LYS C C 5 179.400 178.377 1.023 1
1 59 . 20 1 1 A 5 5 LYS CA C 5 53.600 56.276 -2.676 1
1 60 . 20 1 1 A 5 5 LYS CB C 5 30.900 33.012 -2.112 1
1 64 . 20 1 1 A 5 5 LYS N N 5 121.100 121.889 -0.789 1
1 65 . 20 1 1 A 6 6 ILE H H 6 10.320 8.823 1.497 1
1 66 . 20 1 1 A 6 6 ILE HA H 6 3.440 3.710 -0.270 1
1 76 . 20 1 1 A 6 6 ILE C C 6 178.300 177.586 0.714 1
1 77 . 20 1 1 A 6 6 ILE CA C 6 65.700 65.069 0.631 1
1 78 . 20 1 1 A 6 6 ILE CB C 6 35.900 37.674 -1.774 1
1 82 . 20 1 1 A 6 6 ILE N N 6 125.400 122.485 2.915 1
1 83 . 20 1 1 A 7 7 ARG H H 7 8.210 8.114 0.096 1
1 84 . 20 1 1 A 7 7 ARG HA H 7 3.850 4.032 -0.182 1
1 92 . 20 1 1 A 7 7 ARG C C 7 175.600 177.853 -2.253 1
1 93 . 20 1 1 A 7 7 ARG CA C 7 57.800 59.525 -1.725 1
1 94 . 20 1 1 A 7 7 ARG CB C 7 30.300 30.210 0.090 1
1 98 . 20 1 1 A 7 7 ARG N N 7 118.800 120.381 -1.581 1
1 100 . 20 1 1 A 8 8 ASP H H 8 7.850 8.281 -0.431 1
1 101 . 20 1 1 A 8 8 ASP HA H 8 4.700 4.641 0.059 1
1 104 . 20 1 1 A 8 8 ASP C C 8 176.100 176.391 -0.291 1
1 105 . 20 1 1 A 8 8 ASP CA C 8 54.100 53.694 0.406 1
1 106 . 20 1 1 A 8 8 ASP CB C 8 41.200 39.636 1.564 1
1 107 . 20 1 1 A 8 8 ASP N N 8 116.800 115.459 1.341 1
1 108 . 20 1 1 A 9 9 VAL H H 9 7.240 7.439 -0.199 1
1 109 . 20 1 1 A 9 9 VAL HA H 9 3.710 3.995 -0.285 1
1 117 . 20 1 1 A 9 9 VAL C C 9 174.900 176.014 -1.114 1
1 118 . 20 1 1 A 9 9 VAL CA C 9 64.300 63.352 0.948 1
1 119 . 20 1 1 A 9 9 VAL CB C 9 31.500 31.674 -0.174 1
1 122 . 20 1 1 A 9 9 VAL N N 9 121.800 122.443 -0.643 1
1 123 . 20 1 1 A 10 10 SER H H 10 8.600 8.771 -0.171 1
1 124 . 20 1 1 A 10 10 SER HA H 10 4.600 4.910 -0.310 1
1 127 . 20 1 1 A 10 10 SER CA C 10 56.700 57.182 -0.482 1
1 128 . 20 1 1 A 10 10 SER CB C 10 66.100 67.425 -1.325 1
1 129 . 20 1 1 A 10 10 SER N N 10 122.200 120.304 1.896 1
1 130 . 20 1 1 A 11 11 LEU H H 11 8.660 8.972 -0.312 1
1 131 . 20 1 1 A 11 11 LEU HA H 11 3.900 3.969 -0.069 1
1 141 . 20 1 1 A 11 11 LEU C C 11 178.100 178.995 -0.895 1
1 142 . 20 1 1 A 11 11 LEU CA C 11 56.700 57.910 -1.210 1
1 143 . 20 1 1 A 11 11 LEU CB C 11 41.400 41.238 0.162 1
1 147 . 20 1 1 A 11 11 LEU N N 11 120.300 125.402 -5.102 1
1 148 . 20 1 1 A 12 12 SER H H 12 8.160 8.088 0.072 1
1 149 . 20 1 1 A 12 12 SER HA H 12 4.270 4.244 0.026 1
1 152 . 20 1 1 A 12 12 SER C C 12 174.200 174.958 -0.758 1
1 153 . 20 1 1 A 12 12 SER CA C 12 59.900 60.557 -0.657 1
1 154 . 20 1 1 A 12 12 SER CB C 12 63.100 62.793 0.307 1
1 155 . 20 1 1 A 12 12 SER N N 12 112.100 113.370 -1.270 1
1 156 . 20 1 1 A 13 13 THR H H 13 7.460 7.502 -0.042 1
1 157 . 20 1 1 A 13 13 THR HA H 13 4.760 4.702 0.058 1
1 162 . 20 1 1 A 13 13 THR CA C 13 56.600 58.996 -2.396 1
1 163 . 20 1 1 A 13 13 THR CB C 13 70.100 69.000 1.100 1
1 165 . 20 1 1 A 13 13 THR N N 13 114.700 109.101 5.599 1
1 166 . 20 1 1 A 14 14 PRO HA H 14 4.050 4.241 -0.191 1
1 173 . 20 1 1 A 14 14 PRO C C 14 175.800 175.948 -0.148 1
1 174 . 20 1 1 A 14 14 PRO CA C 14 65.100 64.761 0.339 1
1 175 . 20 1 1 A 14 14 PRO CB C 14 32.100 31.387 0.713 1
1 178 . 20 1 1 A 15 15 TYR H H 15 7.380 7.680 -0.300 1
1 179 . 20 1 1 A 15 15 TYR HA H 15 5.570 5.623 -0.053 1
1 186 . 20 1 1 A 15 15 TYR C C 15 176.100 175.261 0.839 1
1 187 . 20 1 1 A 15 15 TYR CA C 15 56.400 56.807 -0.407 1
1 188 . 20 1 1 A 15 15 TYR CB C 15 41.500 41.591 -0.091 1
1 193 . 20 1 1 A 15 15 TYR N N 15 113.800 117.133 -3.333 1
1 194 . 20 1 1 A 16 16 VAL H H 16 9.010 8.722 0.288 1
1 195 . 20 1 1 A 16 16 VAL HA H 16 4.920 5.026 -0.106 1
1 203 . 20 1 1 A 16 16 VAL C C 16 174.300 174.033 0.267 1
1 204 . 20 1 1 A 16 16 VAL CA C 16 59.600 59.549 0.051 1
1 205 . 20 1 1 A 16 16 VAL CB C 16 36.800 36.345 0.455 1
1 208 . 20 1 1 A 16 16 VAL N N 16 113.800 117.157 -3.357 1
1 209 . 20 1 1 A 17 17 SER H H 17 7.960 8.541 -0.581 1
1 210 . 20 1 1 A 17 17 SER HA H 17 5.860 5.476 0.384 1
1 213 . 20 1 1 A 17 17 SER C C 17 172.700 173.917 -1.217 1
1 214 . 20 1 1 A 17 17 SER CA C 17 57.300 57.586 -0.286 1
1 215 . 20 1 1 A 17 17 SER CB C 17 64.000 64.874 -0.874 1
1 216 . 20 1 1 A 17 17 SER N N 17 117.100 118.331 -1.231 1
1 217 . 20 1 1 A 18 18 VAL H H 18 8.570 8.832 -0.262 1
1 218 . 20 1 1 A 18 18 VAL HA H 18 4.900 5.120 -0.220 1
1 226 . 20 1 1 A 18 18 VAL C C 18 173.700 174.712 -1.012 1
1 227 . 20 1 1 A 18 18 VAL CA C 18 58.800 59.000 -0.200 1
1 228 . 20 1 1 A 18 18 VAL CB C 18 36.700 35.952 0.748 1
1 231 . 20 1 1 A 18 18 VAL N N 18 113.500 119.171 -5.671 1
1 232 . 20 1 1 A 19 19 ILE H H 19 8.490 8.558 -0.068 1
1 233 . 20 1 1 A 19 19 ILE HA H 19 5.300 5.151 0.149 1
1 243 . 20 1 1 A 19 19 ILE C C 19 175.800 175.934 -0.134 1
1 244 . 20 1 1 A 19 19 ILE CA C 19 59.700 59.664 0.036 1
1 245 . 20 1 1 A 19 19 ILE CB C 19 41.700 40.954 0.746 1
1 249 . 20 1 1 A 19 19 ILE N N 19 120.600 121.785 -1.185 1
1 250 . 20 1 1 A 20 20 GLY H H 20 8.670 7.715 0.955 1
1 251 . 20 1 1 A 20 20 GLY HA2 H 20 3.760 4.168 -0.408 1
1 252 . 20 1 1 A 20 20 GLY HA3 H 20 4.190 4.172 0.018 1
1 253 . 20 1 1 A 20 20 GLY C C 20 169.900 172.126 -2.226 1
1 254 . 20 1 1 A 20 20 GLY CA C 20 46.000 45.975 0.025 1
1 255 . 20 1 1 A 20 20 GLY N N 20 110.200 112.495 -2.295 1
1 256 . 20 1 1 A 21 21 LYS H H 21 8.920 8.478 0.442 1
1 257 . 20 1 1 A 21 21 LYS HA H 21 5.210 5.263 -0.053 1
1 266 . 20 1 1 A 21 21 LYS C C 21 176.400 174.826 1.574 1
1 267 . 20 1 1 A 21 21 LYS CA C 21 54.400 54.397 0.003 1
1 268 . 20 1 1 A 21 21 LYS CB C 21 35.400 36.200 -0.800 1
1 272 . 20 1 1 A 21 21 LYS N N 21 119.100 116.852 2.248 1
1 273 . 20 1 1 A 22 22 ILE H H 22 8.900 8.392 0.508 1
1 274 . 20 1 1 A 22 22 ILE HA H 22 5.050 4.967 0.083 1
1 284 . 20 1 1 A 22 22 ILE C C 22 176.900 175.242 1.658 1
1 285 . 20 1 1 A 22 22 ILE CA C 22 57.800 60.295 -2.495 1
1 286 . 20 1 1 A 22 22 ILE CB C 22 36.200 39.418 -3.218 1
1 290 . 20 1 1 A 22 22 ILE N N 22 130.000 124.206 5.794 1
1 291 . 20 1 1 A 23 23 THR H H 23 9.020 8.738 0.282 1
1 292 . 20 1 1 A 23 23 THR HA H 23 4.660 5.083 -0.423 1
1 297 . 20 1 1 A 23 23 THR C C 23 174.000 174.053 -0.053 1
1 298 . 20 1 1 A 23 23 THR CA C 23 60.800 59.788 1.012 1
1 299 . 20 1 1 A 23 23 THR CB C 23 73.400 71.862 1.538 1
1 301 . 20 1 1 A 23 23 THR N N 23 118.200 117.473 0.727 1
1 302 . 20 1 1 A 24 24 GLY H H 24 8.430 8.634 -0.204 1
1 303 . 20 1 1 A 24 24 GLY HA2 H 24 3.910 3.853 0.057 1
1 304 . 20 1 1 A 24 24 GLY HA3 H 24 3.910 4.030 -0.120 1
1 305 . 20 1 1 A 24 24 GLY C C 24 175.400 174.772 0.628 1
1 306 . 20 1 1 A 24 24 GLY CA C 24 47.100 47.032 0.068 1
1 307 . 20 1 1 A 24 24 GLY N N 24 107.200 112.045 -4.845 1
1 308 . 20 1 1 A 25 25 ILE H H 25 9.370 8.045 1.325 1
1 309 . 20 1 1 A 25 25 ILE HA H 25 4.480 4.090 0.390 1
1 319 . 20 1 1 A 25 25 ILE C C 25 178.200 175.655 2.545 1
1 320 . 20 1 1 A 25 25 ILE CA C 25 59.200 61.226 -2.026 1
1 321 . 20 1 1 A 25 25 ILE CB C 25 35.400 38.161 -2.761 1
1 325 . 20 1 1 A 25 25 ILE N N 25 120.600 120.527 0.073 1
1 326 . 20 1 1 A 26 26 HIS H H 26 9.000 9.191 -0.191 1
1 327 . 20 1 1 A 26 26 HIS HA H 26 4.770 5.251 -0.481 1
1 330 . 20 1 1 A 26 26 HIS C C 26 172.700 174.322 -1.622 1
1 331 . 20 1 1 A 26 26 HIS CA C 26 55.000 54.089 0.911 1
1 332 . 20 1 1 A 26 26 HIS CB C 26 31.100 32.300 -1.200 1
1 333 . 20 1 1 A 26 26 HIS N N 26 123.800 125.908 -2.108 1
1 334 . 20 1 1 A 27 27 LYS H H 27 8.930 8.859 0.071 1
1 335 . 20 1 1 A 27 27 LYS HA H 27 4.770 4.469 0.301 1
1 344 . 20 1 1 A 27 27 LYS C C 27 175.300 175.408 -0.108 1
1 345 . 20 1 1 A 27 27 LYS CA C 27 55.100 56.072 -0.972 1
1 346 . 20 1 1 A 27 27 LYS CB C 27 34.400 33.342 1.058 1
1 350 . 20 1 1 A 27 27 LYS N N 27 125.900 125.099 0.801 1
1 351 . 20 1 1 A 28 28 LYS H H 28 8.880 8.194 0.686 1
1 352 . 20 1 1 A 28 28 LYS HA H 28 4.570 4.886 -0.316 1
1 361 . 20 1 1 A 28 28 LYS C C 28 174.500 173.689 0.811 1
1 362 . 20 1 1 A 28 28 LYS CA C 28 54.600 54.973 -0.373 1
1 363 . 20 1 1 A 28 28 LYS CB C 28 35.300 36.742 -1.442 1
1 367 . 20 1 1 A 28 28 LYS N N 28 127.400 126.524 0.876 1
1 368 . 20 1 1 A 29 29 GLU H H 29 8.440 8.450 -0.010 1
1 369 . 20 1 1 A 29 29 GLU HA H 29 5.260 5.161 0.099 1
1 374 . 20 1 1 A 29 29 GLU C C 29 175.800 175.706 0.094 1
1 375 . 20 1 1 A 29 29 GLU CA C 29 54.800 54.740 0.060 1
1 376 . 20 1 1 A 29 29 GLU CB C 29 31.500 33.118 -1.618 1
1 378 . 20 1 1 A 29 29 GLU N N 29 122.200 124.592 -2.392 1
1 379 . 20 1 1 A 30 30 TYR H H 30 8.960 8.672 0.288 1
1 380 . 20 1 1 A 30 30 TYR HA H 30 4.820 5.323 -0.503 1
1 387 . 20 1 1 A 30 30 TYR C C 30 172.600 172.639 -0.039 1
1 388 . 20 1 1 A 30 30 TYR CA C 30 56.300 55.619 0.681 1
1 389 . 20 1 1 A 30 30 TYR CB C 30 40.500 41.493 -0.993 1
1 394 . 20 1 1 A 30 30 TYR N N 30 121.100 118.752 2.348 1
1 395 . 20 1 1 A 31 31 GLU H H 31 8.610 8.859 -0.249 1
1 396 . 20 1 1 A 31 31 GLU HA H 31 4.810 4.333 0.477 1
1 401 . 20 1 1 A 31 31 GLU C C 31 176.100 175.793 0.307 1
1 402 . 20 1 1 A 31 31 GLU CA C 31 55.100 55.298 -0.198 1
1 403 . 20 1 1 A 31 31 GLU CB C 31 30.300 29.583 0.717 1
1 405 . 20 1 1 A 31 31 GLU N N 31 121.800 122.003 -0.203 1
1 406 . 20 1 1 A 32 32 SER H H 32 8.570 8.737 -0.167 1
1 407 . 20 1 1 A 32 32 SER HA H 32 4.520 4.620 -0.100 1
1 410 . 20 1 1 A 32 32 SER C C 32 174.300 173.307 0.993 1
1 411 . 20 1 1 A 32 32 SER CA C 32 57.300 56.431 0.869 1
1 412 . 20 1 1 A 32 32 SER CB C 32 64.100 64.923 -0.823 1
1 413 . 20 1 1 A 32 32 SER N N 32 118.500 122.829 -4.329 1
1 414 . 20 1 1 A 33 33 ASP H H 33 9.290 8.571 0.719 1
1 415 . 20 1 1 A 33 33 ASP HA H 33 4.340 4.271 0.069 1
1 418 . 20 1 1 A 33 33 ASP C C 33 175.900 177.058 -1.158 1
1 419 . 20 1 1 A 33 33 ASP CA C 33 55.000 55.979 -0.979 1
1 420 . 20 1 1 A 33 33 ASP CB C 33 39.300 39.717 -0.417 1
1 421 . 20 1 1 A 33 33 ASP N N 33 125.700 123.022 2.678 1
1 422 . 20 1 1 A 34 34 GLY H H 34 8.690 8.820 -0.130 1
1 423 . 20 1 1 A 34 34 GLY HA2 H 34 3.660 3.850 -0.190 1
1 424 . 20 1 1 A 34 34 GLY HA3 H 34 4.140 3.853 0.287 1
1 425 . 20 1 1 A 34 34 GLY C C 34 174.200 173.371 0.829 1
1 426 . 20 1 1 A 34 34 GLY CA C 34 45.600 46.129 -0.529 1
1 427 . 20 1 1 A 34 34 GLY N N 34 104.800 109.880 -5.080 1
1 428 . 20 1 1 A 35 35 THR H H 35 7.840 7.483 0.357 1
1 429 . 20 1 1 A 35 35 THR HA H 35 4.660 4.926 -0.266 1
1 434 . 20 1 1 A 35 35 THR C C 35 173.000 173.027 -0.027 1
1 435 . 20 1 1 A 35 35 THR CA C 35 60.200 59.324 0.876 1
1 436 . 20 1 1 A 35 35 THR CB C 35 71.200 72.588 -1.388 1
1 438 . 20 1 1 A 35 35 THR N N 35 114.800 109.814 4.986 1
1 439 . 20 1 1 A 36 36 THR H H 36 8.480 8.840 -0.360 1
1 440 . 20 1 1 A 36 36 THR HA H 36 4.620 4.557 0.063 1
1 445 . 20 1 1 A 36 36 THR C C 36 173.800 174.015 -0.215 1
1 446 . 20 1 1 A 36 36 THR CA C 36 62.300 62.354 -0.054 1
1 447 . 20 1 1 A 36 36 THR CB C 36 69.500 69.292 0.208 1
1 449 . 20 1 1 A 36 36 THR N N 36 119.400 118.626 0.774 1
1 450 . 20 1 1 A 37 37 LYS H H 37 8.880 8.249 0.631 1
1 451 . 20 1 1 A 37 37 LYS HA H 37 4.570 4.860 -0.290 1
1 460 . 20 1 1 A 37 37 LYS C C 37 174.500 176.079 -1.579 1
1 461 . 20 1 1 A 37 37 LYS CA C 37 54.600 54.079 0.521 1
1 462 . 20 1 1 A 37 37 LYS CB C 37 35.500 35.796 -0.296 1
1 466 . 20 1 1 A 37 37 LYS N N 37 128.000 126.076 1.924 1
1 467 . 20 1 1 A 38 38 SER H H 38 8.370 8.712 -0.342 1
1 468 . 20 1 1 A 38 38 SER HA H 38 5.250 4.963 0.287 1
1 471 . 20 1 1 A 38 38 SER C C 38 173.200 173.615 -0.415 1
1 472 . 20 1 1 A 38 38 SER CA C 38 57.900 57.072 0.828 1
1 473 . 20 1 1 A 38 38 SER CB C 38 65.500 64.549 0.951 1
1 474 . 20 1 1 A 38 38 SER N N 38 114.300 116.444 -2.144 1
1 475 . 20 1 1 A 39 39 VAL H H 39 9.020 8.615 0.405 1
1 476 . 20 1 1 A 39 39 VAL HA H 39 4.900 4.860 0.040 1
1 484 . 20 1 1 A 39 39 VAL C C 39 173.200 172.570 0.630 1
1 485 . 20 1 1 A 39 39 VAL CA C 39 59.200 59.700 -0.500 1
1 486 . 20 1 1 A 39 39 VAL CB C 39 34.600 35.377 -0.777 1
1 489 . 20 1 1 A 39 39 VAL N N 39 123.600 120.273 3.327 1
1 490 . 20 1 1 A 40 40 TYR H H 40 8.900 8.886 0.014 1
1 491 . 20 1 1 A 40 40 TYR HA H 40 4.730 5.369 -0.639 1
1 498 . 20 1 1 A 40 40 TYR CA C 40 56.500 56.710 -0.210 1
1 499 . 20 1 1 A 40 40 TYR CB C 40 39.000 40.830 -1.830 1
1 504 . 20 1 1 A 40 40 TYR N N 40 126.300 126.888 -0.588 1
1 505 . 20 1 1 A 41 41 GLN H H 41 8.630 8.515 0.115 1
1 506 . 20 1 1 A 41 41 GLN HA H 41 5.330 5.247 0.083 1
1 513 . 20 1 1 A 41 41 GLN C C 41 175.500 176.043 -0.543 1
1 514 . 20 1 1 A 41 41 GLN CA C 41 53.800 54.185 -0.385 1
1 515 . 20 1 1 A 41 41 GLN CB C 41 32.100 31.761 0.339 1
1 518 . 20 1 1 A 41 41 GLN N N 41 122.000 122.155 -0.155 1
1 520 . 20 1 1 A 42 42 GLY H H 42 8.560 7.945 0.615 1
1 521 . 20 1 1 A 42 42 GLY HA2 H 42 3.680 4.335 -0.655 1
1 522 . 20 1 1 A 42 42 GLY HA3 H 42 4.020 4.399 -0.379 1
1 523 . 20 1 1 A 42 42 GLY C C 42 171.600 171.114 0.486 1
1 524 . 20 1 1 A 42 42 GLY CA C 42 47.300 46.198 1.102 1
1 525 . 20 1 1 A 42 42 GLY N N 42 113.000 109.081 3.919 1
1 526 . 20 1 1 A 43 43 TYR H H 43 9.320 8.600 0.720 1
1 527 . 20 1 1 A 43 43 TYR HA H 43 5.280 5.360 -0.080 1
1 534 . 20 1 1 A 43 43 TYR C C 43 173.200 174.142 -0.942 1
1 535 . 20 1 1 A 43 43 TYR CA C 43 57.600 56.692 0.908 1
1 536 . 20 1 1 A 43 43 TYR CB C 43 42.400 41.723 0.677 1
1 541 . 20 1 1 A 43 43 TYR N N 43 126.300 119.058 7.242 1
1 542 . 20 1 1 A 44 44 ILE H H 44 9.160 8.684 0.476 1
1 543 . 20 1 1 A 44 44 ILE HA H 44 5.270 5.427 -0.157 1
1 553 . 20 1 1 A 44 44 ILE C C 44 172.900 173.497 -0.597 1
1 554 . 20 1 1 A 44 44 ILE CA C 44 59.000 59.441 -0.441 1
1 555 . 20 1 1 A 44 44 ILE CB C 44 42.200 42.001 0.199 1
1 559 . 20 1 1 A 44 44 ILE N N 44 117.700 123.345 -5.645 1
1 560 . 20 1 1 A 45 45 GLU H H 45 8.420 8.577 -0.157 1
1 561 . 20 1 1 A 45 45 GLU HA H 45 5.600 5.306 0.294 1
1 566 . 20 1 1 A 45 45 GLU C C 45 174.300 174.894 -0.594 1
1 567 . 20 1 1 A 45 45 GLU CA C 45 54.000 54.678 -0.678 1
1 568 . 20 1 1 A 45 45 GLU CB C 45 34.400 33.897 0.503 1
1 570 . 20 1 1 A 45 45 GLU N N 45 123.600 127.003 -3.403 1
1 571 . 20 1 1 A 46 46 ASP H H 46 8.530 8.403 0.127 1
1 572 . 20 1 1 A 46 46 ASP HA H 46 5.070 4.944 0.126 1
1 575 . 20 1 1 A 46 46 ASP C C 46 175.000 174.859 0.141 1
1 576 . 20 1 1 A 46 46 ASP CA C 46 51.800 52.840 -1.040 1
1 577 . 20 1 1 A 46 46 ASP CB C 46 41.300 44.160 -2.860 1
1 578 . 20 1 1 A 46 46 ASP N N 46 125.500 120.293 5.207 1
1 579 . 20 1 1 A 47 47 ASP H H 47 9.160 8.912 0.248 1
1 580 . 20 1 1 A 47 47 ASP HA H 47 4.430 4.453 -0.023 1
1 583 . 20 1 1 A 47 47 ASP C C 47 176.000 178.051 -2.051 1
1 584 . 20 1 1 A 47 47 ASP CA C 47 55.000 56.388 -1.388 1
1 585 . 20 1 1 A 47 47 ASP CB C 47 38.900 40.429 -1.529 1
1 586 . 20 1 1 A 47 47 ASP N N 47 114.200 121.502 -7.302 1
1 587 . 20 1 1 A 48 48 THR H H 48 9.470 7.806 1.664 1
1 588 . 20 1 1 A 48 48 THR HA H 48 4.520 4.403 0.117 1
1 593 . 20 1 1 A 48 48 THR C C 48 174.500 174.899 -0.399 1
1 594 . 20 1 1 A 48 48 THR CA C 48 62.600 62.563 0.037 1
1 595 . 20 1 1 A 48 48 THR CB C 48 70.400 69.044 1.356 1
1 597 . 20 1 1 A 48 48 THR N N 48 111.800 109.749 2.051 1
1 598 . 20 1 1 A 49 49 ALA H H 49 7.850 7.498 0.352 1
1 599 . 20 1 1 A 49 49 ALA HA H 49 4.440 4.413 0.027 1
1 603 . 20 1 1 A 49 49 ALA C C 49 173.200 175.494 -2.294 1
1 604 . 20 1 1 A 49 49 ALA CA C 49 52.700 51.462 1.238 1
1 605 . 20 1 1 A 49 49 ALA CB C 49 21.300 20.076 1.224 1
1 606 . 20 1 1 A 49 49 ALA N N 49 123.400 120.638 2.762 1
1 607 . 20 1 1 A 50 50 ARG H H 50 8.160 8.828 -0.668 1
1 608 . 20 1 1 A 50 50 ARG HA H 50 5.350 5.617 -0.267 1
1 616 . 20 1 1 A 50 50 ARG C C 50 174.700 174.547 0.153 1
1 617 . 20 1 1 A 50 50 ARG CA C 50 54.000 54.542 -0.542 1
1 618 . 20 1 1 A 50 50 ARG CB C 50 34.500 34.350 0.150 1
1 622 . 20 1 1 A 50 50 ARG N N 50 117.400 114.923 2.477 1
1 624 . 20 1 1 A 51 51 ILE H H 51 9.390 8.541 0.849 1
1 625 . 20 1 1 A 51 51 ILE HA H 51 4.790 4.917 -0.127 1
1 635 . 20 1 1 A 51 51 ILE C C 51 172.600 173.068 -0.468 1
1 636 . 20 1 1 A 51 51 ILE CA C 51 60.000 59.013 0.987 1
1 637 . 20 1 1 A 51 51 ILE CB C 51 42.800 41.712 1.088 1
1 641 . 20 1 1 A 51 51 ILE N N 51 124.600 121.030 3.570 1
1 642 . 20 1 1 A 52 52 ARG H H 52 7.980 8.587 -0.607 1
1 643 . 20 1 1 A 52 52 ARG HA H 52 4.170 4.238 -0.068 1
1 651 . 20 1 1 A 52 52 ARG C C 52 174.600 175.796 -1.196 1
1 652 . 20 1 1 A 52 52 ARG CA C 52 57.100 56.303 0.797 1
1 653 . 20 1 1 A 52 52 ARG CB C 52 31.300 31.040 0.260 1
1 657 . 20 1 1 A 52 52 ARG N N 52 125.900 127.892 -1.992 1
1 659 . 20 1 1 A 53 53 ILE H H 53 8.290 8.729 -0.439 1
1 660 . 20 1 1 A 53 53 ILE HA H 53 5.160 5.228 -0.068 1
1 670 . 20 1 1 A 53 53 ILE C C 53 172.400 174.030 -1.630 1
1 671 . 20 1 1 A 53 53 ILE CA C 53 58.600 58.982 -0.382 1
1 672 . 20 1 1 A 53 53 ILE CB C 53 41.900 42.550 -0.650 1
1 676 . 20 1 1 A 53 53 ILE N N 53 118.500 120.836 -2.336 1
1 677 . 20 1 1 A 54 54 SER H H 54 8.350 8.647 -0.297 1
1 678 . 20 1 1 A 54 54 SER HA H 54 5.070 5.147 -0.077 1
1 681 . 20 1 1 A 54 54 SER C C 54 172.400 172.233 0.167 1
1 682 . 20 1 1 A 54 54 SER CA C 54 57.000 56.650 0.350 1
1 683 . 20 1 1 A 54 54 SER CB C 54 65.900 64.915 0.985 1
1 684 . 20 1 1 A 54 54 SER N N 54 120.700 117.594 3.106 1
1 685 . 20 1 1 A 55 55 SER H H 55 9.130 9.277 -0.147 1
1 686 . 20 1 1 A 55 55 SER HA H 55 5.270 5.149 0.121 1
1 690 . 20 1 1 A 55 55 SER C C 55 174.400 172.712 1.688 1
1 691 . 20 1 1 A 55 55 SER CA C 55 55.500 56.719 -1.219 1
1 692 . 20 1 1 A 55 55 SER CB C 55 64.500 64.647 -0.147 1
1 693 . 20 1 1 A 55 55 SER N N 55 117.200 122.071 -4.871 1
1 694 . 20 1 1 A 56 56 PHE H H 56 8.970 8.760 0.210 1
1 695 . 20 1 1 A 56 56 PHE HA H 56 4.600 4.992 -0.392 1
1 703 . 20 1 1 A 56 56 PHE C C 56 176.500 176.860 -0.360 1
1 704 . 20 1 1 A 56 56 PHE CA C 56 58.300 57.084 1.216 1
1 705 . 20 1 1 A 56 56 PHE CB C 56 37.900 41.030 -3.130 1
1 711 . 20 1 1 A 56 56 PHE N N 56 129.400 127.128 2.272 1
1 712 . 20 1 1 A 57 57 GLY H H 57 8.570 8.898 -0.328 1
1 713 . 20 1 1 A 57 57 GLY HA2 H 57 4.020 4.119 -0.099 1
1 714 . 20 1 1 A 57 57 GLY HA3 H 57 4.380 4.124 0.256 1
1 715 . 20 1 1 A 57 57 GLY C C 57 173.700 174.444 -0.744 1
1 716 . 20 1 1 A 57 57 GLY CA C 57 46.300 45.812 0.488 1
1 717 . 20 1 1 A 57 57 GLY N N 57 112.500 112.285 0.215 1
1 718 . 20 1 1 A 58 58 LYS H H 58 6.800 7.808 -1.008 1
1 719 . 20 1 1 A 58 58 LYS HA H 58 4.410 4.417 -0.007 1
1 728 . 20 1 1 A 58 58 LYS C C 58 174.800 175.642 -0.842 1
1 729 . 20 1 1 A 58 58 LYS CA C 58 55.200 56.476 -1.276 1
1 730 . 20 1 1 A 58 58 LYS CB C 58 33.300 33.464 -0.164 1
1 734 . 20 1 1 A 58 58 LYS N N 58 118.700 121.289 -2.589 1
1 735 . 20 1 1 A 59 59 GLN H H 59 8.390 8.606 -0.216 1
1 736 . 20 1 1 A 59 59 GLN HA H 59 1.830 4.147 -2.317 1
1 743 . 20 1 1 A 59 59 GLN C C 59 174.100 174.328 -0.228 1
1 744 . 20 1 1 A 59 59 GLN CA C 59 57.100 54.424 2.676 1
1 745 . 20 1 1 A 59 59 GLN CB C 59 28.900 30.114 -1.214 1
1 748 . 20 1 1 A 59 59 GLN N N 59 124.000 123.151 0.849 1
1 750 . 20 1 1 A 60 60 LEU H H 60 5.320 8.166 -2.846 1
1 751 . 20 1 1 A 60 60 LEU HA H 60 4.370 5.007 -0.637 1
1 761 . 20 1 1 A 60 60 LEU CA C 60 52.800 53.495 -0.695 1
1 762 . 20 1 1 A 60 60 LEU CB C 60 46.700 46.043 0.657 1
1 766 . 20 1 1 A 60 60 LEU N N 60 121.800 124.021 -2.221 1
1 767 . 20 1 1 A 61 61 GLN H H 61 8.660 8.758 -0.098 1
1 768 . 20 1 1 A 61 61 GLN HA H 61 4.440 4.723 -0.283 1
1 775 . 20 1 1 A 61 61 GLN C C 61 174.000 174.974 -0.974 1
1 776 . 20 1 1 A 61 61 GLN CA C 61 53.800 54.026 -0.226 1
1 777 . 20 1 1 A 61 61 GLN CB C 61 31.800 31.601 0.199 1
1 780 . 20 1 1 A 61 61 GLN N N 61 120.300 120.143 0.157 1
1 782 . 20 1 1 A 62 62 ASP H H 62 8.450 8.649 -0.199 1
1 783 . 20 1 1 A 62 62 ASP HA H 62 4.130 4.247 -0.117 1
1 786 . 20 1 1 A 62 62 ASP C C 62 177.200 176.993 0.207 1
1 787 . 20 1 1 A 62 62 ASP CA C 62 55.700 55.209 0.491 1
1 788 . 20 1 1 A 62 62 ASP CB C 62 39.400 40.745 -1.345 1
1 789 . 20 1 1 A 62 62 ASP N N 62 122.400 123.505 -1.105 1
1 790 . 20 1 1 A 63 63 SER H H 63 9.210 8.872 0.338 1
1 791 . 20 1 1 A 63 63 SER HA H 63 3.850 4.041 -0.191 1
1 794 . 20 1 1 A 63 63 SER C C 63 173.200 172.842 0.358 1
1 795 . 20 1 1 A 63 63 SER CA C 63 61.700 59.430 2.270 1
1 796 . 20 1 1 A 63 63 SER CB C 63 61.800 61.624 0.176 1
1 797 . 20 1 1 A 63 63 SER N N 63 114.300 115.841 -1.541 1
1 798 . 20 1 1 A 64 64 ASP H H 64 7.960 7.578 0.382 1
1 799 . 20 1 1 A 64 64 ASP HA H 64 4.540 4.750 -0.210 1
1 802 . 20 1 1 A 64 64 ASP C C 64 174.900 175.275 -0.375 1
1 803 . 20 1 1 A 64 64 ASP CA C 64 54.900 53.573 1.327 1
1 804 . 20 1 1 A 64 64 ASP CB C 64 40.900 40.972 -0.072 1
1 805 . 20 1 1 A 64 64 ASP N N 64 122.600 120.580 2.020 1
1 806 . 20 1 1 A 65 65 VAL H H 65 8.180 8.489 -0.309 1
1 807 . 20 1 1 A 65 65 VAL HA H 65 4.670 4.334 0.336 1
1 815 . 20 1 1 A 65 65 VAL C C 65 175.900 175.565 0.335 1
1 816 . 20 1 1 A 65 65 VAL CA C 65 62.300 62.562 -0.262 1
1 817 . 20 1 1 A 65 65 VAL CB C 65 31.700 30.934 0.766 1
1 820 . 20 1 1 A 65 65 VAL N N 65 123.100 127.931 -4.831 1
1 821 . 20 1 1 A 66 66 VAL H H 66 8.770 8.591 0.179 1
1 822 . 20 1 1 A 66 66 VAL HA H 66 5.160 5.071 0.089 1
1 830 . 20 1 1 A 66 66 VAL C C 66 173.600 173.465 0.135 1
1 831 . 20 1 1 A 66 66 VAL CA C 66 58.100 58.785 -0.685 1
1 832 . 20 1 1 A 66 66 VAL CB C 66 35.700 36.088 -0.388 1
1 835 . 20 1 1 A 66 66 VAL N N 66 118.100 120.837 -2.737 1
1 836 . 20 1 1 A 67 67 ARG H H 67 8.880 8.808 0.072 1
1 837 . 20 1 1 A 67 67 ARG HA H 67 5.110 5.031 0.079 1
1 845 . 20 1 1 A 67 67 ARG C C 67 175.300 174.960 0.340 1
1 846 . 20 1 1 A 67 67 ARG CA C 67 54.200 54.706 -0.506 1
1 847 . 20 1 1 A 67 67 ARG CB C 67 32.200 33.144 -0.944 1
1 851 . 20 1 1 A 67 67 ARG N N 67 120.200 121.837 -1.637 1
1 853 . 20 1 1 A 68 68 ILE H H 68 9.220 8.794 0.426 1
1 854 . 20 1 1 A 68 68 ILE HA H 68 4.990 4.707 0.283 1
1 864 . 20 1 1 A 68 68 ILE C C 68 174.900 174.230 0.670 1
1 865 . 20 1 1 A 68 68 ILE CA C 68 58.600 59.922 -1.322 1
1 866 . 20 1 1 A 68 68 ILE CB C 68 39.300 38.991 0.309 1
1 870 . 20 1 1 A 68 68 ILE N N 68 127.200 128.045 -0.845 1
1 871 . 20 1 1 A 69 69 ASP H H 69 9.110 8.687 0.423 1
1 872 . 20 1 1 A 69 69 ASP HA H 69 5.370 5.365 0.005 1
1 875 . 20 1 1 A 69 69 ASP C C 69 175.800 175.590 0.210 1
1 876 . 20 1 1 A 69 69 ASP CA C 69 52.400 53.137 -0.737 1
1 877 . 20 1 1 A 69 69 ASP CB C 69 43.700 43.615 0.085 1
1 878 . 20 1 1 A 69 69 ASP N N 69 123.400 127.270 -3.870 1
1 879 . 20 1 1 A 70 70 ASN H H 70 8.300 8.668 -0.368 1
1 880 . 20 1 1 A 70 70 ASN HA H 70 4.160 4.402 -0.242 1
1 885 . 20 1 1 A 70 70 ASN C C 70 176.300 174.599 1.701 1
1 886 . 20 1 1 A 70 70 ASN CA C 70 54.300 54.101 0.199 1
1 887 . 20 1 1 A 70 70 ASN CB C 70 37.500 37.387 0.113 1
1 889 . 20 1 1 A 70 70 ASN N N 70 119.800 122.794 -2.994 1
1 891 . 20 1 1 A 71 71 ALA H H 71 9.100 8.086 1.014 1
1 892 . 20 1 1 A 71 71 ALA HA H 71 4.500 4.467 0.033 1
1 896 . 20 1 1 A 71 71 ALA C C 71 175.700 176.861 -1.161 1
1 897 . 20 1 1 A 71 71 ALA CA C 71 51.900 52.472 -0.572 1
1 898 . 20 1 1 A 71 71 ALA CB C 71 19.600 19.551 0.049 1
1 899 . 20 1 1 A 71 71 ALA N N 71 123.000 121.165 1.835 1
1 900 . 20 1 1 A 72 72 ARG H H 72 8.490 8.485 0.005 1
1 901 . 20 1 1 A 72 72 ARG HA H 72 4.720 4.724 -0.004 1
1 909 . 20 1 1 A 72 72 ARG C C 72 175.800 175.723 0.077 1
1 910 . 20 1 1 A 72 72 ARG CA C 72 54.400 55.807 -1.407 1
1 911 . 20 1 1 A 72 72 ARG CB C 72 32.700 31.211 1.489 1
1 915 . 20 1 1 A 72 72 ARG N N 72 122.500 124.648 -2.148 1
1 917 . 20 1 1 A 73 73 VAL H H 73 8.310 8.356 -0.046 1
1 918 . 20 1 1 A 73 73 VAL HA H 73 4.250 4.485 -0.235 1
1 926 . 20 1 1 A 73 73 VAL C C 73 174.600 175.318 -0.718 1
1 927 . 20 1 1 A 73 73 VAL CA C 73 62.800 61.639 1.161 1
1 928 . 20 1 1 A 73 73 VAL CB C 73 32.100 32.373 -0.273 1
1 931 . 20 1 1 A 73 73 VAL N N 73 127.100 126.161 0.939 1
1 932 . 20 1 1 A 74 74 ALA H H 74 8.880 9.026 -0.146 1
1 933 . 20 1 1 A 74 74 ALA HA H 74 4.500 5.056 -0.556 1
1 937 . 20 1 1 A 74 74 ALA C C 74 174.800 174.581 0.219 1
1 938 . 20 1 1 A 74 74 ALA CA C 74 50.500 50.240 0.260 1
1 939 . 20 1 1 A 74 74 ALA CB C 74 22.500 23.690 -1.190 1
1 940 . 20 1 1 A 74 74 ALA N N 74 131.000 128.841 2.159 1
1 941 . 20 1 1 A 75 75 GLN H H 75 8.280 8.507 -0.227 1
1 942 . 20 1 1 A 75 75 GLN HA H 75 4.910 4.981 -0.071 1
1 949 . 20 1 1 A 75 75 GLN C C 75 175.100 174.092 1.008 1
1 950 . 20 1 1 A 75 75 GLN CA C 75 54.600 53.836 0.764 1
1 951 . 20 1 1 A 75 75 GLN CB C 75 31.400 31.696 -0.296 1
1 954 . 20 1 1 A 75 75 GLN N N 75 118.800 120.524 -1.724 1
1 956 . 20 1 1 A 76 76 PHE H H 76 8.710 9.131 -0.421 1
1 957 . 20 1 1 A 76 76 PHE HA H 76 4.660 4.907 -0.247 1
1 965 . 20 1 1 A 76 76 PHE C C 76 174.900 175.485 -0.585 1
1 966 . 20 1 1 A 76 76 PHE CA C 76 57.000 56.676 0.324 1
1 967 . 20 1 1 A 76 76 PHE CB C 76 41.000 42.028 -1.028 1
1 973 . 20 1 1 A 76 76 PHE N N 76 125.000 125.286 -0.286 1
1 974 . 20 1 1 A 77 77 ASN H H 77 9.040 9.469 -0.429 1
1 975 . 20 1 1 A 77 77 ASN HA H 77 4.170 4.502 -0.332 1
1 980 . 20 1 1 A 77 77 ASN C C 77 174.200 175.673 -1.473 1
1 981 . 20 1 1 A 77 77 ASN CA C 77 53.800 54.527 -0.727 1
1 982 . 20 1 1 A 77 77 ASN CB C 77 37.400 37.514 -0.114 1
1 984 . 20 1 1 A 77 77 ASN N N 77 123.200 123.758 -0.558 1
1 986 . 20 1 1 A 78 78 GLY H H 78 8.370 8.627 -0.257 1
1 987 . 20 1 1 A 78 78 GLY HA2 H 78 3.410 3.609 -0.199 1
1 988 . 20 1 1 A 78 78 GLY HA3 H 78 3.980 3.706 0.274 1
1 989 . 20 1 1 A 78 78 GLY C C 78 173.800 173.139 0.661 1
1 990 . 20 1 1 A 78 78 GLY CA C 78 45.000 45.284 -0.284 1
1 991 . 20 1 1 A 78 78 GLY N N 78 103.300 104.727 -1.427 1
1 992 . 20 1 1 A 79 79 TYR H H 79 7.670 8.189 -0.519 1
1 993 . 20 1 1 A 79 79 TYR HA H 79 4.860 4.852 0.008 1
1 1000 . 20 1 1 A 79 79 TYR C C 79 174.800 175.578 -0.778 1
1 1001 . 20 1 1 A 79 79 TYR CA C 79 56.300 57.448 -1.148 1
1 1002 . 20 1 1 A 79 79 TYR CB C 79 40.800 40.781 0.019 1
1 1007 . 20 1 1 A 79 79 TYR N N 79 118.700 119.264 -0.564 1
1 1008 . 20 1 1 A 80 80 LEU H H 80 8.760 8.781 -0.021 1
1 1009 . 20 1 1 A 80 80 LEU HA H 80 4.830 4.417 0.413 1
1 1019 . 20 1 1 A 80 80 LEU C C 80 176.200 176.850 -0.650 1
1 1020 . 20 1 1 A 80 80 LEU CA C 80 54.700 55.085 -0.385 1
1 1021 . 20 1 1 A 80 80 LEU CB C 80 43.500 42.551 0.949 1
1 1025 . 20 1 1 A 80 80 LEU N N 80 122.600 126.050 -3.450 1
1 1026 . 20 1 1 A 81 81 SER H H 81 8.650 8.878 -0.228 1
1 1027 . 20 1 1 A 81 81 SER HA H 81 4.860 5.117 -0.257 1
1 1030 . 20 1 1 A 81 81 SER C C 81 172.600 172.932 -0.332 1
1 1031 . 20 1 1 A 81 81 SER CA C 81 56.600 57.140 -0.540 1
1 1032 . 20 1 1 A 81 81 SER CB C 81 66.300 65.545 0.755 1
1 1033 . 20 1 1 A 81 81 SER N N 81 114.700 118.294 -3.594 1
1 1034 . 20 1 1 A 82 82 LEU H H 82 8.680 8.621 0.059 1
1 1035 . 20 1 1 A 82 82 LEU HA H 82 5.190 5.350 -0.160 1
1 1045 . 20 1 1 A 82 82 LEU C C 82 177.100 175.463 1.637 1
1 1046 . 20 1 1 A 82 82 LEU CA C 82 53.300 53.728 -0.428 1
1 1047 . 20 1 1 A 82 82 LEU CB C 82 43.800 43.813 -0.013 1
1 1051 . 20 1 1 A 82 82 LEU N N 82 119.800 125.106 -5.306 1
1 1052 . 20 1 1 A 83 83 SER H H 83 9.560 9.420 0.140 1
1 1053 . 20 1 1 A 83 83 SER HA H 83 5.390 5.333 0.057 1
1 1056 . 20 1 1 A 83 83 SER C C 83 174.200 173.246 0.954 1
1 1057 . 20 1 1 A 83 83 SER CA C 83 57.100 56.987 0.113 1
1 1058 . 20 1 1 A 83 83 SER CB C 83 64.400 64.561 -0.161 1
1 1059 . 20 1 1 A 83 83 SER N N 83 119.000 120.585 -1.585 1
1 1060 . 20 1 1 A 84 84 VAL H H 84 9.150 9.326 -0.176 1
1 1061 . 20 1 1 A 84 84 VAL HA H 84 4.490 4.601 -0.111 1
1 1069 . 20 1 1 A 84 84 VAL C C 84 174.700 175.885 -1.185 1
1 1070 . 20 1 1 A 84 84 VAL CA C 84 61.300 61.376 -0.076 1
1 1071 . 20 1 1 A 84 84 VAL CB C 84 33.000 31.311 1.689 1
1 1074 . 20 1 1 A 84 84 VAL N N 84 128.300 127.188 1.112 1
1 1075 . 20 1 1 A 85 85 GLY H H 85 7.970 8.762 -0.792 1
1 1076 . 20 1 1 A 85 85 GLY HA2 H 85 4.030 4.298 -0.268 1
1 1077 . 20 1 1 A 85 85 GLY HA3 H 85 4.840 4.374 0.466 1
1 1078 . 20 1 1 A 85 85 GLY C C 85 175.800 175.156 0.644 1
1 1079 . 20 1 1 A 85 85 GLY CA C 85 44.800 44.179 0.621 1
1 1080 . 20 1 1 A 85 85 GLY N N 85 114.300 115.570 -1.270 1
1 1081 . 20 1 1 A 86 86 ASP H H 86 8.860 8.710 0.150 1
1 1082 . 20 1 1 A 86 86 ASP HA H 86 4.370 4.393 -0.023 1
1 1085 . 20 1 1 A 86 86 ASP C C 86 177.400 177.419 -0.019 1
1 1086 . 20 1 1 A 86 86 ASP CA C 86 57.400 56.144 1.256 1
1 1087 . 20 1 1 A 86 86 ASP CB C 86 40.600 40.357 0.243 1
1 1088 . 20 1 1 A 86 86 ASP N N 86 122.500 119.580 2.920 1
1 1089 . 20 1 1 A 87 87 SER H H 87 8.540 7.840 0.700 1
1 1090 . 20 1 1 A 87 87 SER HA H 87 4.620 4.472 0.148 1
1 1093 . 20 1 1 A 87 87 SER C C 87 174.700 174.136 0.564 1
1 1094 . 20 1 1 A 87 87 SER CA C 87 58.200 59.044 -0.844 1
1 1095 . 20 1 1 A 87 87 SER CB C 87 63.300 63.803 -0.503 1
1 1096 . 20 1 1 A 87 87 SER N N 87 112.100 113.396 -1.296 1
1 1097 . 20 1 1 A 88 88 SER H H 88 7.880 7.524 0.356 1
1 1098 . 20 1 1 A 88 88 SER HA H 88 5.050 4.563 0.487 1
1 1101 . 20 1 1 A 88 88 SER C C 88 172.700 173.373 -0.673 1
1 1102 . 20 1 1 A 88 88 SER CA C 88 57.600 57.510 0.090 1
1 1103 . 20 1 1 A 88 88 SER CB C 88 64.300 64.955 -0.655 1
1 1104 . 20 1 1 A 88 88 SER N N 88 119.200 117.235 1.965 1
1 1105 . 20 1 1 A 89 89 ARG H H 89 8.350 8.340 0.010 1
1 1106 . 20 1 1 A 89 89 ARG HA H 89 4.720 5.128 -0.408 1
1 1114 . 20 1 1 A 89 89 ARG C C 89 174.200 174.429 -0.229 1
1 1115 . 20 1 1 A 89 89 ARG CA C 89 55.000 54.469 0.531 1
1 1116 . 20 1 1 A 89 89 ARG CB C 89 33.500 33.814 -0.314 1
1 1120 . 20 1 1 A 89 89 ARG N N 89 122.800 125.100 -2.300 1
1 1122 . 20 1 1 A 90 90 ILE H H 90 8.530 9.052 -0.522 1
1 1123 . 20 1 1 A 90 90 ILE HA H 90 4.790 4.962 -0.172 1
1 1133 . 20 1 1 A 90 90 ILE C C 90 175.400 175.096 0.304 1
1 1134 . 20 1 1 A 90 90 ILE CA C 90 60.600 60.199 0.401 1
1 1135 . 20 1 1 A 90 90 ILE CB C 90 40.600 40.532 0.068 1
1 1139 . 20 1 1 A 90 90 ILE N N 90 123.100 126.679 -3.579 1
1 1140 . 20 1 1 A 91 91 GLU H H 91 9.000 8.532 0.468 1
1 1141 . 20 1 1 A 91 91 GLU HA H 91 4.730 4.941 -0.211 1
1 1146 . 20 1 1 A 91 91 GLU C C 91 175.100 175.555 -0.455 1
1 1147 . 20 1 1 A 91 91 GLU CA C 91 54.300 54.392 -0.092 1
1 1148 . 20 1 1 A 91 91 GLU CB C 91 32.400 33.246 -0.846 1
1 1150 . 20 1 1 A 91 91 GLU N N 91 126.400 126.949 -0.549 1
1 1151 . 20 1 1 A 92 92 SER H H 92 8.830 8.949 -0.119 1
1 1152 . 20 1 1 A 92 92 SER HA H 92 4.700 4.484 0.216 1
1 1155 . 20 1 1 A 92 92 SER C C 92 174.600 174.126 0.474 1
1 1156 . 20 1 1 A 92 92 SER CA C 92 59.300 58.486 0.814 1
1 1157 . 20 1 1 A 92 92 SER CB C 92 63.100 63.687 -0.587 1
1 1158 . 20 1 1 A 92 92 SER N N 92 119.800 119.724 0.076 1
1 1159 . 20 1 1 A 93 93 VAL H H 93 8.350 8.843 -0.493 1
1 1160 . 20 1 1 A 93 93 VAL HA H 93 4.290 4.122 0.168 1
1 1168 . 20 1 1 A 93 93 VAL C C 93 175.100 176.091 -0.991 1
1 1169 . 20 1 1 A 93 93 VAL CA C 93 61.300 63.671 -2.371 1
1 1170 . 20 1 1 A 93 93 VAL CB C 93 33.900 32.925 0.975 1
1 1173 . 20 1 1 A 93 93 VAL N N 93 121.800 127.358 -5.558 1
1 1174 . 20 1 1 A 94 94 ASN H H 94 8.510 7.894 0.616 1
1 1175 . 20 1 1 A 94 94 ASN HA H 94 4.770 5.035 -0.265 1
1 1180 . 20 1 1 A 94 94 ASN C C 94 175.000 175.214 -0.214 1
1 1181 . 20 1 1 A 94 94 ASN CA C 94 52.700 54.681 -1.981 1
1 1182 . 20 1 1 A 94 94 ASN CB C 94 38.500 40.279 -1.779 1
1 1184 . 20 1 1 A 94 94 ASN N N 94 121.800 117.134 4.666 1
1 1186 . 20 1 1 A 95 95 VAL H H 95 7.860 7.965 -0.105 1
1 1187 . 20 1 1 A 95 95 VAL HA H 95 4.100 3.682 0.418 1
1 1195 . 20 1 1 A 95 95 VAL C C 95 175.100 175.234 -0.134 1
1 1196 . 20 1 1 A 95 95 VAL CA C 95 61.700 63.337 -1.637 1
1 1197 . 20 1 1 A 95 95 VAL CB C 95 33.100 29.497 3.603 1
1 1200 . 20 1 1 A 95 95 VAL N N 95 119.700 117.878 1.822 1
1 1201 . 20 1 1 A 96 96 ASN H H 96 8.490 8.542 -0.052 1
1 1202 . 20 1 1 A 96 96 ASN HA H 96 4.700 4.555 0.145 1
1 1207 . 20 1 1 A 96 96 ASN C C 96 174.600 175.373 -0.773 1
1 1208 . 20 1 1 A 96 96 ASN CA C 96 53.000 54.443 -1.443 1
1 1209 . 20 1 1 A 96 96 ASN CB C 96 39.000 37.361 1.639 1
1 1211 . 20 1 1 A 96 96 ASN N N 96 122.200 112.102 10.098 1
1 1213 . 20 1 1 A 97 97 ILE H H 97 8.080 8.579 -0.499 1
1 1214 . 20 1 1 A 97 97 ILE HA H 97 4.370 4.255 0.115 1
1 1224 . 20 1 1 A 97 97 ILE CA C 97 58.600 63.927 -5.327 1
1 1225 . 20 1 1 A 97 97 ILE CB C 97 38.600 38.424 0.176 1
1 1229 . 20 1 1 A 97 97 ILE N N 97 123.500 123.011 0.489 1
1 1230 . 20 1 1 A 98 98 PRO HA H 98 4.360 4.486 -0.126 1
1 1237 . 20 1 1 A 98 98 PRO C C 98 176.600 176.935 -0.335 1
1 1238 . 20 1 1 A 98 98 PRO CA C 98 63.100 63.246 -0.146 1
1 1239 . 20 1 1 A 98 98 PRO CB C 98 31.800 32.404 -0.604 1
1 1242 . 20 1 1 A 99 99 LEU H H 99 8.200 7.955 0.245 1
1 1243 . 20 1 1 A 99 99 LEU HA H 99 4.200 4.255 -0.055 1
1 1253 . 20 1 1 A 99 99 LEU C C 99 177.300 176.342 0.958 1
1 1254 . 20 1 1 A 99 99 LEU CA C 99 55.000 56.041 -1.041 1
1 1255 . 20 1 1 A 99 99 LEU CB C 99 42.400 40.974 1.426 1
1 1259 . 20 1 1 A 99 99 LEU N N 99 122.500 118.322 4.178 1
1 1260 . 20 1 1 A 100 100 GLU H H 100 8.250 8.386 -0.136 1
1 1261 . 20 1 1 A 100 100 GLU HA H 100 4.140 4.364 -0.224 1
1 1266 . 20 1 1 A 100 100 GLU C C 100 176.100 176.038 0.062 1
1 1267 . 20 1 1 A 100 100 GLU CA C 100 56.100 55.310 0.790 1
1 1268 . 20 1 1 A 100 100 GLU CB C 100 29.900 29.987 -0.087 1
1 1270 . 20 1 1 A 100 100 GLU N N 100 121.000 121.975 -0.975 1
1 1271 . 20 1 1 A 101 101 HIS H H 101 8.540 8.327 0.213 1
1 1272 . 20 1 1 A 101 101 HIS HA H 101 4.600 4.519 0.081 1
1 1275 . 20 1 1 A 101 101 HIS C C 101 174.200 174.963 -0.763 1
1 1276 . 20 1 1 A 101 101 HIS CA C 101 55.200 55.756 -0.556 1
1 1277 . 20 1 1 A 101 101 HIS CB C 101 29.000 30.367 -1.367 1
1 1278 . 20 1 1 A 101 101 HIS N N 101 119.400 117.958 1.442 1
1 1279 . 20 1 1 A 102 102 HIS H H 102 8.660 8.930 -0.270 1
1 1280 . 20 1 1 A 102 102 HIS HA H 102 4.630 4.509 0.121 1
1 1283 . 20 1 1 A 102 102 HIS C C 102 174.200 176.736 -2.536 1
1 1284 . 20 1 1 A 102 102 HIS CA C 102 55.200 56.465 -1.265 1
1 1285 . 20 1 1 A 102 102 HIS CB C 102 29.100 30.334 -1.234 1
1 1286 . 20 1 1 A 102 102 HIS N N 102 119.700 121.172 -1.472 1
1 1287 . 20 1 1 A 103 103 HIS H H 103 8.680 8.717 -0.037 1
1 1288 . 20 1 1 A 103 103 HIS HA H 103 4.640 4.623 0.017 1
1 1291 . 20 1 1 A 103 103 HIS C C 103 174.200 174.876 -0.676 1
1 1292 . 20 1 1 A 103 103 HIS CA C 103 55.200 57.096 -1.896 1
1 1293 . 20 1 1 A 103 103 HIS CB C 103 29.200 30.634 -1.434 1
1 1294 . 20 1 1 A 103 103 HIS N N 103 120.500 120.779 -0.279 1
1 1295 . 20 1 1 A 104 104 HIS H H 104 8.580 7.676 0.904 1
1 1296 . 20 1 1 A 104 104 HIS HA H 104 4.590 4.446 0.144 1
1 1299 . 20 1 1 A 104 104 HIS C C 104 174.200 173.700 0.500 1
1 1300 . 20 1 1 A 104 104 HIS CA C 104 55.200 56.473 -1.273 1
1 1301 . 20 1 1 A 104 104 HIS CB C 104 29.300 29.146 0.154 1
1 1302 . 20 1 1 A 104 104 HIS N N 104 120.700 118.338 2.362 1
1 1303 . 20 1 1 A 105 105 HIS H H 105 8.550 7.210 1.340 1
1 1304 . 20 1 1 A 105 105 HIS HA H 105 4.610 5.058 -0.448 1
1 1307 . 20 1 1 A 105 105 HIS C C 105 173.500 172.352 1.148 1
1 1308 . 20 1 1 A 105 105 HIS CA C 105 55.400 53.740 1.660 1
1 1309 . 20 1 1 A 105 105 HIS CB C 105 28.800 33.251 -4.451 1
1 1310 . 20 1 1 A 105 105 HIS N N 105 119.000 117.317 1.683 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 99 1.055 1
2 1 1 1 "RMS(OBS, PRED)" CA 104 1.105 1
3 1 1 1 "RMS(OBS, PRED)" CB 97 1.129 1
4 1 1 1 "RMS(OBS, PRED)" H 102 0.567 1
5 1 1 1 "RMS(OBS, PRED)" HA 111 0.326 1
6 1 1 1 "RMS(OBS, PRED)" N 102 2.868 1
7 1 2 1 "RMS(OBS, PRED)" C 99 0.978 1
8 1 2 1 "RMS(OBS, PRED)" CA 104 1.004 1
9 1 2 1 "RMS(OBS, PRED)" CB 97 1.132 1
10 1 2 1 "RMS(OBS, PRED)" H 102 0.595 1
11 1 2 1 "RMS(OBS, PRED)" HA 111 0.363 1
12 1 2 1 "RMS(OBS, PRED)" N 102 3.003 1
13 1 3 1 "RMS(OBS, PRED)" C 99 0.969 1
14 1 3 1 "RMS(OBS, PRED)" CA 104 1.224 1
15 1 3 1 "RMS(OBS, PRED)" CB 97 1.039 1
16 1 3 1 "RMS(OBS, PRED)" H 102 0.534 1
17 1 3 1 "RMS(OBS, PRED)" HA 111 0.380 1
18 1 3 1 "RMS(OBS, PRED)" N 102 3.223 1
19 1 4 1 "RMS(OBS, PRED)" C 99 0.973 1
20 1 4 1 "RMS(OBS, PRED)" CA 104 1.067 1
21 1 4 1 "RMS(OBS, PRED)" CB 97 1.139 1
22 1 4 1 "RMS(OBS, PRED)" H 102 0.587 1
23 1 4 1 "RMS(OBS, PRED)" HA 111 0.369 1
24 1 4 1 "RMS(OBS, PRED)" N 102 2.681 1
25 1 5 1 "RMS(OBS, PRED)" C 99 0.938 1
26 1 5 1 "RMS(OBS, PRED)" CA 104 1.072 1
27 1 5 1 "RMS(OBS, PRED)" CB 97 1.247 1
28 1 5 1 "RMS(OBS, PRED)" H 102 0.583 1
29 1 5 1 "RMS(OBS, PRED)" HA 111 0.336 1
30 1 5 1 "RMS(OBS, PRED)" N 102 2.878 1
31 1 6 1 "RMS(OBS, PRED)" C 99 0.923 1
32 1 6 1 "RMS(OBS, PRED)" CA 104 1.147 1
33 1 6 1 "RMS(OBS, PRED)" CB 97 1.134 1
34 1 6 1 "RMS(OBS, PRED)" H 102 0.573 1
35 1 6 1 "RMS(OBS, PRED)" HA 111 0.360 1
36 1 6 1 "RMS(OBS, PRED)" N 102 3.162 1
37 1 7 1 "RMS(OBS, PRED)" C 99 1.047 1
38 1 7 1 "RMS(OBS, PRED)" CA 104 1.213 1
39 1 7 1 "RMS(OBS, PRED)" CB 97 1.139 1
40 1 7 1 "RMS(OBS, PRED)" H 102 0.589 1
41 1 7 1 "RMS(OBS, PRED)" HA 111 0.336 1
42 1 7 1 "RMS(OBS, PRED)" N 102 3.429 1
43 1 8 1 "RMS(OBS, PRED)" C 99 0.893 1
44 1 8 1 "RMS(OBS, PRED)" CA 104 0.921 1
45 1 8 1 "RMS(OBS, PRED)" CB 97 1.181 1
46 1 8 1 "RMS(OBS, PRED)" H 102 0.553 1
47 1 8 1 "RMS(OBS, PRED)" HA 111 0.316 1
48 1 8 1 "RMS(OBS, PRED)" N 102 2.710 1
49 1 9 1 "RMS(OBS, PRED)" C 99 0.968 1
50 1 9 1 "RMS(OBS, PRED)" CA 104 1.108 1
51 1 9 1 "RMS(OBS, PRED)" CB 97 1.099 1
52 1 9 1 "RMS(OBS, PRED)" H 102 0.589 1
53 1 9 1 "RMS(OBS, PRED)" HA 111 0.341 1
54 1 9 1 "RMS(OBS, PRED)" N 102 2.927 1
55 1 10 1 "RMS(OBS, PRED)" C 99 0.967 1
56 1 10 1 "RMS(OBS, PRED)" CA 104 1.063 1
57 1 10 1 "RMS(OBS, PRED)" CB 97 1.264 1
58 1 10 1 "RMS(OBS, PRED)" H 102 0.609 1
59 1 10 1 "RMS(OBS, PRED)" HA 111 0.376 1
60 1 10 1 "RMS(OBS, PRED)" N 102 3.016 1
61 1 11 1 "RMS(OBS, PRED)" C 99 0.951 1
62 1 11 1 "RMS(OBS, PRED)" CA 104 0.971 1
63 1 11 1 "RMS(OBS, PRED)" CB 97 1.183 1
64 1 11 1 "RMS(OBS, PRED)" H 102 0.562 1
65 1 11 1 "RMS(OBS, PRED)" HA 111 0.355 1
66 1 11 1 "RMS(OBS, PRED)" N 102 2.898 1
67 1 12 1 "RMS(OBS, PRED)" C 99 1.058 1
68 1 12 1 "RMS(OBS, PRED)" CA 104 1.134 1
69 1 12 1 "RMS(OBS, PRED)" CB 97 1.100 1
70 1 12 1 "RMS(OBS, PRED)" H 102 0.562 1
71 1 12 1 "RMS(OBS, PRED)" HA 111 0.340 1
72 1 12 1 "RMS(OBS, PRED)" N 102 2.650 1
73 1 13 1 "RMS(OBS, PRED)" C 99 0.983 1
74 1 13 1 "RMS(OBS, PRED)" CA 104 1.096 1
75 1 13 1 "RMS(OBS, PRED)" CB 97 1.360 1
76 1 13 1 "RMS(OBS, PRED)" H 102 0.576 1
77 1 13 1 "RMS(OBS, PRED)" HA 111 0.362 1
78 1 13 1 "RMS(OBS, PRED)" N 102 2.907 1
79 1 14 1 "RMS(OBS, PRED)" C 99 0.981 1
80 1 14 1 "RMS(OBS, PRED)" CA 104 1.192 1
81 1 14 1 "RMS(OBS, PRED)" CB 97 1.116 1
82 1 14 1 "RMS(OBS, PRED)" H 102 0.574 1
83 1 14 1 "RMS(OBS, PRED)" HA 111 0.333 1
84 1 14 1 "RMS(OBS, PRED)" N 102 3.106 1
85 1 15 1 "RMS(OBS, PRED)" C 99 0.951 1
86 1 15 1 "RMS(OBS, PRED)" CA 104 1.021 1
87 1 15 1 "RMS(OBS, PRED)" CB 97 1.169 1
88 1 15 1 "RMS(OBS, PRED)" H 102 0.571 1
89 1 15 1 "RMS(OBS, PRED)" HA 111 0.334 1
90 1 15 1 "RMS(OBS, PRED)" N 102 3.124 1
91 1 16 1 "RMS(OBS, PRED)" C 99 0.944 1
92 1 16 1 "RMS(OBS, PRED)" CA 104 1.252 1
93 1 16 1 "RMS(OBS, PRED)" CB 97 1.138 1
94 1 16 1 "RMS(OBS, PRED)" H 102 0.584 1
95 1 16 1 "RMS(OBS, PRED)" HA 111 0.351 1
96 1 16 1 "RMS(OBS, PRED)" N 102 2.856 1
97 1 17 1 "RMS(OBS, PRED)" C 99 1.053 1
98 1 17 1 "RMS(OBS, PRED)" CA 104 1.072 1
99 1 17 1 "RMS(OBS, PRED)" CB 97 1.123 1
100 1 17 1 "RMS(OBS, PRED)" H 102 0.572 1
101 1 17 1 "RMS(OBS, PRED)" HA 111 0.321 1
102 1 17 1 "RMS(OBS, PRED)" N 102 2.779 1
103 1 18 1 "RMS(OBS, PRED)" C 99 0.935 1
104 1 18 1 "RMS(OBS, PRED)" CA 104 0.997 1
105 1 18 1 "RMS(OBS, PRED)" CB 97 1.185 1
106 1 18 1 "RMS(OBS, PRED)" H 102 0.580 1
107 1 18 1 "RMS(OBS, PRED)" HA 111 0.332 1
108 1 18 1 "RMS(OBS, PRED)" N 102 2.857 1
109 1 19 1 "RMS(OBS, PRED)" C 99 1.000 1
110 1 19 1 "RMS(OBS, PRED)" CA 104 1.120 1
111 1 19 1 "RMS(OBS, PRED)" CB 97 1.175 1
112 1 19 1 "RMS(OBS, PRED)" H 102 0.605 1
113 1 19 1 "RMS(OBS, PRED)" HA 111 0.339 1
114 1 19 1 "RMS(OBS, PRED)" N 102 2.854 1
115 1 20 1 "RMS(OBS, PRED)" C 99 0.977 1
116 1 20 1 "RMS(OBS, PRED)" CA 104 1.152 1
117 1 20 1 "RMS(OBS, PRED)" CB 97 1.228 1
118 1 20 1 "RMS(OBS, PRED)" H 102 0.570 1
119 1 20 1 "RMS(OBS, PRED)" HA 111 0.340 1
120 1 20 1 "RMS(OBS, PRED)" N 102 3.121 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 7 . 1 1 A 2 2 ASP H H 2 8.890 8.198 0.692 2
1 8 . 1 1 A 2 2 ASP HA H 2 4.740 4.780 -0.040 2
1 11 . 1 1 A 2 2 ASP C C 2 174.600 175.208 -0.608 2
1 12 . 1 1 A 2 2 ASP CA C 2 53.800 53.996 -0.196 2
1 13 . 1 1 A 2 2 ASP CB C 2 41.500 42.435 -0.935 2
1 14 . 1 1 A 2 2 ASP N N 2 122.100 122.086 0.014 2
1 15 . 1 1 A 3 3 LEU H H 3 8.280 8.402 -0.122 2
1 16 . 1 1 A 3 3 LEU HA H 3 4.420 4.753 -0.333 2
1 26 . 1 1 A 3 3 LEU C C 3 176.900 176.105 0.795 2
1 27 . 1 1 A 3 3 LEU CA C 3 55.000 55.188 -0.188 2
1 28 . 1 1 A 3 3 LEU CB C 3 42.700 42.685 0.015 2
1 32 . 1 1 A 3 3 LEU N N 3 122.300 125.152 -2.852 2
1 33 . 1 1 A 4 4 VAL H H 4 8.640 8.623 0.017 2
1 34 . 1 1 A 4 4 VAL HA H 4 4.540 4.965 -0.425 2
1 42 . 1 1 A 4 4 VAL C C 4 175.800 174.976 0.824 2
1 43 . 1 1 A 4 4 VAL CA C 4 59.400 58.622 0.778 2
1 44 . 1 1 A 4 4 VAL CB C 4 35.400 35.833 -0.433 2
1 47 . 1 1 A 4 4 VAL N N 4 122.600 119.147 3.453 2
1 48 . 1 1 A 5 5 LYS H H 5 8.630 8.685 -0.055 2
1 49 . 1 1 A 5 5 LYS HA H 5 4.450 4.383 0.067 2
1 58 . 1 1 A 5 5 LYS C C 5 179.400 178.459 0.941 2
1 59 . 1 1 A 5 5 LYS CA C 5 53.600 55.979 -2.379 2
1 60 . 1 1 A 5 5 LYS CB C 5 30.900 33.211 -2.311 2
1 64 . 1 1 A 5 5 LYS N N 5 121.100 121.672 -0.573 2
1 65 . 1 1 A 6 6 ILE H H 6 10.320 8.838 1.482 2
1 66 . 1 1 A 6 6 ILE HA H 6 3.440 3.711 -0.271 2
1 76 . 1 1 A 6 6 ILE C C 6 178.300 177.790 0.510 2
1 77 . 1 1 A 6 6 ILE CA C 6 65.700 65.008 0.692 2
1 78 . 1 1 A 6 6 ILE CB C 6 35.900 37.682 -1.782 2
1 82 . 1 1 A 6 6 ILE N N 6 125.400 122.514 2.886 2
1 83 . 1 1 A 7 7 ARG H H 7 8.210 8.130 0.080 2
1 84 . 1 1 A 7 7 ARG HA H 7 3.850 4.145 -0.295 2
1 92 . 1 1 A 7 7 ARG C C 7 175.600 177.198 -1.598 2
1 93 . 1 1 A 7 7 ARG CA C 7 57.800 58.678 -0.878 2
1 94 . 1 1 A 7 7 ARG CB C 7 30.300 29.770 0.530 2
1 98 . 1 1 A 7 7 ARG N N 7 118.800 120.838 -2.038 2
1 100 . 1 1 A 8 8 ASP H H 8 7.850 7.766 0.084 2
1 101 . 1 1 A 8 8 ASP HA H 8 4.700 4.690 0.010 2
1 104 . 1 1 A 8 8 ASP C C 8 176.100 176.443 -0.343 2
1 105 . 1 1 A 8 8 ASP CA C 8 54.100 54.361 -0.261 2
1 106 . 1 1 A 8 8 ASP CB C 8 41.200 41.123 0.077 2
1 107 . 1 1 A 8 8 ASP N N 8 116.800 118.018 -1.218 2
1 108 . 1 1 A 9 9 VAL H H 9 7.240 7.335 -0.095 2
1 109 . 1 1 A 9 9 VAL HA H 9 3.710 3.962 -0.252 2
1 117 . 1 1 A 9 9 VAL C C 9 174.900 175.736 -0.836 2
1 118 . 1 1 A 9 9 VAL CA C 9 64.300 63.321 0.979 2
1 119 . 1 1 A 9 9 VAL CB C 9 31.500 31.674 -0.174 2
1 122 . 1 1 A 9 9 VAL N N 9 121.800 121.877 -0.077 2
1 123 . 1 1 A 10 10 SER H H 10 8.600 8.410 0.190 2
1 124 . 1 1 A 10 10 SER HA H 10 4.600 4.757 -0.157 2
1 127 . 1 1 A 10 10 SER CA C 10 56.700 57.030 -0.330 2
1 128 . 1 1 A 10 10 SER CB C 10 66.100 65.953 0.147 2
1 129 . 1 1 A 10 10 SER N N 10 122.200 120.654 1.546 2
1 130 . 1 1 A 11 11 LEU H H 11 8.660 8.977 -0.317 2
1 131 . 1 1 A 11 11 LEU HA H 11 3.900 4.041 -0.141 2
1 141 . 1 1 A 11 11 LEU C C 11 178.100 178.919 -0.819 2
1 142 . 1 1 A 11 11 LEU CA C 11 56.700 57.384 -0.684 2
1 143 . 1 1 A 11 11 LEU CB C 11 41.400 41.381 0.019 2
1 147 . 1 1 A 11 11 LEU N N 11 120.300 124.073 -3.773 2
1 148 . 1 1 A 12 12 SER H H 12 8.160 8.002 0.158 2
1 149 . 1 1 A 12 12 SER HA H 12 4.270 4.298 -0.028 2
1 152 . 1 1 A 12 12 SER C C 12 174.200 174.894 -0.694 2
1 153 . 1 1 A 12 12 SER CA C 12 59.900 61.293 -1.393 2
1 154 . 1 1 A 12 12 SER CB C 12 63.100 63.004 0.097 2
1 155 . 1 1 A 12 12 SER N N 12 112.100 113.838 -1.738 2
1 156 . 1 1 A 13 13 THR H H 13 7.460 7.526 -0.066 2
1 157 . 1 1 A 13 13 THR HA H 13 4.760 4.693 0.067 2
1 162 . 1 1 A 13 13 THR CA C 13 56.600 58.904 -2.304 2
1 163 . 1 1 A 13 13 THR CB C 13 70.100 69.273 0.827 2
1 165 . 1 1 A 13 13 THR N N 13 114.700 110.677 4.023 2
1 166 . 1 1 A 14 14 PRO HA H 14 4.050 4.301 -0.251 2
1 173 . 1 1 A 14 14 PRO C C 14 175.800 175.875 -0.075 2
1 174 . 1 1 A 14 14 PRO CA C 14 65.100 64.653 0.447 2
1 175 . 1 1 A 14 14 PRO CB C 14 32.100 31.559 0.541 2
1 178 . 1 1 A 15 15 TYR H H 15 7.380 7.614 -0.234 2
1 179 . 1 1 A 15 15 TYR HA H 15 5.570 5.585 -0.015 2
1 186 . 1 1 A 15 15 TYR C C 15 176.100 175.160 0.940 2
1 187 . 1 1 A 15 15 TYR CA C 15 56.400 56.783 -0.383 2
1 188 . 1 1 A 15 15 TYR CB C 15 41.500 41.043 0.457 2
1 193 . 1 1 A 15 15 TYR N N 15 113.800 117.434 -3.634 2
1 194 . 1 1 A 16 16 VAL H H 16 9.010 8.778 0.232 2
1 195 . 1 1 A 16 16 VAL HA H 16 4.920 5.057 -0.137 2
1 203 . 1 1 A 16 16 VAL C C 16 174.300 173.764 0.536 2
1 204 . 1 1 A 16 16 VAL CA C 16 59.600 59.491 0.109 2
1 205 . 1 1 A 16 16 VAL CB C 16 36.800 36.303 0.497 2
1 208 . 1 1 A 16 16 VAL N N 16 113.800 117.824 -4.024 2
1 209 . 1 1 A 17 17 SER H H 17 7.960 8.757 -0.796 2
1 210 . 1 1 A 17 17 SER HA H 17 5.860 5.587 0.273 2
1 213 . 1 1 A 17 17 SER C C 17 172.700 173.549 -0.849 2
1 214 . 1 1 A 17 17 SER CA C 17 57.300 56.863 0.437 2
1 215 . 1 1 A 17 17 SER CB C 17 64.000 65.346 -1.346 2
1 216 . 1 1 A 17 17 SER N N 17 117.100 117.334 -0.234 2
1 217 . 1 1 A 18 18 VAL H H 18 8.570 8.795 -0.225 2
1 218 . 1 1 A 18 18 VAL HA H 18 4.900 5.138 -0.238 2
1 226 . 1 1 A 18 18 VAL C C 18 173.700 173.898 -0.198 2
1 227 . 1 1 A 18 18 VAL CA C 18 58.800 59.172 -0.372 2
1 228 . 1 1 A 18 18 VAL CB C 18 36.700 36.025 0.675 2
1 231 . 1 1 A 18 18 VAL N N 18 113.500 119.167 -5.667 2
1 232 . 1 1 A 19 19 ILE H H 19 8.490 8.607 -0.117 2
1 233 . 1 1 A 19 19 ILE HA H 19 5.300 4.969 0.331 2
1 243 . 1 1 A 19 19 ILE C C 19 175.800 174.999 0.802 2
1 244 . 1 1 A 19 19 ILE CA C 19 59.700 59.424 0.276 2
1 245 . 1 1 A 19 19 ILE CB C 19 41.700 42.249 -0.549 2
1 249 . 1 1 A 19 19 ILE N N 19 120.600 122.058 -1.458 2
1 250 . 1 1 A 20 20 GLY H H 20 8.670 7.930 0.740 2
1 251 . 1 1 A 20 20 GLY HA2 H 20 3.760 4.178 -0.418 2
1 252 . 1 1 A 20 20 GLY HA3 H 20 4.190 4.181 0.008 2
1 253 . 1 1 A 20 20 GLY C C 20 169.900 171.804 -1.904 2
1 254 . 1 1 A 20 20 GLY CA C 20 46.000 45.972 0.028 2
1 255 . 1 1 A 20 20 GLY N N 20 110.200 113.352 -3.152 2
1 256 . 1 1 A 21 21 LYS H H 21 8.920 8.324 0.596 2
1 257 . 1 1 A 21 21 LYS HA H 21 5.210 5.167 0.043 2
1 266 . 1 1 A 21 21 LYS C C 21 176.400 175.175 1.225 2
1 267 . 1 1 A 21 21 LYS CA C 21 54.400 54.710 -0.310 2
1 268 . 1 1 A 21 21 LYS CB C 21 35.400 35.314 0.086 2
1 272 . 1 1 A 21 21 LYS N N 21 119.100 119.091 0.010 2
1 273 . 1 1 A 22 22 ILE H H 22 8.900 8.512 0.388 2
1 274 . 1 1 A 22 22 ILE HA H 22 5.050 5.012 0.038 2
1 284 . 1 1 A 22 22 ILE C C 22 176.900 175.283 1.617 2
1 285 . 1 1 A 22 22 ILE CA C 22 57.800 60.486 -2.686 2
1 286 . 1 1 A 22 22 ILE CB C 22 36.200 39.105 -2.905 2
1 290 . 1 1 A 22 22 ILE N N 22 130.000 125.837 4.163 2
1 291 . 1 1 A 23 23 THR H H 23 9.020 8.838 0.182 2
1 292 . 1 1 A 23 23 THR HA H 23 4.660 4.992 -0.332 2
1 297 . 1 1 A 23 23 THR C C 23 174.000 174.232 -0.232 2
1 298 . 1 1 A 23 23 THR CA C 23 60.800 60.039 0.761 2
1 299 . 1 1 A 23 23 THR CB C 23 73.400 71.860 1.540 2
1 301 . 1 1 A 23 23 THR N N 23 118.200 118.685 -0.485 2
1 302 . 1 1 A 24 24 GLY H H 24 8.430 8.652 -0.222 2
1 303 . 1 1 A 24 24 GLY HA2 H 24 3.910 3.915 -0.005 2
1 304 . 1 1 A 24 24 GLY HA3 H 24 3.910 4.050 -0.140 2
1 305 . 1 1 A 24 24 GLY C C 24 175.400 174.727 0.673 2
1 306 . 1 1 A 24 24 GLY CA C 24 47.100 46.704 0.396 2
1 307 . 1 1 A 24 24 GLY N N 24 107.200 111.998 -4.798 2
1 308 . 1 1 A 25 25 ILE H H 25 9.370 8.152 1.218 2
1 309 . 1 1 A 25 25 ILE HA H 25 4.480 4.172 0.308 2
1 319 . 1 1 A 25 25 ILE C C 25 178.200 175.244 2.956 2
1 320 . 1 1 A 25 25 ILE CA C 25 59.200 61.365 -2.165 2
1 321 . 1 1 A 25 25 ILE CB C 25 35.400 37.928 -2.528 2
1 325 . 1 1 A 25 25 ILE N N 25 120.600 120.388 0.212 2
1 326 . 1 1 A 26 26 HIS H H 26 9.000 9.169 -0.169 2
1 327 . 1 1 A 26 26 HIS HA H 26 4.770 5.178 -0.408 2
1 330 . 1 1 A 26 26 HIS C C 26 172.700 173.566 -0.866 2
1 331 . 1 1 A 26 26 HIS CA C 26 55.000 54.465 0.535 2
1 332 . 1 1 A 26 26 HIS CB C 26 31.100 33.238 -2.138 2
1 333 . 1 1 A 26 26 HIS N N 26 123.800 125.839 -2.039 2
1 334 . 1 1 A 27 27 LYS H H 27 8.930 8.936 -0.006 2
1 335 . 1 1 A 27 27 LYS HA H 27 4.770 4.563 0.207 2
1 344 . 1 1 A 27 27 LYS C C 27 175.300 175.129 0.171 2
1 345 . 1 1 A 27 27 LYS CA C 27 55.100 55.279 -0.179 2
1 346 . 1 1 A 27 27 LYS CB C 27 34.400 34.160 0.240 2
1 350 . 1 1 A 27 27 LYS N N 27 125.900 124.995 0.905 2
1 351 . 1 1 A 28 28 LYS H H 28 8.880 8.417 0.463 2
1 352 . 1 1 A 28 28 LYS HA H 28 4.570 4.944 -0.374 2
1 361 . 1 1 A 28 28 LYS C C 28 174.500 174.383 0.117 2
1 362 . 1 1 A 28 28 LYS CA C 28 54.600 54.812 -0.212 2
1 363 . 1 1 A 28 28 LYS CB C 28 35.300 36.778 -1.478 2
1 367 . 1 1 A 28 28 LYS N N 28 127.400 125.764 1.636 2
1 368 . 1 1 A 29 29 GLU H H 29 8.440 8.508 -0.068 2
1 369 . 1 1 A 29 29 GLU HA H 29 5.260 5.230 0.030 2
1 374 . 1 1 A 29 29 GLU C C 29 175.800 175.521 0.279 2
1 375 . 1 1 A 29 29 GLU CA C 29 54.800 54.844 -0.044 2
1 376 . 1 1 A 29 29 GLU CB C 29 31.500 33.107 -1.607 2
1 378 . 1 1 A 29 29 GLU N N 29 122.200 122.674 -0.474 2
1 379 . 1 1 A 30 30 TYR H H 30 8.960 8.756 0.204 2
1 380 . 1 1 A 30 30 TYR HA H 30 4.820 5.341 -0.521 2
1 387 . 1 1 A 30 30 TYR C C 30 172.600 172.733 -0.133 2
1 388 . 1 1 A 30 30 TYR CA C 30 56.300 55.559 0.741 2
1 389 . 1 1 A 30 30 TYR CB C 30 40.500 41.521 -1.021 2
1 394 . 1 1 A 30 30 TYR N N 30 121.100 118.680 2.420 2
1 395 . 1 1 A 31 31 GLU H H 31 8.610 8.733 -0.123 2
1 396 . 1 1 A 31 31 GLU HA H 31 4.810 4.511 0.299 2
1 401 . 1 1 A 31 31 GLU C C 31 176.100 175.455 0.645 2
1 402 . 1 1 A 31 31 GLU CA C 31 55.100 55.917 -0.817 2
1 403 . 1 1 A 31 31 GLU CB C 31 30.300 30.364 -0.064 2
1 405 . 1 1 A 31 31 GLU N N 31 121.800 121.050 0.750 2
1 406 . 1 1 A 32 32 SER H H 32 8.570 8.983 -0.414 2
1 407 . 1 1 A 32 32 SER HA H 32 4.520 4.818 -0.298 2
1 410 . 1 1 A 32 32 SER C C 32 174.300 173.377 0.923 2
1 411 . 1 1 A 32 32 SER CA C 32 57.300 57.008 0.292 2
1 412 . 1 1 A 32 32 SER CB C 32 64.100 65.091 -0.991 2
1 413 . 1 1 A 32 32 SER N N 32 118.500 120.240 -1.740 2
1 414 . 1 1 A 33 33 ASP H H 33 9.290 9.121 0.169 2
1 415 . 1 1 A 33 33 ASP HA H 33 4.340 4.338 0.002 2
1 418 . 1 1 A 33 33 ASP C C 33 175.900 176.239 -0.339 2
1 419 . 1 1 A 33 33 ASP CA C 33 55.000 55.020 -0.020 2
1 420 . 1 1 A 33 33 ASP CB C 33 39.300 39.606 -0.306 2
1 421 . 1 1 A 33 33 ASP N N 33 125.700 126.014 -0.314 2
1 422 . 1 1 A 34 34 GLY H H 34 8.690 8.678 0.012 2
1 423 . 1 1 A 34 34 GLY HA2 H 34 3.660 3.801 -0.141 2
1 424 . 1 1 A 34 34 GLY HA3 H 34 4.140 3.803 0.337 2
1 425 . 1 1 A 34 34 GLY C C 34 174.200 173.603 0.597 2
1 426 . 1 1 A 34 34 GLY CA C 34 45.600 45.727 -0.127 2
1 427 . 1 1 A 34 34 GLY N N 34 104.800 106.777 -1.977 2
1 428 . 1 1 A 35 35 THR H H 35 7.840 7.846 -0.006 2
1 429 . 1 1 A 35 35 THR HA H 35 4.660 4.729 -0.069 2
1 434 . 1 1 A 35 35 THR C C 35 173.000 173.166 -0.166 2
1 435 . 1 1 A 35 35 THR CA C 35 60.200 60.483 -0.283 2
1 436 . 1 1 A 35 35 THR CB C 35 71.200 71.711 -0.511 2
1 438 . 1 1 A 35 35 THR N N 35 114.800 113.749 1.051 2
1 439 . 1 1 A 36 36 THR H H 36 8.480 8.685 -0.205 2
1 440 . 1 1 A 36 36 THR HA H 36 4.620 4.552 0.068 2
1 445 . 1 1 A 36 36 THR C C 36 173.800 174.181 -0.381 2
1 446 . 1 1 A 36 36 THR CA C 36 62.300 62.630 -0.329 2
1 447 . 1 1 A 36 36 THR CB C 36 69.500 69.318 0.182 2
1 449 . 1 1 A 36 36 THR N N 36 119.400 120.788 -1.388 2
1 450 . 1 1 A 37 37 LYS H H 37 8.880 8.435 0.445 2
1 451 . 1 1 A 37 37 LYS HA H 37 4.570 4.841 -0.271 2
1 460 . 1 1 A 37 37 LYS C C 37 174.500 175.634 -1.134 2
1 461 . 1 1 A 37 37 LYS CA C 37 54.600 54.097 0.503 2
1 462 . 1 1 A 37 37 LYS CB C 37 35.500 35.910 -0.410 2
1 466 . 1 1 A 37 37 LYS N N 37 128.000 125.655 2.345 2
1 467 . 1 1 A 38 38 SER H H 38 8.370 8.778 -0.408 2
1 468 . 1 1 A 38 38 SER HA H 38 5.250 4.973 0.277 2
1 471 . 1 1 A 38 38 SER C C 38 173.200 173.660 -0.460 2
1 472 . 1 1 A 38 38 SER CA C 38 57.900 57.809 0.091 2
1 473 . 1 1 A 38 38 SER CB C 38 65.500 64.211 1.289 2
1 474 . 1 1 A 38 38 SER N N 38 114.300 118.153 -3.853 2
1 475 . 1 1 A 39 39 VAL H H 39 9.020 8.870 0.150 2
1 476 . 1 1 A 39 39 VAL HA H 39 4.900 4.969 -0.069 2
1 484 . 1 1 A 39 39 VAL C C 39 173.200 172.808 0.392 2
1 485 . 1 1 A 39 39 VAL CA C 39 59.200 59.640 -0.440 2
1 486 . 1 1 A 39 39 VAL CB C 39 34.600 35.323 -0.723 2
1 489 . 1 1 A 39 39 VAL N N 39 123.600 122.098 1.502 2
1 490 . 1 1 A 40 40 TYR H H 40 8.900 8.866 0.034 2
1 491 . 1 1 A 40 40 TYR HA H 40 4.730 5.319 -0.589 2
1 498 . 1 1 A 40 40 TYR CA C 40 56.500 56.853 -0.353 2
1 499 . 1 1 A 40 40 TYR CB C 40 39.000 40.505 -1.505 2
1 504 . 1 1 A 40 40 TYR N N 40 126.300 127.404 -1.104 2
1 505 . 1 1 A 41 41 GLN H H 41 8.630 8.680 -0.050 2
1 506 . 1 1 A 41 41 GLN HA H 41 5.330 5.309 0.021 2
1 513 . 1 1 A 41 41 GLN C C 41 175.500 175.756 -0.256 2
1 514 . 1 1 A 41 41 GLN CA C 41 53.800 54.177 -0.377 2
1 515 . 1 1 A 41 41 GLN CB C 41 32.100 32.096 0.004 2
1 518 . 1 1 A 41 41 GLN N N 41 122.000 121.817 0.183 2
1 520 . 1 1 A 42 42 GLY H H 42 8.560 7.901 0.660 2
1 521 . 1 1 A 42 42 GLY HA2 H 42 3.680 4.307 -0.627 2
1 522 . 1 1 A 42 42 GLY HA3 H 42 4.020 4.356 -0.336 2
1 523 . 1 1 A 42 42 GLY C C 42 171.600 171.083 0.517 2
1 524 . 1 1 A 42 42 GLY CA C 42 47.300 46.145 1.155 2
1 525 . 1 1 A 42 42 GLY N N 42 113.000 108.782 4.218 2
1 526 . 1 1 A 43 43 TYR H H 43 9.320 8.553 0.767 2
1 527 . 1 1 A 43 43 TYR HA H 43 5.280 5.442 -0.162 2
1 534 . 1 1 A 43 43 TYR C C 43 173.200 174.156 -0.956 2
1 535 . 1 1 A 43 43 TYR CA C 43 57.600 56.462 1.138 2
1 536 . 1 1 A 43 43 TYR CB C 43 42.400 42.411 -0.011 2
1 541 . 1 1 A 43 43 TYR N N 43 126.300 118.791 7.509 2
1 542 . 1 1 A 44 44 ILE H H 44 9.160 8.828 0.332 2
1 543 . 1 1 A 44 44 ILE HA H 44 5.270 5.401 -0.131 2
1 553 . 1 1 A 44 44 ILE C C 44 172.900 173.796 -0.896 2
1 554 . 1 1 A 44 44 ILE CA C 44 59.000 59.467 -0.466 2
1 555 . 1 1 A 44 44 ILE CB C 44 42.200 41.687 0.513 2
1 559 . 1 1 A 44 44 ILE N N 44 117.700 123.086 -5.386 2
1 560 . 1 1 A 45 45 GLU H H 45 8.420 8.799 -0.379 2
1 561 . 1 1 A 45 45 GLU HA H 45 5.600 5.396 0.204 2
1 566 . 1 1 A 45 45 GLU C C 45 174.300 174.497 -0.197 2
1 567 . 1 1 A 45 45 GLU CA C 45 54.000 54.525 -0.525 2
1 568 . 1 1 A 45 45 GLU CB C 45 34.400 33.765 0.635 2
1 570 . 1 1 A 45 45 GLU N N 45 123.600 128.064 -4.464 2
1 571 . 1 1 A 46 46 ASP H H 46 8.530 8.549 -0.018 2
1 572 . 1 1 A 46 46 ASP HA H 46 5.070 4.964 0.106 2
1 575 . 1 1 A 46 46 ASP C C 46 175.000 175.389 -0.389 2
1 576 . 1 1 A 46 46 ASP CA C 46 51.800 52.966 -1.166 2
1 577 . 1 1 A 46 46 ASP CB C 46 41.300 43.141 -1.841 2
1 578 . 1 1 A 46 46 ASP N N 46 125.500 121.996 3.504 2
1 579 . 1 1 A 47 47 ASP H H 47 9.160 8.862 0.298 2
1 580 . 1 1 A 47 47 ASP HA H 47 4.430 4.494 -0.064 2
1 583 . 1 1 A 47 47 ASP C C 47 176.000 177.352 -1.352 2
1 584 . 1 1 A 47 47 ASP CA C 47 55.000 56.014 -1.014 2
1 585 . 1 1 A 47 47 ASP CB C 47 38.900 40.429 -1.529 2
1 586 . 1 1 A 47 47 ASP N N 47 114.200 121.196 -6.996 2
1 587 . 1 1 A 48 48 THR H H 48 9.470 7.997 1.474 2
1 588 . 1 1 A 48 48 THR HA H 48 4.520 4.391 0.129 2
1 593 . 1 1 A 48 48 THR C C 48 174.500 174.621 -0.121 2
1 594 . 1 1 A 48 48 THR CA C 48 62.600 63.000 -0.400 2
1 595 . 1 1 A 48 48 THR CB C 48 70.400 69.283 1.117 2
1 597 . 1 1 A 48 48 THR N N 48 111.800 110.194 1.606 2
1 598 . 1 1 A 49 49 ALA H H 49 7.850 7.592 0.258 2
1 599 . 1 1 A 49 49 ALA HA H 49 4.440 4.462 -0.022 2
1 603 . 1 1 A 49 49 ALA C C 49 173.200 175.452 -2.252 2
1 604 . 1 1 A 49 49 ALA CA C 49 52.700 51.187 1.513 2
1 605 . 1 1 A 49 49 ALA CB C 49 21.300 20.474 0.826 2
1 606 . 1 1 A 49 49 ALA N N 49 123.400 120.460 2.940 2
1 607 . 1 1 A 50 50 ARG H H 50 8.160 8.819 -0.659 2
1 608 . 1 1 A 50 50 ARG HA H 50 5.350 5.568 -0.218 2
1 616 . 1 1 A 50 50 ARG C C 50 174.700 174.377 0.323 2
1 617 . 1 1 A 50 50 ARG CA C 50 54.000 54.461 -0.461 2
1 618 . 1 1 A 50 50 ARG CB C 50 34.500 34.396 0.104 2
1 622 . 1 1 A 50 50 ARG N N 50 117.400 115.221 2.179 2
1 624 . 1 1 A 51 51 ILE H H 51 9.390 8.654 0.736 2
1 625 . 1 1 A 51 51 ILE HA H 51 4.790 4.993 -0.203 2
1 635 . 1 1 A 51 51 ILE C C 51 172.600 173.878 -1.278 2
1 636 . 1 1 A 51 51 ILE CA C 51 60.000 59.029 0.971 2
1 637 . 1 1 A 51 51 ILE CB C 51 42.800 41.895 0.905 2
1 641 . 1 1 A 51 51 ILE N N 51 124.600 121.049 3.551 2
1 642 . 1 1 A 52 52 ARG H H 52 7.980 8.455 -0.475 2
1 643 . 1 1 A 52 52 ARG HA H 52 4.170 4.274 -0.104 2
1 651 . 1 1 A 52 52 ARG C C 52 174.600 176.058 -1.458 2
1 652 . 1 1 A 52 52 ARG CA C 52 57.100 56.148 0.952 2
1 653 . 1 1 A 52 52 ARG CB C 52 31.300 30.925 0.375 2
1 657 . 1 1 A 52 52 ARG N N 52 125.900 126.991 -1.091 2
1 659 . 1 1 A 53 53 ILE H H 53 8.290 8.611 -0.321 2
1 660 . 1 1 A 53 53 ILE HA H 53 5.160 5.155 0.005 2
1 670 . 1 1 A 53 53 ILE C C 53 172.400 174.388 -1.988 2
1 671 . 1 1 A 53 53 ILE CA C 53 58.600 59.115 -0.515 2
1 672 . 1 1 A 53 53 ILE CB C 53 41.900 42.458 -0.558 2
1 676 . 1 1 A 53 53 ILE N N 53 118.500 120.014 -1.514 2
1 677 . 1 1 A 54 54 SER H H 54 8.350 8.791 -0.441 2
1 678 . 1 1 A 54 54 SER HA H 54 5.070 5.247 -0.177 2
1 681 . 1 1 A 54 54 SER C C 54 172.400 172.520 -0.120 2
1 682 . 1 1 A 54 54 SER CA C 54 57.000 56.849 0.151 2
1 683 . 1 1 A 54 54 SER CB C 54 65.900 65.468 0.432 2
1 684 . 1 1 A 54 54 SER N N 54 120.700 118.267 2.433 2
1 685 . 1 1 A 55 55 SER H H 55 9.130 9.111 0.019 2
1 686 . 1 1 A 55 55 SER HA H 55 5.270 5.212 0.058 2
1 690 . 1 1 A 55 55 SER C C 55 174.400 172.792 1.608 2
1 691 . 1 1 A 55 55 SER CA C 55 55.500 56.411 -0.911 2
1 692 . 1 1 A 55 55 SER CB C 55 64.500 65.208 -0.708 2
1 693 . 1 1 A 55 55 SER N N 55 117.200 119.504 -2.304 2
1 694 . 1 1 A 56 56 PHE H H 56 8.970 8.646 0.324 2
1 695 . 1 1 A 56 56 PHE HA H 56 4.600 4.931 -0.331 2
1 703 . 1 1 A 56 56 PHE C C 56 176.500 177.134 -0.634 2
1 704 . 1 1 A 56 56 PHE CA C 56 58.300 57.360 0.940 2
1 705 . 1 1 A 56 56 PHE CB C 56 37.900 40.661 -2.761 2
1 711 . 1 1 A 56 56 PHE N N 56 129.400 124.897 4.503 2
1 712 . 1 1 A 57 57 GLY H H 57 8.570 8.870 -0.300 2
1 713 . 1 1 A 57 57 GLY HA2 H 57 4.020 4.138 -0.118 2
1 714 . 1 1 A 57 57 GLY HA3 H 57 4.380 4.167 0.213 2
1 715 . 1 1 A 57 57 GLY C C 57 173.700 174.181 -0.481 2
1 716 . 1 1 A 57 57 GLY CA C 57 46.300 45.701 0.599 2
1 717 . 1 1 A 57 57 GLY N N 57 112.500 112.275 0.225 2
1 718 . 1 1 A 58 58 LYS H H 58 6.800 8.207 -1.407 2
1 719 . 1 1 A 58 58 LYS HA H 58 4.410 4.367 0.043 2
1 728 . 1 1 A 58 58 LYS C C 58 174.800 175.725 -0.925 2
1 729 . 1 1 A 58 58 LYS CA C 58 55.200 56.264 -1.064 2
1 730 . 1 1 A 58 58 LYS CB C 58 33.300 33.236 0.064 2
1 734 . 1 1 A 58 58 LYS N N 58 118.700 121.285 -2.585 2
1 735 . 1 1 A 59 59 GLN H H 59 8.390 8.516 -0.126 2
1 736 . 1 1 A 59 59 GLN HA H 59 1.830 3.823 -1.993 2
1 743 . 1 1 A 59 59 GLN C C 59 174.100 174.520 -0.420 2
1 744 . 1 1 A 59 59 GLN CA C 59 57.100 54.777 2.323 2
1 745 . 1 1 A 59 59 GLN CB C 59 28.900 29.706 -0.806 2
1 748 . 1 1 A 59 59 GLN N N 59 124.000 123.521 0.479 2
1 750 . 1 1 A 60 60 LEU H H 60 5.320 8.228 -2.908 2
1 751 . 1 1 A 60 60 LEU HA H 60 4.370 4.959 -0.589 2
1 761 . 1 1 A 60 60 LEU CA C 60 52.800 53.449 -0.649 2
1 762 . 1 1 A 60 60 LEU CB C 60 46.700 45.424 1.276 2
1 766 . 1 1 A 60 60 LEU N N 60 121.800 123.942 -2.142 2
1 767 . 1 1 A 61 61 GLN H H 61 8.660 8.716 -0.056 2
1 768 . 1 1 A 61 61 GLN HA H 61 4.440 4.730 -0.290 2
1 775 . 1 1 A 61 61 GLN C C 61 174.000 175.038 -1.038 2
1 776 . 1 1 A 61 61 GLN CA C 61 53.800 54.038 -0.238 2
1 777 . 1 1 A 61 61 GLN CB C 61 31.800 31.515 0.285 2
1 780 . 1 1 A 61 61 GLN N N 61 120.300 120.454 -0.154 2
1 782 . 1 1 A 62 62 ASP H H 62 8.450 8.710 -0.260 2
1 783 . 1 1 A 62 62 ASP HA H 62 4.130 4.446 -0.316 2
1 786 . 1 1 A 62 62 ASP C C 62 177.200 176.677 0.523 2
1 787 . 1 1 A 62 62 ASP CA C 62 55.700 54.993 0.707 2
1 788 . 1 1 A 62 62 ASP CB C 62 39.400 40.921 -1.521 2
1 789 . 1 1 A 62 62 ASP N N 62 122.400 123.538 -1.138 2
1 790 . 1 1 A 63 63 SER H H 63 9.210 9.007 0.203 2
1 791 . 1 1 A 63 63 SER HA H 63 3.850 4.130 -0.280 2
1 794 . 1 1 A 63 63 SER C C 63 173.200 173.097 0.103 2
1 795 . 1 1 A 63 63 SER CA C 63 61.700 59.393 2.307 2
1 796 . 1 1 A 63 63 SER CB C 63 61.800 61.515 0.285 2
1 797 . 1 1 A 63 63 SER N N 63 114.300 117.417 -3.117 2
1 798 . 1 1 A 64 64 ASP H H 64 7.960 7.620 0.340 2
1 799 . 1 1 A 64 64 ASP HA H 64 4.540 4.910 -0.370 2
1 802 . 1 1 A 64 64 ASP C C 64 174.900 175.070 -0.170 2
1 803 . 1 1 A 64 64 ASP CA C 64 54.900 53.563 1.337 2
1 804 . 1 1 A 64 64 ASP CB C 64 40.900 42.564 -1.664 2
1 805 . 1 1 A 64 64 ASP N N 64 122.600 121.138 1.462 2
1 806 . 1 1 A 65 65 VAL H H 65 8.180 8.651 -0.471 2
1 807 . 1 1 A 65 65 VAL HA H 65 4.670 4.514 0.156 2
1 815 . 1 1 A 65 65 VAL C C 65 175.900 175.631 0.269 2
1 816 . 1 1 A 65 65 VAL CA C 65 62.300 62.272 0.028 2
1 817 . 1 1 A 65 65 VAL CB C 65 31.700 31.468 0.232 2
1 820 . 1 1 A 65 65 VAL N N 65 123.100 125.140 -2.040 2
1 821 . 1 1 A 66 66 VAL H H 66 8.770 8.768 0.003 2
1 822 . 1 1 A 66 66 VAL HA H 66 5.160 5.112 0.048 2
1 830 . 1 1 A 66 66 VAL C C 66 173.600 173.322 0.278 2
1 831 . 1 1 A 66 66 VAL CA C 66 58.100 58.790 -0.690 2
1 832 . 1 1 A 66 66 VAL CB C 66 35.700 36.091 -0.391 2
1 835 . 1 1 A 66 66 VAL N N 66 118.100 121.067 -2.967 2
1 836 . 1 1 A 67 67 ARG H H 67 8.880 8.828 0.052 2
1 837 . 1 1 A 67 67 ARG HA H 67 5.110 5.142 -0.032 2
1 845 . 1 1 A 67 67 ARG C C 67 175.300 174.599 0.701 2
1 846 . 1 1 A 67 67 ARG CA C 67 54.200 54.398 -0.198 2
1 847 . 1 1 A 67 67 ARG CB C 67 32.200 33.522 -1.322 2
1 851 . 1 1 A 67 67 ARG N N 67 120.200 121.744 -1.544 2
1 853 . 1 1 A 68 68 ILE H H 68 9.220 8.977 0.243 2
1 854 . 1 1 A 68 68 ILE HA H 68 4.990 4.681 0.309 2
1 864 . 1 1 A 68 68 ILE C C 68 174.900 174.617 0.283 2
1 865 . 1 1 A 68 68 ILE CA C 68 58.600 59.692 -1.092 2
1 866 . 1 1 A 68 68 ILE CB C 68 39.300 38.880 0.420 2
1 870 . 1 1 A 68 68 ILE N N 68 127.200 128.268 -1.068 2
1 871 . 1 1 A 69 69 ASP H H 69 9.110 8.904 0.206 2
1 872 . 1 1 A 69 69 ASP HA H 69 5.370 5.144 0.226 2
1 875 . 1 1 A 69 69 ASP C C 69 175.800 176.192 -0.392 2
1 876 . 1 1 A 69 69 ASP CA C 69 52.400 52.781 -0.381 2
1 877 . 1 1 A 69 69 ASP CB C 69 43.700 43.268 0.432 2
1 878 . 1 1 A 69 69 ASP N N 69 123.400 126.203 -2.803 2
1 879 . 1 1 A 70 70 ASN H H 70 8.300 8.899 -0.599 2
1 880 . 1 1 A 70 70 ASN HA H 70 4.160 4.402 -0.242 2
1 885 . 1 1 A 70 70 ASN C C 70 176.300 174.621 1.679 2
1 886 . 1 1 A 70 70 ASN CA C 70 54.300 54.204 0.096 2
1 887 . 1 1 A 70 70 ASN CB C 70 37.500 37.569 -0.069 2
1 889 . 1 1 A 70 70 ASN N N 70 119.800 121.268 -1.468 2
1 891 . 1 1 A 71 71 ALA H H 71 9.100 7.924 1.176 2
1 892 . 1 1 A 71 71 ALA HA H 71 4.500 4.471 0.029 2
1 896 . 1 1 A 71 71 ALA C C 71 175.700 176.705 -1.005 2
1 897 . 1 1 A 71 71 ALA CA C 71 51.900 52.691 -0.791 2
1 898 . 1 1 A 71 71 ALA CB C 71 19.600 19.837 -0.237 2
1 899 . 1 1 A 71 71 ALA N N 71 123.000 121.039 1.961 2
1 900 . 1 1 A 72 72 ARG H H 72 8.490 8.462 0.028 2
1 901 . 1 1 A 72 72 ARG HA H 72 4.720 4.825 -0.105 2
1 909 . 1 1 A 72 72 ARG C C 72 175.800 175.173 0.627 2
1 910 . 1 1 A 72 72 ARG CA C 72 54.400 55.060 -0.660 2
1 911 . 1 1 A 72 72 ARG CB C 72 32.700 31.813 0.887 2
1 915 . 1 1 A 72 72 ARG N N 72 122.500 123.231 -0.731 2
1 917 . 1 1 A 73 73 VAL H H 73 8.310 8.232 0.078 2
1 918 . 1 1 A 73 73 VAL HA H 73 4.250 4.561 -0.311 2
1 926 . 1 1 A 73 73 VAL C C 73 174.600 175.442 -0.842 2
1 927 . 1 1 A 73 73 VAL CA C 73 62.800 61.901 0.899 2
1 928 . 1 1 A 73 73 VAL CB C 73 32.100 32.156 -0.056 2
1 931 . 1 1 A 73 73 VAL N N 73 127.100 126.625 0.475 2
1 932 . 1 1 A 74 74 ALA H H 74 8.880 8.869 0.011 2
1 933 . 1 1 A 74 74 ALA HA H 74 4.500 5.000 -0.500 2
1 937 . 1 1 A 74 74 ALA C C 74 174.800 174.876 -0.076 2
1 938 . 1 1 A 74 74 ALA CA C 74 50.500 50.539 -0.039 2
1 939 . 1 1 A 74 74 ALA CB C 74 22.500 23.713 -1.213 2
1 940 . 1 1 A 74 74 ALA N N 74 131.000 128.648 2.352 2
1 941 . 1 1 A 75 75 GLN H H 75 8.280 8.463 -0.183 2
1 942 . 1 1 A 75 75 GLN HA H 75 4.910 5.014 -0.104 2
1 949 . 1 1 A 75 75 GLN C C 75 175.100 174.333 0.767 2
1 950 . 1 1 A 75 75 GLN CA C 75 54.600 54.101 0.499 2
1 951 . 1 1 A 75 75 GLN CB C 75 31.400 31.251 0.149 2
1 954 . 1 1 A 75 75 GLN N N 75 118.800 120.282 -1.482 2
1 956 . 1 1 A 76 76 PHE H H 76 8.710 9.219 -0.509 2
1 957 . 1 1 A 76 76 PHE HA H 76 4.660 4.898 -0.238 2
1 965 . 1 1 A 76 76 PHE C C 76 174.900 175.822 -0.922 2
1 966 . 1 1 A 76 76 PHE CA C 76 57.000 56.799 0.201 2
1 967 . 1 1 A 76 76 PHE CB C 76 41.000 41.742 -0.742 2
1 973 . 1 1 A 76 76 PHE N N 76 125.000 124.846 0.154 2
1 974 . 1 1 A 77 77 ASN H H 77 9.040 9.325 -0.285 2
1 975 . 1 1 A 77 77 ASN HA H 77 4.170 4.489 -0.319 2
1 980 . 1 1 A 77 77 ASN C C 77 174.200 175.464 -1.264 2
1 981 . 1 1 A 77 77 ASN CA C 77 53.800 54.554 -0.754 2
1 982 . 1 1 A 77 77 ASN CB C 77 37.400 37.538 -0.138 2
1 984 . 1 1 A 77 77 ASN N N 77 123.200 122.953 0.247 2
1 986 . 1 1 A 78 78 GLY H H 78 8.370 8.575 -0.205 2
1 987 . 1 1 A 78 78 GLY HA2 H 78 3.410 3.647 -0.237 2
1 988 . 1 1 A 78 78 GLY HA3 H 78 3.980 3.745 0.235 2
1 989 . 1 1 A 78 78 GLY C C 78 173.800 173.140 0.660 2
1 990 . 1 1 A 78 78 GLY CA C 78 45.000 45.362 -0.362 2
1 991 . 1 1 A 78 78 GLY N N 78 103.300 104.673 -1.373 2
1 992 . 1 1 A 79 79 TYR H H 79 7.670 8.087 -0.417 2
1 993 . 1 1 A 79 79 TYR HA H 79 4.860 4.939 -0.079 2
1 1000 . 1 1 A 79 79 TYR C C 79 174.800 175.423 -0.623 2
1 1001 . 1 1 A 79 79 TYR CA C 79 56.300 57.100 -0.800 2
1 1002 . 1 1 A 79 79 TYR CB C 79 40.800 41.231 -0.431 2
1 1007 . 1 1 A 79 79 TYR N N 79 118.700 118.801 -0.101 2
1 1008 . 1 1 A 80 80 LEU H H 80 8.760 8.705 0.055 2
1 1009 . 1 1 A 80 80 LEU HA H 80 4.830 4.518 0.312 2
1 1019 . 1 1 A 80 80 LEU C C 80 176.200 176.248 -0.048 2
1 1020 . 1 1 A 80 80 LEU CA C 80 54.700 55.008 -0.308 2
1 1021 . 1 1 A 80 80 LEU CB C 80 43.500 42.606 0.894 2
1 1025 . 1 1 A 80 80 LEU N N 80 122.600 125.544 -2.944 2
1 1026 . 1 1 A 81 81 SER H H 81 8.650 8.828 -0.178 2
1 1027 . 1 1 A 81 81 SER HA H 81 4.860 5.229 -0.369 2
1 1030 . 1 1 A 81 81 SER C C 81 172.600 172.498 0.102 2
1 1031 . 1 1 A 81 81 SER CA C 81 56.600 57.326 -0.726 2
1 1032 . 1 1 A 81 81 SER CB C 81 66.300 66.396 -0.096 2
1 1033 . 1 1 A 81 81 SER N N 81 114.700 117.155 -2.455 2
1 1034 . 1 1 A 82 82 LEU H H 82 8.680 8.644 0.036 2
1 1035 . 1 1 A 82 82 LEU HA H 82 5.190 5.175 0.015 2
1 1045 . 1 1 A 82 82 LEU C C 82 177.100 175.549 1.551 2
1 1046 . 1 1 A 82 82 LEU CA C 82 53.300 53.749 -0.449 2
1 1047 . 1 1 A 82 82 LEU CB C 82 43.800 43.634 0.166 2
1 1051 . 1 1 A 82 82 LEU N N 82 119.800 122.976 -3.176 2
1 1052 . 1 1 A 83 83 SER H H 83 9.560 9.464 0.096 2
1 1053 . 1 1 A 83 83 SER HA H 83 5.390 5.366 0.024 2
1 1056 . 1 1 A 83 83 SER C C 83 174.200 173.584 0.616 2
1 1057 . 1 1 A 83 83 SER CA C 83 57.100 57.428 -0.328 2
1 1058 . 1 1 A 83 83 SER CB C 83 64.400 64.585 -0.185 2
1 1059 . 1 1 A 83 83 SER N N 83 119.000 121.132 -2.132 2
1 1060 . 1 1 A 84 84 VAL H H 84 9.150 9.177 -0.027 2
1 1061 . 1 1 A 84 84 VAL HA H 84 4.490 4.696 -0.206 2
1 1069 . 1 1 A 84 84 VAL C C 84 174.700 176.025 -1.325 2
1 1070 . 1 1 A 84 84 VAL CA C 84 61.300 61.229 0.071 2
1 1071 . 1 1 A 84 84 VAL CB C 84 33.000 32.199 0.801 2
1 1074 . 1 1 A 84 84 VAL N N 84 128.300 126.794 1.506 2
1 1075 . 1 1 A 85 85 GLY H H 85 7.970 8.803 -0.833 2
1 1076 . 1 1 A 85 85 GLY HA2 H 85 4.030 4.305 -0.275 2
1 1077 . 1 1 A 85 85 GLY HA3 H 85 4.840 4.395 0.445 2
1 1078 . 1 1 A 85 85 GLY C C 85 175.800 174.905 0.895 2
1 1079 . 1 1 A 85 85 GLY CA C 85 44.800 44.389 0.411 2
1 1080 . 1 1 A 85 85 GLY N N 85 114.300 115.217 -0.917 2
1 1081 . 1 1 A 86 86 ASP H H 86 8.860 8.831 0.029 2
1 1082 . 1 1 A 86 86 ASP HA H 86 4.370 4.414 -0.044 2
1 1085 . 1 1 A 86 86 ASP C C 86 177.400 177.469 -0.069 2
1 1086 . 1 1 A 86 86 ASP CA C 86 57.400 56.504 0.896 2
1 1087 . 1 1 A 86 86 ASP CB C 86 40.600 40.403 0.197 2
1 1088 . 1 1 A 86 86 ASP N N 86 122.500 119.985 2.515 2
1 1089 . 1 1 A 87 87 SER H H 87 8.540 7.825 0.715 2
1 1090 . 1 1 A 87 87 SER HA H 87 4.620 4.403 0.217 2
1 1093 . 1 1 A 87 87 SER C C 87 174.700 174.544 0.156 2
1 1094 . 1 1 A 87 87 SER CA C 87 58.200 59.384 -1.184 2
1 1095 . 1 1 A 87 87 SER CB C 87 63.300 63.650 -0.350 2
1 1096 . 1 1 A 87 87 SER N N 87 112.100 112.899 -0.799 2
1 1097 . 1 1 A 88 88 SER H H 88 7.880 7.537 0.343 2
1 1098 . 1 1 A 88 88 SER HA H 88 5.050 4.548 0.502 2
1 1101 . 1 1 A 88 88 SER C C 88 172.700 173.729 -1.029 2
1 1102 . 1 1 A 88 88 SER CA C 88 57.600 58.105 -0.505 2
1 1103 . 1 1 A 88 88 SER CB C 88 64.300 64.745 -0.445 2
1 1104 . 1 1 A 88 88 SER N N 88 119.200 117.258 1.942 2
1 1105 . 1 1 A 89 89 ARG H H 89 8.350 8.339 0.011 2
1 1106 . 1 1 A 89 89 ARG HA H 89 4.720 5.195 -0.475 2
1 1114 . 1 1 A 89 89 ARG C C 89 174.200 174.609 -0.409 2
1 1115 . 1 1 A 89 89 ARG CA C 89 55.000 54.478 0.522 2
1 1116 . 1 1 A 89 89 ARG CB C 89 33.500 33.898 -0.398 2
1 1120 . 1 1 A 89 89 ARG N N 89 122.800 122.679 0.121 2
1 1122 . 1 1 A 90 90 ILE H H 90 8.530 9.001 -0.471 2
1 1123 . 1 1 A 90 90 ILE HA H 90 4.790 4.991 -0.201 2
1 1133 . 1 1 A 90 90 ILE C C 90 175.400 174.846 0.554 2
1 1134 . 1 1 A 90 90 ILE CA C 90 60.600 60.147 0.453 2
1 1135 . 1 1 A 90 90 ILE CB C 90 40.600 40.619 -0.019 2
1 1139 . 1 1 A 90 90 ILE N N 90 123.100 125.034 -1.934 2
1 1140 . 1 1 A 91 91 GLU H H 91 9.000 8.979 0.021 2
1 1141 . 1 1 A 91 91 GLU HA H 91 4.730 4.986 -0.256 2
1 1146 . 1 1 A 91 91 GLU C C 91 175.100 175.892 -0.792 2
1 1147 . 1 1 A 91 91 GLU CA C 91 54.300 54.510 -0.210 2
1 1148 . 1 1 A 91 91 GLU CB C 91 32.400 32.749 -0.349 2
1 1150 . 1 1 A 91 91 GLU N N 91 126.400 127.708 -1.308 2
1 1151 . 1 1 A 92 92 SER H H 92 8.830 8.850 -0.020 2
1 1152 . 1 1 A 92 92 SER HA H 92 4.700 4.701 -0.001 2
1 1155 . 1 1 A 92 92 SER C C 92 174.600 174.343 0.257 2
1 1156 . 1 1 A 92 92 SER CA C 92 59.300 58.367 0.932 2
1 1157 . 1 1 A 92 92 SER CB C 92 63.100 63.990 -0.890 2
1 1158 . 1 1 A 92 92 SER N N 92 119.800 121.045 -1.245 2
1 1159 . 1 1 A 93 93 VAL H H 93 8.350 8.428 -0.078 2
1 1160 . 1 1 A 93 93 VAL HA H 93 4.290 4.514 -0.224 2
1 1168 . 1 1 A 93 93 VAL C C 93 175.100 175.453 -0.353 2
1 1169 . 1 1 A 93 93 VAL CA C 93 61.300 61.426 -0.126 2
1 1170 . 1 1 A 93 93 VAL CB C 93 33.900 33.540 0.360 2
1 1173 . 1 1 A 93 93 VAL N N 93 121.800 123.360 -1.560 2
1 1174 . 1 1 A 94 94 ASN H H 94 8.510 8.662 -0.152 2
1 1175 . 1 1 A 94 94 ASN HA H 94 4.770 4.799 -0.029 2
1 1180 . 1 1 A 94 94 ASN C C 94 175.000 174.762 0.238 2
1 1181 . 1 1 A 94 94 ASN CA C 94 52.700 53.709 -1.009 2
1 1182 . 1 1 A 94 94 ASN CB C 94 38.500 39.292 -0.792 2
1 1184 . 1 1 A 94 94 ASN N N 94 121.800 123.441 -1.641 2
1 1186 . 1 1 A 95 95 VAL H H 95 7.860 8.134 -0.274 2
1 1187 . 1 1 A 95 95 VAL HA H 95 4.100 4.250 -0.150 2
1 1195 . 1 1 A 95 95 VAL C C 95 175.100 175.384 -0.284 2
1 1196 . 1 1 A 95 95 VAL CA C 95 61.700 62.385 -0.685 2
1 1197 . 1 1 A 95 95 VAL CB C 95 33.100 32.725 0.375 2
1 1200 . 1 1 A 95 95 VAL N N 95 119.700 119.526 0.174 2
1 1201 . 1 1 A 96 96 ASN H H 96 8.490 8.582 -0.092 2
1 1202 . 1 1 A 96 96 ASN HA H 96 4.700 4.849 -0.149 2
1 1207 . 1 1 A 96 96 ASN C C 96 174.600 174.706 -0.106 2
1 1208 . 1 1 A 96 96 ASN CA C 96 53.000 53.281 -0.281 2
1 1209 . 1 1 A 96 96 ASN CB C 96 39.000 38.893 0.107 2
1 1211 . 1 1 A 96 96 ASN N N 96 122.200 122.021 0.179 2
1 1213 . 1 1 A 97 97 ILE H H 97 8.080 8.503 -0.423 2
1 1214 . 1 1 A 97 97 ILE HA H 97 4.370 4.347 0.023 2
1 1224 . 1 1 A 97 97 ILE CA C 97 58.600 60.052 -1.452 2
1 1225 . 1 1 A 97 97 ILE CB C 97 38.600 37.832 0.768 2
1 1229 . 1 1 A 97 97 ILE N N 97 123.500 120.821 2.679 2
1 1230 . 1 1 A 98 98 PRO HA H 98 4.360 4.498 -0.138 2
1 1237 . 1 1 A 98 98 PRO C C 98 176.600 176.762 -0.162 2
1 1238 . 1 1 A 98 98 PRO CA C 98 63.100 63.268 -0.168 2
1 1239 . 1 1 A 98 98 PRO CB C 98 31.800 32.188 -0.388 2
1 1242 . 1 1 A 99 99 LEU H H 99 8.200 8.347 -0.147 2
1 1243 . 1 1 A 99 99 LEU HA H 99 4.200 4.208 -0.008 2
1 1253 . 1 1 A 99 99 LEU C C 99 177.300 176.654 0.646 2
1 1254 . 1 1 A 99 99 LEU CA C 99 55.000 55.549 -0.549 2
1 1255 . 1 1 A 99 99 LEU CB C 99 42.400 41.798 0.601 2
1 1259 . 1 1 A 99 99 LEU N N 99 122.500 120.673 1.827 2
1 1260 . 1 1 A 100 100 GLU H H 100 8.250 8.389 -0.139 2
1 1261 . 1 1 A 100 100 GLU HA H 100 4.140 4.368 -0.228 2
1 1266 . 1 1 A 100 100 GLU C C 100 176.100 176.210 -0.110 2
1 1267 . 1 1 A 100 100 GLU CA C 100 56.100 56.650 -0.550 2
1 1268 . 1 1 A 100 100 GLU CB C 100 29.900 30.059 -0.159 2
1 1270 . 1 1 A 100 100 GLU N N 100 121.000 122.113 -1.113 2
1 1271 . 1 1 A 101 101 HIS H H 101 8.540 8.475 0.065 2
1 1272 . 1 1 A 101 101 HIS HA H 101 4.600 4.583 0.017 2
1 1275 . 1 1 A 101 101 HIS C C 101 174.200 174.915 -0.715 2
1 1276 . 1 1 A 101 101 HIS CA C 101 55.200 56.613 -1.413 2
1 1277 . 1 1 A 101 101 HIS CB C 101 29.000 30.091 -1.091 2
1 1278 . 1 1 A 101 101 HIS N N 101 119.400 120.883 -1.483 2
1 1279 . 1 1 A 102 102 HIS H H 102 8.660 8.341 0.319 2
1 1280 . 1 1 A 102 102 HIS HA H 102 4.630 4.525 0.105 2
1 1283 . 1 1 A 102 102 HIS C C 102 174.200 175.014 -0.815 2
1 1284 . 1 1 A 102 102 HIS CA C 102 55.200 56.627 -1.427 2
1 1285 . 1 1 A 102 102 HIS CB C 102 29.100 30.207 -1.107 2
1 1286 . 1 1 A 102 102 HIS N N 102 119.700 119.451 0.249 2
1 1287 . 1 1 A 103 103 HIS H H 103 8.680 8.394 0.286 2
1 1288 . 1 1 A 103 103 HIS HA H 103 4.640 4.583 0.057 2
1 1291 . 1 1 A 103 103 HIS C C 103 174.200 174.984 -0.784 2
1 1292 . 1 1 A 103 103 HIS CA C 103 55.200 56.277 -1.077 2
1 1293 . 1 1 A 103 103 HIS CB C 103 29.200 30.831 -1.631 2
1 1294 . 1 1 A 103 103 HIS N N 103 120.500 119.379 1.121 2
1 1295 . 1 1 A 104 104 HIS H H 104 8.580 8.106 0.474 2
1 1296 . 1 1 A 104 104 HIS HA H 104 4.590 4.309 0.281 2
1 1299 . 1 1 A 104 104 HIS C C 104 174.200 174.540 -0.340 2
1 1300 . 1 1 A 104 104 HIS CA C 104 55.200 56.735 -1.535 2
1 1301 . 1 1 A 104 104 HIS CB C 104 29.300 29.987 -0.687 2
1 1302 . 1 1 A 104 104 HIS N N 104 120.700 118.938 1.762 2
1 1303 . 1 1 A 105 105 HIS H H 105 8.550 7.956 0.594 2
1 1304 . 1 1 A 105 105 HIS HA H 105 4.610 4.436 0.174 2
1 1307 . 1 1 A 105 105 HIS C C 105 173.500 174.957 -1.457 2
1 1308 . 1 1 A 105 105 HIS CA C 105 55.400 56.496 -1.096 2
1 1309 . 1 1 A 105 105 HIS CB C 105 28.800 30.544 -1.744 2
1 1310 . 1 1 A 105 105 HIS N N 105 119.000 118.591 0.409 2
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