data_15203_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15203
_Entry.PDB_ID 2JOV
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 1 A 2 2 HIS HA H 2 4.640 4.643 -0.003 1
1 4 . 1 1 1 A 2 2 HIS C C 2 173.600 174.807 -1.207 1
1 5 . 1 1 1 A 2 2 HIS CA C 2 56.500 57.371 -0.871 1
1 6 . 1 1 1 A 2 2 HIS CB C 2 31.000 31.491 -0.491 1
1 7 . 1 1 1 A 3 3 LYS H H 3 8.160 7.745 0.415 1
1 8 . 1 1 1 A 3 3 LYS HA H 3 4.660 4.708 -0.048 1
1 17 . 1 1 1 A 3 3 LYS C C 3 174.400 173.787 0.613 1
1 18 . 1 1 1 A 3 3 LYS CA C 3 54.800 54.562 0.238 1
1 19 . 1 1 1 A 3 3 LYS CB C 3 35.800 37.388 -1.588 1
1 23 . 1 1 1 A 3 3 LYS N N 3 121.900 116.384 5.516 1
1 24 . 1 1 1 A 4 4 ASP H H 4 8.470 9.190 -0.720 1
1 25 . 1 1 1 A 4 4 ASP HA H 4 4.900 5.339 -0.439 1
1 28 . 1 1 1 A 4 4 ASP C C 4 176.900 175.455 1.445 1
1 29 . 1 1 1 A 4 4 ASP CA C 4 52.700 52.745 -0.045 1
1 30 . 1 1 1 A 4 4 ASP CB C 4 44.100 44.064 0.036 1
1 31 . 1 1 1 A 4 4 ASP N N 4 117.900 122.875 -4.975 1
1 32 . 1 1 1 A 5 5 ILE H H 5 9.570 8.559 1.011 1
1 33 . 1 1 1 A 5 5 ILE HA H 5 3.640 4.124 -0.484 1
1 43 . 1 1 1 A 5 5 ILE C C 5 174.800 176.546 -1.746 1
1 44 . 1 1 1 A 5 5 ILE CA C 5 60.900 62.046 -1.146 1
1 45 . 1 1 1 A 5 5 ILE CB C 5 37.000 37.359 -0.359 1
1 49 . 1 1 1 A 5 5 ILE N N 5 124.400 124.474 -0.074 1
1 50 . 1 1 1 A 6 6 PHE H H 6 7.790 9.102 -1.312 1
1 51 . 1 1 1 A 6 6 PHE HA H 6 3.160 4.969 -1.809 1
1 58 . 1 1 1 A 6 6 PHE C C 6 173.500 174.755 -1.255 1
1 59 . 1 1 1 A 6 6 PHE CA C 6 56.900 59.903 -3.003 1
1 60 . 1 1 1 A 6 6 PHE CB C 6 40.100 39.973 0.127 1
1 65 . 1 1 1 A 6 6 PHE N N 6 130.200 128.792 1.408 1
1 66 . 1 1 1 A 7 7 THR H H 7 6.790 8.789 -1.999 1
1 67 . 1 1 1 A 7 7 THR HA H 7 4.530 5.195 -0.665 1
1 72 . 1 1 1 A 7 7 THR C C 7 172.300 173.077 -0.777 1
1 73 . 1 1 1 A 7 7 THR CA C 7 59.200 61.226 -2.026 1
1 74 . 1 1 1 A 7 7 THR CB C 7 71.000 71.357 -0.357 1
1 76 . 1 1 1 A 7 7 THR N N 7 117.900 123.728 -5.828 1
1 77 . 1 1 1 A 8 8 SER H H 8 7.600 8.697 -1.097 1
1 78 . 1 1 1 A 8 8 SER HA H 8 4.180 4.749 -0.569 1
1 81 . 1 1 1 A 8 8 SER C C 8 175.300 172.142 3.158 1
1 82 . 1 1 1 A 8 8 SER CA C 8 55.800 55.983 -0.183 1
1 83 . 1 1 1 A 8 8 SER CB C 8 64.000 64.784 -0.784 1
1 84 . 1 1 1 A 8 8 SER N N 8 113.400 120.422 -7.022 1
1 85 . 1 1 1 A 9 9 VAL H H 9 8.880 8.487 0.393 1
1 86 . 1 1 1 A 9 9 VAL HA H 9 5.220 4.557 0.663 1
1 94 . 1 1 1 A 9 9 VAL C C 9 174.000 174.429 -0.429 1
1 95 . 1 1 1 A 9 9 VAL CA C 9 59.100 61.124 -2.024 1
1 96 . 1 1 1 A 9 9 VAL CB C 9 36.500 33.529 2.971 1
1 99 . 1 1 1 A 9 9 VAL N N 9 114.700 121.940 -7.240 1
1 100 . 1 1 1 A 10 10 VAL H H 10 8.510 8.925 -0.415 1
1 101 . 1 1 1 A 10 10 VAL HA H 10 4.470 4.822 -0.352 1
1 109 . 1 1 1 A 10 10 VAL C C 10 173.700 174.915 -1.215 1
1 110 . 1 1 1 A 10 10 VAL CA C 10 59.400 59.555 -0.155 1
1 111 . 1 1 1 A 10 10 VAL CB C 10 36.000 34.592 1.408 1
1 114 . 1 1 1 A 10 10 VAL N N 10 117.100 127.337 -10.237 1
1 115 . 1 1 1 A 11 11 ARG H H 11 8.500 8.156 0.344 1
1 116 . 1 1 1 A 11 11 ARG HA H 11 4.460 4.583 -0.123 1
1 123 . 1 1 1 A 11 11 ARG C C 11 174.500 175.857 -1.357 1
1 124 . 1 1 1 A 11 11 ARG CA C 11 57.400 55.962 1.438 1
1 125 . 1 1 1 A 11 11 ARG CB C 11 31.000 30.669 0.331 1
1 128 . 1 1 1 A 11 11 ARG N N 11 124.800 126.650 -1.850 1
1 129 . 1 1 1 A 12 12 VAL H H 12 7.650 8.916 -1.266 1
1 130 . 1 1 1 A 12 12 VAL HA H 12 4.970 5.039 -0.069 1
1 138 . 1 1 1 A 12 12 VAL C C 12 176.700 174.418 2.282 1
1 139 . 1 1 1 A 12 12 VAL CA C 12 59.400 61.462 -2.062 1
1 140 . 1 1 1 A 12 12 VAL CB C 12 34.400 33.178 1.222 1
1 143 . 1 1 1 A 12 12 VAL N N 12 120.900 123.889 -2.989 1
1 144 . 1 1 1 A 13 13 ARG H H 13 9.020 9.301 -0.281 1
1 145 . 1 1 1 A 13 13 ARG HA H 13 4.700 4.855 -0.155 1
1 152 . 1 1 1 A 13 13 ARG C C 13 176.000 174.993 1.007 1
1 153 . 1 1 1 A 13 13 ARG CA C 13 54.600 55.356 -0.756 1
1 154 . 1 1 1 A 13 13 ARG CB C 13 32.900 31.101 1.799 1
1 157 . 1 1 1 A 13 13 ARG N N 13 127.500 128.966 -1.466 1
1 158 . 1 1 1 A 14 14 GLY H H 14 8.640 8.302 0.338 1
1 159 . 1 1 1 A 14 14 GLY HA2 H 14 3.680 4.212 -0.532 1
1 160 . 1 1 1 A 14 14 GLY HA3 H 14 4.190 4.222 -0.032 1
1 161 . 1 1 1 A 14 14 GLY C C 14 173.700 171.628 2.072 1
1 162 . 1 1 1 A 14 14 GLY CA C 14 45.600 45.396 0.204 1
1 163 . 1 1 1 A 14 14 GLY N N 14 108.800 113.290 -4.490 1
1 164 . 1 1 1 A 15 15 SER H H 15 8.220 8.468 -0.248 1
1 165 . 1 1 1 A 15 15 SER HA H 15 5.020 4.743 0.277 1
1 168 . 1 1 1 A 15 15 SER C C 15 175.400 174.425 0.975 1
1 169 . 1 1 1 A 15 15 SER CA C 15 55.300 57.358 -2.058 1
1 170 . 1 1 1 A 15 15 SER CB C 15 64.900 63.407 1.493 1
1 171 . 1 1 1 A 15 15 SER N N 15 113.200 115.131 -1.931 1
1 172 . 1 1 1 A 16 16 LYS H H 16 9.930 8.725 1.205 1
1 173 . 1 1 1 A 16 16 LYS HA H 16 4.190 4.553 -0.363 1
1 182 . 1 1 1 A 16 16 LYS C C 16 176.500 176.562 -0.062 1
1 183 . 1 1 1 A 16 16 LYS CA C 16 57.300 54.968 2.332 1
1 184 . 1 1 1 A 16 16 LYS CB C 16 32.300 32.559 -0.259 1
1 188 . 1 1 1 A 16 16 LYS N N 16 129.200 123.799 5.401 1
1 189 . 1 1 1 A 17 17 LYS H H 17 7.960 8.119 -0.159 1
1 190 . 1 1 1 A 17 17 LYS HA H 17 4.030 4.166 -0.136 1
1 199 . 1 1 1 A 17 17 LYS C C 17 175.600 175.692 -0.092 1
1 200 . 1 1 1 A 17 17 LYS CA C 17 56.900 58.472 -1.572 1
1 201 . 1 1 1 A 17 17 LYS CB C 17 34.700 32.062 2.638 1
1 205 . 1 1 1 A 17 17 LYS N N 17 118.500 118.642 -0.142 1
1 206 . 1 1 1 A 18 18 TYR H H 18 7.780 8.467 -0.687 1
1 207 . 1 1 1 A 18 18 TYR HA H 18 4.760 4.580 0.180 1
1 214 . 1 1 1 A 18 18 TYR C C 18 174.000 175.850 -1.850 1
1 215 . 1 1 1 A 18 18 TYR CA C 18 56.800 58.212 -1.412 1
1 216 . 1 1 1 A 18 18 TYR CB C 18 41.100 39.342 1.758 1
1 221 . 1 1 1 A 18 18 TYR N N 18 117.100 119.079 -1.979 1
1 222 . 1 1 1 A 19 19 ASN H H 19 8.890 8.915 -0.025 1
1 223 . 1 1 1 A 19 19 ASN HA H 19 4.960 5.090 -0.130 1
1 228 . 1 1 1 A 19 19 ASN C C 19 176.100 174.631 1.469 1
1 229 . 1 1 1 A 19 19 ASN CA C 19 53.600 53.245 0.355 1
1 230 . 1 1 1 A 19 19 ASN CB C 19 40.300 40.912 -0.612 1
1 231 . 1 1 1 A 19 19 ASN N N 19 116.600 116.362 0.238 1
1 233 . 1 1 1 A 20 20 VAL H H 20 7.730 7.647 0.083 1
1 234 . 1 1 1 A 20 20 VAL HA H 20 5.250 4.991 0.259 1
1 242 . 1 1 1 A 20 20 VAL C C 20 173.800 173.977 -0.177 1
1 243 . 1 1 1 A 20 20 VAL CA C 20 59.400 59.282 0.118 1
1 244 . 1 1 1 A 20 20 VAL CB C 20 37.600 35.355 2.245 1
1 247 . 1 1 1 A 20 20 VAL N N 20 113.900 114.887 -0.987 1
1 248 . 1 1 1 A 21 21 VAL H H 21 8.890 8.776 0.114 1
1 249 . 1 1 1 A 21 21 VAL HA H 21 4.840 4.715 0.125 1
1 257 . 1 1 1 A 21 21 VAL CA C 21 56.800 57.313 -0.513 1
1 258 . 1 1 1 A 21 21 VAL CB C 21 36.000 35.117 0.883 1
1 261 . 1 1 1 A 21 21 VAL N N 21 118.500 122.039 -3.539 1
1 262 . 1 1 1 A 22 22 PRO HA H 22 4.940 4.903 0.037 1
1 269 . 1 1 1 A 22 22 PRO C C 22 175.600 176.317 -0.717 1
1 270 . 1 1 1 A 22 22 PRO CA C 22 62.700 62.378 0.322 1
1 271 . 1 1 1 A 22 22 PRO CB C 22 31.800 31.910 -0.110 1
1 274 . 1 1 1 A 23 23 VAL H H 23 8.060 8.596 -0.536 1
1 275 . 1 1 1 A 23 23 VAL HA H 23 5.390 4.955 0.435 1
1 283 . 1 1 1 A 23 23 VAL C C 23 175.400 174.738 0.662 1
1 284 . 1 1 1 A 23 23 VAL CA C 23 57.800 59.112 -1.312 1
1 285 . 1 1 1 A 23 23 VAL CB C 23 36.300 34.381 1.919 1
1 288 . 1 1 1 A 23 23 VAL N N 23 110.900 116.815 -5.915 1
1 289 . 1 1 1 A 24 24 LYS H H 24 8.960 9.478 -0.518 1
1 290 . 1 1 1 A 24 24 LYS HA H 24 5.600 5.510 0.090 1
1 299 . 1 1 1 A 24 24 LYS C C 24 175.600 174.400 1.200 1
1 300 . 1 1 1 A 24 24 LYS CA C 24 54.200 54.028 0.172 1
1 301 . 1 1 1 A 24 24 LYS CB C 24 37.000 36.359 0.641 1
1 305 . 1 1 1 A 24 24 LYS N N 24 117.900 122.269 -4.369 1
1 306 . 1 1 1 A 25 25 SER H H 25 8.950 8.833 0.117 1
1 307 . 1 1 1 A 25 25 SER HA H 25 5.190 5.110 0.080 1
1 310 . 1 1 1 A 25 25 SER C C 25 173.800 175.835 -2.035 1
1 311 . 1 1 1 A 25 25 SER CA C 25 57.700 55.979 1.721 1
1 312 . 1 1 1 A 25 25 SER CB C 25 65.100 65.402 -0.302 1
1 313 . 1 1 1 A 25 25 SER N N 25 114.600 115.703 -1.103 1
1 314 . 1 1 1 A 26 26 ASN H H 26 9.020 8.685 0.335 1
1 315 . 1 1 1 A 26 26 ASN HA H 26 4.370 4.647 -0.277 1
1 320 . 1 1 1 A 26 26 ASN C C 26 173.500 175.257 -1.757 1
1 321 . 1 1 1 A 26 26 ASN CA C 26 53.700 54.527 -0.827 1
1 322 . 1 1 1 A 26 26 ASN CB C 26 37.100 38.678 -1.578 1
1 323 . 1 1 1 A 26 26 ASN N N 26 118.300 122.602 -4.302 1
1 325 . 1 1 1 A 27 27 LYS H H 27 7.400 7.449 -0.049 1
1 326 . 1 1 1 A 27 27 LYS HA H 27 4.780 4.814 -0.034 1
1 335 . 1 1 1 A 27 27 LYS CA C 27 53.500 52.865 0.635 1
1 336 . 1 1 1 A 27 27 LYS CB C 27 34.100 33.806 0.294 1
1 340 . 1 1 1 A 27 27 LYS N N 27 116.600 118.929 -2.329 1
1 341 . 1 1 1 A 28 28 PRO HA H 28 4.040 4.758 -0.718 1
1 348 . 1 1 1 A 28 28 PRO C C 28 174.500 176.192 -1.692 1
1 349 . 1 1 1 A 28 28 PRO CA C 28 63.200 62.941 0.259 1
1 350 . 1 1 1 A 28 28 PRO CB C 28 32.500 32.541 -0.041 1
1 353 . 1 1 1 A 29 29 VAL H H 29 8.860 8.931 -0.071 1
1 354 . 1 1 1 A 29 29 VAL HA H 29 4.420 4.812 -0.392 1
1 362 . 1 1 1 A 29 29 VAL C C 29 174.800 175.299 -0.499 1
1 363 . 1 1 1 A 29 29 VAL CA C 29 60.300 60.509 -0.209 1
1 364 . 1 1 1 A 29 29 VAL CB C 29 36.400 35.988 0.412 1
1 367 . 1 1 1 A 29 29 VAL N N 29 119.800 122.567 -2.767 1
1 368 . 1 1 1 A 30 30 GLU H H 30 9.550 8.682 0.868 1
1 369 . 1 1 1 A 30 30 GLU HA H 30 4.260 4.396 -0.136 1
1 374 . 1 1 1 A 30 30 GLU C C 30 177.800 176.982 0.818 1
1 375 . 1 1 1 A 30 30 GLU CA C 30 58.000 56.632 1.368 1
1 376 . 1 1 1 A 30 30 GLU CB C 30 29.700 30.469 -0.769 1
1 378 . 1 1 1 A 30 30 GLU N N 30 128.900 124.669 4.231 1
1 379 . 1 1 1 A 31 31 ILE H H 31 7.910 8.554 -0.644 1
1 380 . 1 1 1 A 31 31 ILE HA H 31 2.120 4.064 -1.944 1
1 390 . 1 1 1 A 31 31 ILE C C 31 178.000 177.555 0.445 1
1 391 . 1 1 1 A 31 31 ILE CA C 31 63.500 63.399 0.101 1
1 392 . 1 1 1 A 31 31 ILE CB C 31 37.200 37.970 -0.770 1
1 396 . 1 1 1 A 31 31 ILE N N 31 122.500 123.229 -0.729 1
1 397 . 1 1 1 A 32 32 SER H H 32 7.940 8.126 -0.186 1
1 398 . 1 1 1 A 32 32 SER HA H 32 4.070 4.247 -0.177 1
1 401 . 1 1 1 A 32 32 SER C C 32 175.800 175.958 -0.158 1
1 402 . 1 1 1 A 32 32 SER CA C 32 60.200 61.423 -1.223 1
1 403 . 1 1 1 A 32 32 SER CB C 32 62.100 62.644 -0.544 1
1 404 . 1 1 1 A 32 32 SER N N 32 115.300 116.829 -1.529 1
1 405 . 1 1 1 A 33 33 LYS H H 33 7.640 7.680 -0.040 1
1 406 . 1 1 1 A 33 33 LYS HA H 33 4.400 3.982 0.418 1
1 415 . 1 1 1 A 33 33 LYS C C 33 176.600 178.096 -1.496 1
1 416 . 1 1 1 A 33 33 LYS CA C 33 56.200 56.777 -0.577 1
1 417 . 1 1 1 A 33 33 LYS CB C 33 32.700 32.074 0.626 1
1 421 . 1 1 1 A 33 33 LYS N N 33 119.800 120.308 -0.508 1
1 422 . 1 1 1 A 34 34 TRP H H 34 7.860 7.892 -0.032 1
1 423 . 1 1 1 A 34 34 TRP HA H 34 3.870 4.557 -0.687 1
1 426 . 1 1 1 A 34 34 TRP C C 34 178.600 178.615 -0.015 1
1 427 . 1 1 1 A 34 34 TRP CA C 34 60.200 61.140 -0.940 1
1 428 . 1 1 1 A 34 34 TRP CB C 34 28.500 29.642 -1.142 1
1 429 . 1 1 1 A 34 34 TRP N N 34 120.000 122.881 -2.881 1
1 430 . 1 1 1 A 35 35 ILE H H 35 8.200 8.010 0.190 1
1 431 . 1 1 1 A 35 35 ILE HA H 35 3.990 3.386 0.604 1
1 441 . 1 1 1 A 35 35 ILE C C 35 177.900 177.584 0.316 1
1 442 . 1 1 1 A 35 35 ILE CA C 35 64.300 65.151 -0.851 1
1 443 . 1 1 1 A 35 35 ILE CB C 35 37.200 37.870 -0.670 1
1 447 . 1 1 1 A 35 35 ILE N N 35 119.500 120.455 -0.955 1
1 448 . 1 1 1 A 36 36 ASP H H 36 7.680 7.720 -0.040 1
1 449 . 1 1 1 A 36 36 ASP HA H 36 4.490 4.258 0.232 1
1 452 . 1 1 1 A 36 36 ASP C C 36 179.200 178.479 0.721 1
1 453 . 1 1 1 A 36 36 ASP CA C 36 57.500 57.238 0.262 1
1 454 . 1 1 1 A 36 36 ASP CB C 36 40.400 41.349 -0.949 1
1 455 . 1 1 1 A 36 36 ASP N N 36 122.000 120.333 1.667 1
1 456 . 1 1 1 A 37 37 PHE H H 37 8.450 8.154 0.296 1
1 457 . 1 1 1 A 37 37 PHE HA H 37 4.080 4.024 0.056 1
1 465 . 1 1 1 A 37 37 PHE C C 37 178.300 178.010 0.290 1
1 466 . 1 1 1 A 37 37 PHE CA C 37 58.600 60.264 -1.664 1
1 467 . 1 1 1 A 37 37 PHE CB C 37 37.000 37.565 -0.565 1
1 473 . 1 1 1 A 37 37 PHE N N 37 119.800 118.683 1.117 1
1 474 . 1 1 1 A 38 38 SER H H 38 8.580 7.859 0.721 1
1 475 . 1 1 1 A 38 38 SER HA H 38 4.250 4.246 0.004 1
1 478 . 1 1 1 A 38 38 SER C C 38 176.800 176.362 0.438 1
1 479 . 1 1 1 A 38 38 SER CA C 38 62.700 61.565 1.135 1
1 480 . 1 1 1 A 38 38 SER CB C 38 62.700 62.635 0.065 1
1 481 . 1 1 1 A 38 38 SER N N 38 115.800 114.583 1.217 1
1 482 . 1 1 1 A 39 39 ASN H H 39 8.190 8.247 -0.057 1
1 483 . 1 1 1 A 39 39 ASN HA H 39 4.540 4.405 0.135 1
1 488 . 1 1 1 A 39 39 ASN C C 39 178.500 178.104 0.396 1
1 489 . 1 1 1 A 39 39 ASN CA C 39 56.200 56.448 -0.248 1
1 490 . 1 1 1 A 39 39 ASN CB C 39 37.900 37.612 0.288 1
1 491 . 1 1 1 A 39 39 ASN N N 39 121.300 120.567 0.733 1
1 493 . 1 1 1 A 40 40 VAL H H 40 7.840 7.719 0.121 1
1 494 . 1 1 1 A 40 40 VAL HA H 40 3.650 3.575 0.075 1
1 502 . 1 1 1 A 40 40 VAL C C 40 179.000 178.083 0.917 1
1 503 . 1 1 1 A 40 40 VAL CA C 40 66.600 66.512 0.088 1
1 504 . 1 1 1 A 40 40 VAL CB C 40 32.100 31.619 0.481 1
1 507 . 1 1 1 A 40 40 VAL N N 40 121.800 120.209 1.591 1
1 508 . 1 1 1 A 41 41 LEU H H 41 8.210 8.206 0.004 1
1 509 . 1 1 1 A 41 41 LEU HA H 41 3.840 4.091 -0.251 1
1 519 . 1 1 1 A 41 41 LEU C C 41 178.800 178.969 -0.169 1
1 520 . 1 1 1 A 41 41 LEU CA C 41 57.400 57.163 0.237 1
1 521 . 1 1 1 A 41 41 LEU CB C 41 41.200 41.104 0.096 1
1 525 . 1 1 1 A 41 41 LEU N N 41 117.700 118.936 -1.236 1
1 526 . 1 1 1 A 42 42 SER H H 42 7.980 7.878 0.102 1
1 527 . 1 1 1 A 42 42 SER HA H 42 4.260 4.259 0.001 1
1 530 . 1 1 1 A 42 42 SER C C 42 174.900 175.387 -0.487 1
1 531 . 1 1 1 A 42 42 SER CA C 42 61.200 60.375 0.825 1
1 532 . 1 1 1 A 42 42 SER CB C 42 63.100 62.997 0.103 1
1 533 . 1 1 1 A 42 42 SER N N 42 113.200 115.262 -2.062 1
1 534 . 1 1 1 A 43 43 ARG H H 43 7.100 8.064 -0.964 1
1 535 . 1 1 1 A 43 43 ARG HA H 43 4.500 4.386 0.114 1
1 542 . 1 1 1 A 43 43 ARG C C 43 175.800 174.980 0.820 1
1 543 . 1 1 1 A 43 43 ARG CA C 43 55.600 56.296 -0.696 1
1 544 . 1 1 1 A 43 43 ARG CB C 43 30.800 30.566 0.234 1
1 547 . 1 1 1 A 43 43 ARG N N 43 118.400 115.954 2.446 1
1 548 . 1 1 1 A 44 44 LEU H H 44 7.610 7.188 0.422 1
1 549 . 1 1 1 A 44 44 LEU HA H 44 4.590 4.930 -0.340 1
1 559 . 1 1 1 A 44 44 LEU C C 44 175.300 174.306 0.994 1
1 560 . 1 1 1 A 44 44 LEU CA C 44 53.900 53.320 0.580 1
1 561 . 1 1 1 A 44 44 LEU CB C 44 44.100 45.387 -1.287 1
1 565 . 1 1 1 A 44 44 LEU N N 44 120.400 122.330 -1.930 1
1 566 . 1 1 1 A 45 45 TYR H H 45 7.630 9.225 -1.595 1
1 567 . 1 1 1 A 45 45 TYR HA H 45 5.180 5.223 -0.043 1
1 574 . 1 1 1 A 45 45 TYR C C 45 174.600 175.098 -0.498 1
1 575 . 1 1 1 A 45 45 TYR CA C 45 56.300 56.451 -0.151 1
1 576 . 1 1 1 A 45 45 TYR CB C 45 41.400 39.940 1.460 1
1 581 . 1 1 1 A 45 45 TYR N N 45 115.300 126.035 -10.735 1
1 582 . 1 1 1 A 46 46 VAL H H 46 8.770 9.016 -0.246 1
1 583 . 1 1 1 A 46 46 VAL HA H 46 4.540 4.108 0.432 1
1 591 . 1 1 1 A 46 46 VAL C C 46 174.600 177.283 -2.683 1
1 592 . 1 1 1 A 46 46 VAL CA C 46 59.600 62.009 -2.409 1
1 593 . 1 1 1 A 46 46 VAL CB C 46 34.700 31.605 3.095 1
1 596 . 1 1 1 A 46 46 VAL N N 46 115.400 126.143 -10.743 1
1 597 . 1 1 1 A 47 47 GLY H H 47 8.280 8.765 -0.485 1
1 598 . 1 1 1 A 47 47 GLY HA2 H 47 3.610 4.090 -0.480 1
1 599 . 1 1 1 A 47 47 GLY HA3 H 47 4.970 4.101 0.869 1
1 600 . 1 1 1 A 47 47 GLY C C 47 173.100 172.883 0.217 1
1 601 . 1 1 1 A 47 47 GLY CA C 47 43.600 45.977 -2.377 1
1 602 . 1 1 1 A 47 47 GLY N N 47 109.900 116.378 -6.478 1
1 603 . 1 1 1 A 48 48 VAL H H 48 7.630 7.448 0.182 1
1 604 . 1 1 1 A 48 48 VAL HA H 48 4.320 4.488 -0.168 1
1 612 . 1 1 1 A 48 48 VAL CA C 48 58.700 59.111 -0.411 1
1 613 . 1 1 1 A 48 48 VAL CB C 48 32.100 34.466 -2.366 1
1 616 . 1 1 1 A 48 48 VAL N N 48 109.900 119.415 -9.515 1
1 617 . 1 1 1 A 49 49 PRO HA H 49 4.800 4.830 -0.030 1
1 624 . 1 1 1 A 49 49 PRO C C 49 176.700 175.453 1.247 1
1 625 . 1 1 1 A 49 49 PRO CA C 49 62.300 62.373 -0.073 1
1 626 . 1 1 1 A 49 49 PRO CB C 49 35.400 31.519 3.881 1
1 629 . 1 1 1 A 50 50 THR H H 50 8.790 8.636 0.154 1
1 630 . 1 1 1 A 50 50 THR HA H 50 4.690 5.079 -0.389 1
1 635 . 1 1 1 A 50 50 THR C C 50 173.500 174.018 -0.518 1
1 636 . 1 1 1 A 50 50 THR CA C 50 60.800 59.172 1.628 1
1 637 . 1 1 1 A 50 50 THR CB C 50 70.800 71.570 -0.770 1
1 639 . 1 1 1 A 50 50 THR N N 50 113.500 116.307 -2.807 1
1 640 . 1 1 1 A 51 51 LYS H H 51 7.810 8.077 -0.267 1
1 641 . 1 1 1 A 51 51 LYS HA H 51 4.890 4.492 0.398 1
1 650 . 1 1 1 A 51 51 LYS C C 51 175.900 176.188 -0.288 1
1 651 . 1 1 1 A 51 51 LYS CA C 51 54.100 55.117 -1.017 1
1 652 . 1 1 1 A 51 51 LYS CB C 51 35.300 33.114 2.186 1
1 656 . 1 1 1 A 51 51 LYS N N 51 122.200 121.190 1.010 1
1 657 . 1 1 1 A 52 52 SER H H 52 8.410 8.532 -0.122 1
1 658 . 1 1 1 A 52 52 SER HA H 52 3.630 4.314 -0.684 1
1 661 . 1 1 1 A 52 52 SER C C 52 175.800 175.086 0.714 1
1 662 . 1 1 1 A 52 52 SER CA C 52 58.800 59.447 -0.647 1
1 663 . 1 1 1 A 52 52 SER CB C 52 62.600 63.038 -0.438 1
1 664 . 1 1 1 A 52 52 SER N N 52 118.900 114.750 4.150 1
1 665 . 1 1 1 A 53 53 GLY H H 53 9.070 9.012 0.058 1
1 666 . 1 1 1 A 53 53 GLY HA2 H 53 3.390 3.853 -0.463 1
1 667 . 1 1 1 A 53 53 GLY HA3 H 53 4.460 3.855 0.605 1
1 668 . 1 1 1 A 53 53 GLY C C 53 174.100 174.223 -0.123 1
1 669 . 1 1 1 A 53 53 GLY CA C 53 44.800 46.137 -1.337 1
1 670 . 1 1 1 A 53 53 GLY N N 53 115.600 112.934 2.666 1
1 671 . 1 1 1 A 54 54 ASN H H 54 7.870 7.806 0.064 1
1 672 . 1 1 1 A 54 54 ASN HA H 54 4.570 4.884 -0.314 1
1 677 . 1 1 1 A 54 54 ASN C C 54 175.500 174.386 1.114 1
1 678 . 1 1 1 A 54 54 ASN CA C 54 53.000 52.094 0.906 1
1 679 . 1 1 1 A 54 54 ASN CB C 54 38.600 39.422 -0.822 1
1 680 . 1 1 1 A 54 54 ASN N N 54 119.600 118.547 1.053 1
1 682 . 1 1 1 A 55 55 VAL H H 55 8.770 8.899 -0.129 1
1 683 . 1 1 1 A 55 55 VAL HA H 55 3.880 4.159 -0.279 1
1 691 . 1 1 1 A 55 55 VAL C C 55 176.200 175.294 0.906 1
1 692 . 1 1 1 A 55 55 VAL CA C 55 63.700 63.216 0.484 1
1 693 . 1 1 1 A 55 55 VAL CB C 55 31.600 31.194 0.406 1
1 696 . 1 1 1 A 55 55 VAL N N 55 123.900 123.748 0.152 1
1 697 . 1 1 1 A 56 56 VAL H H 56 9.050 8.967 0.083 1
1 698 . 1 1 1 A 56 56 VAL HA H 56 3.990 3.965 0.025 1
1 706 . 1 1 1 A 56 56 VAL C C 56 175.200 175.708 -0.508 1
1 707 . 1 1 1 A 56 56 VAL CA C 56 62.700 64.379 -1.679 1
1 708 . 1 1 1 A 56 56 VAL CB C 56 32.900 32.477 0.423 1
1 711 . 1 1 1 A 56 56 VAL N N 56 127.500 128.323 -0.823 1
1 712 . 1 1 1 A 57 57 CYS H H 57 7.250 7.891 -0.641 1
1 713 . 1 1 1 A 57 57 CYS HA H 57 4.370 5.020 -0.650 1
1 716 . 1 1 1 A 57 57 CYS C C 57 171.900 172.611 -0.711 1
1 717 . 1 1 1 A 57 57 CYS CA C 57 58.600 57.407 1.193 1
1 718 . 1 1 1 A 57 57 CYS CB C 57 28.600 29.872 -1.272 1
1 719 . 1 1 1 A 57 57 CYS N N 57 117.600 117.399 0.201 1
1 720 . 1 1 1 A 58 58 LYS H H 58 8.880 8.618 0.262 1
1 721 . 1 1 1 A 58 58 LYS HA H 58 4.220 4.429 -0.209 1
1 730 . 1 1 1 A 58 58 LYS C C 58 176.000 176.548 -0.548 1
1 731 . 1 1 1 A 58 58 LYS CA C 58 54.400 55.674 -1.274 1
1 732 . 1 1 1 A 58 58 LYS CB C 58 33.600 33.868 -0.268 1
1 736 . 1 1 1 A 58 58 LYS N N 58 132.000 126.891 5.109 1
1 737 . 1 1 1 A 59 59 ASN H H 59 9.500 9.209 0.291 1
1 738 . 1 1 1 A 59 59 ASN HA H 59 4.040 4.178 -0.138 1
1 743 . 1 1 1 A 59 59 ASN C C 59 176.400 174.064 2.336 1
1 744 . 1 1 1 A 59 59 ASN CA C 59 53.200 54.049 -0.849 1
1 745 . 1 1 1 A 59 59 ASN CB C 59 35.900 36.839 -0.939 1
1 746 . 1 1 1 A 59 59 ASN N N 59 127.500 119.480 8.020 1
1 748 . 1 1 1 A 60 60 ILE H H 60 8.050 7.681 0.369 1
1 749 . 1 1 1 A 60 60 ILE HA H 60 3.680 3.675 0.005 1
1 759 . 1 1 1 A 60 60 ILE C C 60 175.700 176.615 -0.915 1
1 760 . 1 1 1 A 60 60 ILE CA C 60 61.900 61.913 -0.013 1
1 761 . 1 1 1 A 60 60 ILE CB C 60 38.300 37.435 0.865 1
1 765 . 1 1 1 A 60 60 ILE N N 60 120.200 118.978 1.222 1
1 766 . 1 1 1 A 61 61 MET H H 61 9.590 9.339 0.251 1
1 767 . 1 1 1 A 61 61 MET HA H 61 3.920 4.182 -0.262 1
1 775 . 1 1 1 A 61 61 MET C C 61 174.300 176.009 -1.709 1
1 776 . 1 1 1 A 61 61 MET CA C 61 57.000 56.718 0.282 1
1 777 . 1 1 1 A 61 61 MET CB C 61 31.300 31.292 0.008 1
1 780 . 1 1 1 A 61 61 MET N N 61 124.400 126.001 -1.601 1
1 781 . 1 1 1 A 62 62 ASN H H 62 8.250 8.369 -0.119 1
1 782 . 1 1 1 A 62 62 ASN HA H 62 4.400 4.431 -0.031 1
1 787 . 1 1 1 A 62 62 ASN C C 62 176.800 176.228 0.572 1
1 788 . 1 1 1 A 62 62 ASN CA C 62 54.400 53.914 0.486 1
1 789 . 1 1 1 A 62 62 ASN CB C 62 37.600 36.799 0.801 1
1 790 . 1 1 1 A 62 62 ASN N N 62 111.900 117.009 -5.109 1
1 792 . 1 1 1 A 63 63 THR H H 63 7.480 8.129 -0.649 1
1 793 . 1 1 1 A 63 63 THR HA H 63 4.210 4.635 -0.425 1
1 798 . 1 1 1 A 63 63 THR C C 63 177.100 176.103 0.997 1
1 799 . 1 1 1 A 63 63 THR CA C 63 62.900 62.176 0.724 1
1 800 . 1 1 1 A 63 63 THR CB C 63 72.500 71.272 1.228 1
1 802 . 1 1 1 A 63 63 THR N N 63 105.900 112.903 -7.003 1
1 803 . 1 1 1 A 64 64 GLY H H 64 9.110 8.203 0.907 1
1 804 . 1 1 1 A 64 64 GLY HA2 H 64 3.580 3.974 -0.394 1
1 805 . 1 1 1 A 64 64 GLY HA3 H 64 4.090 3.986 0.104 1
1 806 . 1 1 1 A 64 64 GLY C C 64 173.200 173.981 -0.781 1
1 807 . 1 1 1 A 64 64 GLY CA C 64 45.300 45.040 0.260 1
1 808 . 1 1 1 A 64 64 GLY N N 64 111.500 111.272 0.228 1
1 809 . 1 1 1 A 65 65 VAL H H 65 7.580 7.179 0.401 1
1 810 . 1 1 1 A 65 65 VAL HA H 65 4.060 4.471 -0.411 1
1 818 . 1 1 1 A 65 65 VAL C C 65 172.900 173.879 -0.979 1
1 819 . 1 1 1 A 65 65 VAL CA C 65 61.400 59.972 1.428 1
1 820 . 1 1 1 A 65 65 VAL CB C 65 32.900 34.290 -1.390 1
1 823 . 1 1 1 A 65 65 VAL N N 65 121.600 121.038 0.562 1
1 824 . 1 1 1 A 66 66 ASP H H 66 8.210 8.921 -0.711 1
1 825 . 1 1 1 A 66 66 ASP HA H 66 5.320 5.314 0.006 1
1 828 . 1 1 1 A 66 66 ASP C C 66 174.800 174.896 -0.096 1
1 829 . 1 1 1 A 66 66 ASP CA C 66 51.700 52.622 -0.922 1
1 830 . 1 1 1 A 66 66 ASP CB C 66 43.200 43.960 -0.760 1
1 831 . 1 1 1 A 66 66 ASP N N 66 123.100 126.260 -3.160 1
1 832 . 1 1 1 A 67 67 ILE H H 67 8.540 8.690 -0.150 1
1 833 . 1 1 1 A 67 67 ILE HA H 67 4.630 4.830 -0.200 1
1 843 . 1 1 1 A 67 67 ILE C C 67 175.600 175.387 0.213 1
1 844 . 1 1 1 A 67 67 ILE CA C 67 56.900 60.244 -3.344 1
1 845 . 1 1 1 A 67 67 ILE CB C 67 35.300 39.385 -4.085 1
1 849 . 1 1 1 A 67 67 ILE N N 67 119.200 123.082 -3.882 1
1 850 . 1 1 1 A 68 68 ILE H H 68 9.420 9.471 -0.051 1
1 851 . 1 1 1 A 68 68 ILE HA H 68 4.980 5.500 -0.520 1
1 861 . 1 1 1 A 68 68 ILE C C 68 175.000 174.309 0.691 1
1 862 . 1 1 1 A 68 68 ILE CA C 68 58.600 59.002 -0.402 1
1 863 . 1 1 1 A 68 68 ILE CB C 68 40.900 41.038 -0.138 1
1 867 . 1 1 1 A 68 68 ILE N N 68 125.000 122.876 2.124 1
1 868 . 1 1 1 A 69 69 CYS H H 69 8.870 8.880 -0.010 1
1 869 . 1 1 1 A 69 69 CYS HA H 69 4.610 4.620 -0.010 1
1 872 . 1 1 1 A 69 69 CYS C C 69 176.200 174.894 1.306 1
1 873 . 1 1 1 A 69 69 CYS CA C 69 58.900 59.046 -0.146 1
1 874 . 1 1 1 A 69 69 CYS CB C 69 27.100 27.344 -0.244 1
1 875 . 1 1 1 A 69 69 CYS N N 69 122.300 124.093 -1.793 1
1 876 . 1 1 1 A 70 70 THR H H 70 8.270 8.457 -0.187 1
1 877 . 1 1 1 A 70 70 THR HA H 70 4.710 4.534 0.176 1
1 882 . 1 1 1 A 70 70 THR C C 70 173.600 174.002 -0.402 1
1 883 . 1 1 1 A 70 70 THR CA C 70 61.500 62.048 -0.548 1
1 884 . 1 1 1 A 70 70 THR CB C 70 68.100 69.417 -1.317 1
1 886 . 1 1 1 A 70 70 THR N N 70 116.700 119.491 -2.791 1
1 887 . 1 1 1 A 71 71 LYS H H 71 7.370 7.509 -0.139 1
1 888 . 1 1 1 A 71 71 LYS HA H 71 4.520 4.676 -0.156 1
1 897 . 1 1 1 A 71 71 LYS CA C 71 55.100 55.038 0.062 1
1 898 . 1 1 1 A 71 71 LYS CB C 71 37.800 34.209 3.591 1
1 902 . 1 1 1 A 71 71 LYS N N 71 120.900 122.772 -1.872 1
1 903 . 1 1 1 A 72 72 ASN H H 72 8.580 8.629 -0.049 1
1 904 . 1 1 1 A 72 72 ASN HA H 72 4.620 5.187 -0.567 1
1 909 . 1 1 1 A 72 72 ASN C C 72 173.500 174.510 -1.010 1
1 910 . 1 1 1 A 72 72 ASN CA C 72 52.200 52.922 -0.722 1
1 911 . 1 1 1 A 72 72 ASN CB C 72 38.500 39.545 -1.045 1
1 912 . 1 1 1 A 72 72 ASN N N 72 122.700 123.645 -0.945 1
1 914 . 1 1 1 A 73 73 LEU H H 73 8.100 9.349 -1.249 1
1 915 . 1 1 1 A 73 73 LEU HA H 73 4.680 4.858 -0.178 1
1 925 . 1 1 1 A 73 73 LEU CA C 73 51.000 51.251 -0.251 1
1 926 . 1 1 1 A 73 73 LEU CB C 73 42.500 42.674 -0.174 1
1 930 . 1 1 1 A 73 73 LEU N N 73 125.100 126.618 -1.518 1
1 931 . 1 1 1 A 74 74 PRO HA H 74 4.670 4.859 -0.189 1
1 938 . 1 1 1 A 74 74 PRO C C 74 176.500 177.278 -0.778 1
1 939 . 1 1 1 A 74 74 PRO CA C 74 61.800 62.155 -0.355 1
1 940 . 1 1 1 A 74 74 PRO CB C 74 32.800 30.277 2.523 1
1 943 . 1 1 1 A 75 75 LYS H H 75 8.280 8.832 -0.552 1
1 944 . 1 1 1 A 75 75 LYS HA H 75 4.110 4.107 0.003 1
1 953 . 1 1 1 A 75 75 LYS CA C 75 56.500 59.453 -2.953 1
1 954 . 1 1 1 A 75 75 LYS CB C 75 33.300 33.019 0.281 1
1 958 . 1 1 1 A 75 75 LYS N N 75 117.000 125.229 -8.229 1
1 959 . 1 1 1 A 76 76 ASP H H 76 8.570 8.287 0.283 1
1 960 . 1 1 1 A 76 76 ASP HA H 76 4.530 4.965 -0.435 1
1 963 . 1 1 1 A 76 76 ASP C C 76 176.300 175.199 1.101 1
1 964 . 1 1 1 A 76 76 ASP CA C 76 55.000 53.498 1.502 1
1 965 . 1 1 1 A 76 76 ASP CB C 76 41.100 41.711 -0.611 1
1 966 . 1 1 1 A 76 76 ASP N N 76 122.700 118.240 4.460 1
1 967 . 1 1 1 A 77 77 SER H H 77 8.330 9.031 -0.701 1
1 968 . 1 1 1 A 77 77 SER HA H 77 4.410 4.673 -0.263 1
1 971 . 1 1 1 A 77 77 SER C C 77 174.300 173.180 1.120 1
1 972 . 1 1 1 A 77 77 SER CA C 77 58.000 58.205 -0.205 1
1 973 . 1 1 1 A 77 77 SER CB C 77 63.900 61.456 2.444 1
1 974 . 1 1 1 A 77 77 SER N N 77 116.100 122.065 -5.965 1
1 975 . 1 1 1 A 78 78 LEU H H 78 8.350 8.489 -0.139 1
1 976 . 1 1 1 A 78 78 LEU HA H 78 4.280 4.778 -0.498 1
1 986 . 1 1 1 A 78 78 LEU C C 78 177.200 174.858 2.342 1
1 987 . 1 1 1 A 78 78 LEU CA C 78 55.200 54.060 1.140 1
1 988 . 1 1 1 A 78 78 LEU CB C 78 42.100 41.431 0.669 1
1 992 . 1 1 1 A 78 78 LEU N N 78 124.300 127.328 -3.028 1
1 993 . 1 1 1 A 79 79 GLU H H 79 8.300 8.966 -0.666 1
1 994 . 1 1 1 A 79 79 GLU CA C 79 56.400 54.572 1.828 1
1 995 . 1 1 1 A 79 79 GLU CB C 79 30.200 31.183 -0.983 1
1 1 . 2 1 1 A 2 2 HIS HA H 2 4.640 4.940 -0.300 1
1 4 . 2 1 1 A 2 2 HIS C C 2 173.600 173.089 0.511 1
1 5 . 2 1 1 A 2 2 HIS CA C 2 56.500 54.981 1.519 1
1 6 . 2 1 1 A 2 2 HIS CB C 2 31.000 33.209 -2.209 1
1 7 . 2 1 1 A 3 3 LYS H H 3 8.160 8.402 -0.242 1
1 8 . 2 1 1 A 3 3 LYS HA H 3 4.660 5.011 -0.351 1
1 17 . 2 1 1 A 3 3 LYS C C 3 174.400 175.031 -0.631 1
1 18 . 2 1 1 A 3 3 LYS CA C 3 54.800 54.534 0.266 1
1 19 . 2 1 1 A 3 3 LYS CB C 3 35.800 35.388 0.412 1
1 23 . 2 1 1 A 3 3 LYS N N 3 121.900 126.250 -4.350 1
1 24 . 2 1 1 A 4 4 ASP H H 4 8.470 9.146 -0.676 1
1 25 . 2 1 1 A 4 4 ASP HA H 4 4.900 5.211 -0.311 1
1 28 . 2 1 1 A 4 4 ASP C C 4 176.900 175.662 1.238 1
1 29 . 2 1 1 A 4 4 ASP CA C 4 52.700 52.508 0.192 1
1 30 . 2 1 1 A 4 4 ASP CB C 4 44.100 45.044 -0.944 1
1 31 . 2 1 1 A 4 4 ASP N N 4 117.900 121.611 -3.711 1
1 32 . 2 1 1 A 5 5 ILE H H 5 9.570 8.578 0.992 1
1 33 . 2 1 1 A 5 5 ILE HA H 5 3.640 4.078 -0.438 1
1 43 . 2 1 1 A 5 5 ILE C C 5 174.800 176.171 -1.371 1
1 44 . 2 1 1 A 5 5 ILE CA C 5 60.900 62.287 -1.387 1
1 45 . 2 1 1 A 5 5 ILE CB C 5 37.000 37.226 -0.226 1
1 49 . 2 1 1 A 5 5 ILE N N 5 124.400 122.391 2.009 1
1 50 . 2 1 1 A 6 6 PHE H H 6 7.790 8.982 -1.192 1
1 51 . 2 1 1 A 6 6 PHE HA H 6 3.160 4.647 -1.487 1
1 58 . 2 1 1 A 6 6 PHE C C 6 173.500 174.648 -1.148 1
1 59 . 2 1 1 A 6 6 PHE CA C 6 56.900 58.007 -1.107 1
1 60 . 2 1 1 A 6 6 PHE CB C 6 40.100 39.044 1.056 1
1 65 . 2 1 1 A 6 6 PHE N N 6 130.200 128.879 1.321 1
1 66 . 2 1 1 A 7 7 THR H H 7 6.790 8.667 -1.877 1
1 67 . 2 1 1 A 7 7 THR HA H 7 4.530 5.130 -0.600 1
1 72 . 2 1 1 A 7 7 THR C C 7 172.300 172.944 -0.644 1
1 73 . 2 1 1 A 7 7 THR CA C 7 59.200 61.111 -1.911 1
1 74 . 2 1 1 A 7 7 THR CB C 7 71.000 70.613 0.387 1
1 76 . 2 1 1 A 7 7 THR N N 7 117.900 123.694 -5.794 1
1 77 . 2 1 1 A 8 8 SER H H 8 7.600 8.540 -0.940 1
1 78 . 2 1 1 A 8 8 SER HA H 8 4.180 4.801 -0.621 1
1 81 . 2 1 1 A 8 8 SER C C 8 175.300 172.164 3.136 1
1 82 . 2 1 1 A 8 8 SER CA C 8 55.800 57.429 -1.629 1
1 83 . 2 1 1 A 8 8 SER CB C 8 64.000 67.405 -3.405 1
1 84 . 2 1 1 A 8 8 SER N N 8 113.400 118.986 -5.586 1
1 85 . 2 1 1 A 9 9 VAL H H 9 8.880 8.482 0.398 1
1 86 . 2 1 1 A 9 9 VAL HA H 9 5.220 4.789 0.431 1
1 94 . 2 1 1 A 9 9 VAL C C 9 174.000 175.501 -1.501 1
1 95 . 2 1 1 A 9 9 VAL CA C 9 59.100 60.985 -1.885 1
1 96 . 2 1 1 A 9 9 VAL CB C 9 36.500 33.811 2.689 1
1 99 . 2 1 1 A 9 9 VAL N N 9 114.700 120.921 -6.221 1
1 100 . 2 1 1 A 10 10 VAL H H 10 8.510 8.859 -0.349 1
1 101 . 2 1 1 A 10 10 VAL HA H 10 4.470 4.818 -0.348 1
1 109 . 2 1 1 A 10 10 VAL C C 10 173.700 174.550 -0.850 1
1 110 . 2 1 1 A 10 10 VAL CA C 10 59.400 59.438 -0.038 1
1 111 . 2 1 1 A 10 10 VAL CB C 10 36.000 33.996 2.004 1
1 114 . 2 1 1 A 10 10 VAL N N 10 117.100 122.526 -5.426 1
1 115 . 2 1 1 A 11 11 ARG H H 11 8.500 8.150 0.350 1
1 116 . 2 1 1 A 11 11 ARG HA H 11 4.460 4.870 -0.410 1
1 123 . 2 1 1 A 11 11 ARG C C 11 174.500 174.868 -0.368 1
1 124 . 2 1 1 A 11 11 ARG CA C 11 57.400 55.671 1.729 1
1 125 . 2 1 1 A 11 11 ARG CB C 11 31.000 30.930 0.070 1
1 128 . 2 1 1 A 11 11 ARG N N 11 124.800 122.039 2.761 1
1 129 . 2 1 1 A 12 12 VAL H H 12 7.650 9.313 -1.663 1
1 130 . 2 1 1 A 12 12 VAL HA H 12 4.970 4.598 0.372 1
1 138 . 2 1 1 A 12 12 VAL C C 12 176.700 175.294 1.406 1
1 139 . 2 1 1 A 12 12 VAL CA C 12 59.400 61.008 -1.608 1
1 140 . 2 1 1 A 12 12 VAL CB C 12 34.400 34.035 0.365 1
1 143 . 2 1 1 A 12 12 VAL N N 12 120.900 124.976 -4.076 1
1 144 . 2 1 1 A 13 13 ARG H H 13 9.020 8.895 0.125 1
1 145 . 2 1 1 A 13 13 ARG HA H 13 4.700 4.809 -0.109 1
1 152 . 2 1 1 A 13 13 ARG C C 13 176.000 175.777 0.223 1
1 153 . 2 1 1 A 13 13 ARG CA C 13 54.600 55.133 -0.533 1
1 154 . 2 1 1 A 13 13 ARG CB C 13 32.900 32.438 0.462 1
1 157 . 2 1 1 A 13 13 ARG N N 13 127.500 126.163 1.337 1
1 158 . 2 1 1 A 14 14 GLY H H 14 8.640 8.462 0.178 1
1 159 . 2 1 1 A 14 14 GLY HA2 H 14 3.680 4.212 -0.532 1
1 160 . 2 1 1 A 14 14 GLY HA3 H 14 4.190 4.217 -0.027 1
1 161 . 2 1 1 A 14 14 GLY C C 14 173.700 173.889 -0.189 1
1 162 . 2 1 1 A 14 14 GLY CA C 14 45.600 44.310 1.290 1
1 163 . 2 1 1 A 14 14 GLY N N 14 108.800 109.227 -0.427 1
1 164 . 2 1 1 A 15 15 SER H H 15 8.220 8.633 -0.413 1
1 165 . 2 1 1 A 15 15 SER HA H 15 5.020 4.444 0.576 1
1 168 . 2 1 1 A 15 15 SER C C 15 175.400 174.670 0.730 1
1 169 . 2 1 1 A 15 15 SER CA C 15 55.300 57.950 -2.650 1
1 170 . 2 1 1 A 15 15 SER CB C 15 64.900 62.596 2.304 1
1 171 . 2 1 1 A 15 15 SER N N 15 113.200 115.397 -2.197 1
1 172 . 2 1 1 A 16 16 LYS H H 16 9.930 8.015 1.915 1
1 173 . 2 1 1 A 16 16 LYS HA H 16 4.190 4.623 -0.433 1
1 182 . 2 1 1 A 16 16 LYS C C 16 176.500 177.311 -0.811 1
1 183 . 2 1 1 A 16 16 LYS CA C 16 57.300 55.505 1.795 1
1 184 . 2 1 1 A 16 16 LYS CB C 16 32.300 31.372 0.928 1
1 188 . 2 1 1 A 16 16 LYS N N 16 129.200 120.268 8.932 1
1 189 . 2 1 1 A 17 17 LYS H H 17 7.960 8.067 -0.107 1
1 190 . 2 1 1 A 17 17 LYS HA H 17 4.030 4.096 -0.066 1
1 199 . 2 1 1 A 17 17 LYS C C 17 175.600 175.602 -0.002 1
1 200 . 2 1 1 A 17 17 LYS CA C 17 56.900 58.340 -1.440 1
1 201 . 2 1 1 A 17 17 LYS CB C 17 34.700 32.059 2.641 1
1 205 . 2 1 1 A 17 17 LYS N N 17 118.500 118.728 -0.228 1
1 206 . 2 1 1 A 18 18 TYR H H 18 7.780 8.577 -0.797 1
1 207 . 2 1 1 A 18 18 TYR HA H 18 4.760 4.642 0.118 1
1 214 . 2 1 1 A 18 18 TYR C C 18 174.000 175.279 -1.279 1
1 215 . 2 1 1 A 18 18 TYR CA C 18 56.800 58.131 -1.331 1
1 216 . 2 1 1 A 18 18 TYR CB C 18 41.100 39.279 1.821 1
1 221 . 2 1 1 A 18 18 TYR N N 18 117.100 119.888 -2.788 1
1 222 . 2 1 1 A 19 19 ASN H H 19 8.890 9.179 -0.289 1
1 223 . 2 1 1 A 19 19 ASN HA H 19 4.960 5.208 -0.248 1
1 228 . 2 1 1 A 19 19 ASN C C 19 176.100 174.317 1.783 1
1 229 . 2 1 1 A 19 19 ASN CA C 19 53.600 52.965 0.635 1
1 230 . 2 1 1 A 19 19 ASN CB C 19 40.300 40.137 0.163 1
1 231 . 2 1 1 A 19 19 ASN N N 19 116.600 118.164 -1.564 1
1 233 . 2 1 1 A 20 20 VAL H H 20 7.730 7.722 0.008 1
1 234 . 2 1 1 A 20 20 VAL HA H 20 5.250 5.227 0.023 1
1 242 . 2 1 1 A 20 20 VAL C C 20 173.800 173.851 -0.051 1
1 243 . 2 1 1 A 20 20 VAL CA C 20 59.400 59.266 0.134 1
1 244 . 2 1 1 A 20 20 VAL CB C 20 37.600 35.971 1.629 1
1 247 . 2 1 1 A 20 20 VAL N N 20 113.900 116.337 -2.437 1
1 248 . 2 1 1 A 21 21 VAL H H 21 8.890 8.764 0.126 1
1 249 . 2 1 1 A 21 21 VAL HA H 21 4.840 4.690 0.150 1
1 257 . 2 1 1 A 21 21 VAL CA C 21 56.800 57.357 -0.557 1
1 258 . 2 1 1 A 21 21 VAL CB C 21 36.000 35.476 0.524 1
1 261 . 2 1 1 A 21 21 VAL N N 21 118.500 121.921 -3.421 1
1 262 . 2 1 1 A 22 22 PRO HA H 22 4.940 4.882 0.058 1
1 269 . 2 1 1 A 22 22 PRO C C 22 175.600 176.692 -1.092 1
1 270 . 2 1 1 A 22 22 PRO CA C 22 62.700 62.552 0.148 1
1 271 . 2 1 1 A 22 22 PRO CB C 22 31.800 31.829 -0.029 1
1 274 . 2 1 1 A 23 23 VAL H H 23 8.060 8.775 -0.715 1
1 275 . 2 1 1 A 23 23 VAL HA H 23 5.390 4.836 0.554 1
1 283 . 2 1 1 A 23 23 VAL C C 23 175.400 175.093 0.307 1
1 284 . 2 1 1 A 23 23 VAL CA C 23 57.800 59.273 -1.473 1
1 285 . 2 1 1 A 23 23 VAL CB C 23 36.300 33.861 2.439 1
1 288 . 2 1 1 A 23 23 VAL N N 23 110.900 116.854 -5.954 1
1 289 . 2 1 1 A 24 24 LYS H H 24 8.960 9.411 -0.451 1
1 290 . 2 1 1 A 24 24 LYS HA H 24 5.600 5.107 0.493 1
1 299 . 2 1 1 A 24 24 LYS C C 24 175.600 174.977 0.623 1
1 300 . 2 1 1 A 24 24 LYS CA C 24 54.200 54.238 -0.038 1
1 301 . 2 1 1 A 24 24 LYS CB C 24 37.000 36.306 0.694 1
1 305 . 2 1 1 A 24 24 LYS N N 24 117.900 121.853 -3.953 1
1 306 . 2 1 1 A 25 25 SER H H 25 8.950 8.880 0.070 1
1 307 . 2 1 1 A 25 25 SER HA H 25 5.190 4.989 0.201 1
1 310 . 2 1 1 A 25 25 SER C C 25 173.800 175.267 -1.467 1
1 311 . 2 1 1 A 25 25 SER CA C 25 57.700 58.162 -0.462 1
1 312 . 2 1 1 A 25 25 SER CB C 25 65.100 65.001 0.099 1
1 313 . 2 1 1 A 25 25 SER N N 25 114.600 118.224 -3.624 1
1 314 . 2 1 1 A 26 26 ASN H H 26 9.020 8.549 0.471 1
1 315 . 2 1 1 A 26 26 ASN HA H 26 4.370 4.652 -0.282 1
1 320 . 2 1 1 A 26 26 ASN C C 26 173.500 175.109 -1.609 1
1 321 . 2 1 1 A 26 26 ASN CA C 26 53.700 54.268 -0.568 1
1 322 . 2 1 1 A 26 26 ASN CB C 26 37.100 38.119 -1.019 1
1 323 . 2 1 1 A 26 26 ASN N N 26 118.300 121.964 -3.664 1
1 325 . 2 1 1 A 27 27 LYS H H 27 7.400 7.727 -0.327 1
1 326 . 2 1 1 A 27 27 LYS HA H 27 4.780 4.714 0.066 1
1 335 . 2 1 1 A 27 27 LYS CA C 27 53.500 52.752 0.748 1
1 336 . 2 1 1 A 27 27 LYS CB C 27 34.100 33.968 0.132 1
1 340 . 2 1 1 A 27 27 LYS N N 27 116.600 120.234 -3.634 1
1 341 . 2 1 1 A 28 28 PRO HA H 28 4.040 4.690 -0.650 1
1 348 . 2 1 1 A 28 28 PRO C C 28 174.500 176.141 -1.641 1
1 349 . 2 1 1 A 28 28 PRO CA C 28 63.200 62.913 0.287 1
1 350 . 2 1 1 A 28 28 PRO CB C 28 32.500 31.792 0.708 1
1 353 . 2 1 1 A 29 29 VAL H H 29 8.860 8.965 -0.105 1
1 354 . 2 1 1 A 29 29 VAL HA H 29 4.420 4.426 -0.006 1
1 362 . 2 1 1 A 29 29 VAL C C 29 174.800 175.803 -1.003 1
1 363 . 2 1 1 A 29 29 VAL CA C 29 60.300 61.061 -0.761 1
1 364 . 2 1 1 A 29 29 VAL CB C 29 36.400 33.494 2.906 1
1 367 . 2 1 1 A 29 29 VAL N N 29 119.800 124.130 -4.330 1
1 368 . 2 1 1 A 30 30 GLU H H 30 9.550 8.602 0.948 1
1 369 . 2 1 1 A 30 30 GLU HA H 30 4.260 4.237 0.023 1
1 374 . 2 1 1 A 30 30 GLU C C 30 177.800 178.148 -0.348 1
1 375 . 2 1 1 A 30 30 GLU CA C 30 58.000 56.854 1.146 1
1 376 . 2 1 1 A 30 30 GLU CB C 30 29.700 29.871 -0.171 1
1 378 . 2 1 1 A 30 30 GLU N N 30 128.900 123.975 4.925 1
1 379 . 2 1 1 A 31 31 ILE H H 31 7.910 8.510 -0.600 1
1 380 . 2 1 1 A 31 31 ILE HA H 31 2.120 3.846 -1.726 1
1 390 . 2 1 1 A 31 31 ILE C C 31 178.000 177.426 0.574 1
1 391 . 2 1 1 A 31 31 ILE CA C 31 63.500 63.608 -0.108 1
1 392 . 2 1 1 A 31 31 ILE CB C 31 37.200 37.590 -0.390 1
1 396 . 2 1 1 A 31 31 ILE N N 31 122.500 125.665 -3.165 1
1 397 . 2 1 1 A 32 32 SER H H 32 7.940 8.276 -0.336 1
1 398 . 2 1 1 A 32 32 SER HA H 32 4.070 4.458 -0.388 1
1 401 . 2 1 1 A 32 32 SER C C 32 175.800 175.069 0.731 1
1 402 . 2 1 1 A 32 32 SER CA C 32 60.200 61.406 -1.206 1
1 403 . 2 1 1 A 32 32 SER CB C 32 62.100 63.096 -0.996 1
1 404 . 2 1 1 A 32 32 SER N N 32 115.300 118.095 -2.795 1
1 405 . 2 1 1 A 33 33 LYS H H 33 7.640 7.993 -0.353 1
1 406 . 2 1 1 A 33 33 LYS HA H 33 4.400 4.299 0.101 1
1 415 . 2 1 1 A 33 33 LYS C C 33 176.600 177.500 -0.900 1
1 416 . 2 1 1 A 33 33 LYS CA C 33 56.200 56.314 -0.114 1
1 417 . 2 1 1 A 33 33 LYS CB C 33 32.700 32.589 0.111 1
1 421 . 2 1 1 A 33 33 LYS N N 33 119.800 119.862 -0.062 1
1 422 . 2 1 1 A 34 34 TRP H H 34 7.860 7.998 -0.138 1
1 423 . 2 1 1 A 34 34 TRP HA H 34 3.870 4.245 -0.375 1
1 426 . 2 1 1 A 34 34 TRP C C 34 178.600 177.807 0.793 1
1 427 . 2 1 1 A 34 34 TRP CA C 34 60.200 60.012 0.188 1
1 428 . 2 1 1 A 34 34 TRP CB C 34 28.500 28.264 0.236 1
1 429 . 2 1 1 A 34 34 TRP N N 34 120.000 119.882 0.118 1
1 430 . 2 1 1 A 35 35 ILE H H 35 8.200 7.218 0.982 1
1 431 . 2 1 1 A 35 35 ILE HA H 35 3.990 3.126 0.864 1
1 441 . 2 1 1 A 35 35 ILE C C 35 177.900 177.514 0.386 1
1 442 . 2 1 1 A 35 35 ILE CA C 35 64.300 64.000 0.300 1
1 443 . 2 1 1 A 35 35 ILE CB C 35 37.200 37.085 0.115 1
1 447 . 2 1 1 A 35 35 ILE N N 35 119.500 117.034 2.466 1
1 448 . 2 1 1 A 36 36 ASP H H 36 7.680 8.029 -0.349 1
1 449 . 2 1 1 A 36 36 ASP HA H 36 4.490 4.260 0.230 1
1 452 . 2 1 1 A 36 36 ASP C C 36 179.200 178.468 0.732 1
1 453 . 2 1 1 A 36 36 ASP CA C 36 57.500 57.327 0.173 1
1 454 . 2 1 1 A 36 36 ASP CB C 36 40.400 41.560 -1.160 1
1 455 . 2 1 1 A 36 36 ASP N N 36 122.000 121.730 0.270 1
1 456 . 2 1 1 A 37 37 PHE H H 37 8.450 8.030 0.420 1
1 457 . 2 1 1 A 37 37 PHE HA H 37 4.080 4.067 0.013 1
1 465 . 2 1 1 A 37 37 PHE C C 37 178.300 178.136 0.164 1
1 466 . 2 1 1 A 37 37 PHE CA C 37 58.600 60.215 -1.615 1
1 467 . 2 1 1 A 37 37 PHE CB C 37 37.000 37.365 -0.365 1
1 473 . 2 1 1 A 37 37 PHE N N 37 119.800 118.594 1.206 1
1 474 . 2 1 1 A 38 38 SER H H 38 8.580 8.130 0.450 1
1 475 . 2 1 1 A 38 38 SER HA H 38 4.250 4.352 -0.102 1
1 478 . 2 1 1 A 38 38 SER C C 38 176.800 176.339 0.461 1
1 479 . 2 1 1 A 38 38 SER CA C 38 62.700 61.511 1.189 1
1 480 . 2 1 1 A 38 38 SER CB C 38 62.700 62.730 -0.030 1
1 481 . 2 1 1 A 38 38 SER N N 38 115.800 114.731 1.069 1
1 482 . 2 1 1 A 39 39 ASN H H 39 8.190 8.279 -0.089 1
1 483 . 2 1 1 A 39 39 ASN HA H 39 4.540 4.418 0.122 1
1 488 . 2 1 1 A 39 39 ASN C C 39 178.500 178.045 0.455 1
1 489 . 2 1 1 A 39 39 ASN CA C 39 56.200 56.427 -0.227 1
1 490 . 2 1 1 A 39 39 ASN CB C 39 37.900 37.892 0.008 1
1 491 . 2 1 1 A 39 39 ASN N N 39 121.300 120.703 0.597 1
1 493 . 2 1 1 A 40 40 VAL H H 40 7.840 7.693 0.147 1
1 494 . 2 1 1 A 40 40 VAL HA H 40 3.650 3.559 0.091 1
1 502 . 2 1 1 A 40 40 VAL C C 40 179.000 178.073 0.927 1
1 503 . 2 1 1 A 40 40 VAL CA C 40 66.600 66.562 0.038 1
1 504 . 2 1 1 A 40 40 VAL CB C 40 32.100 31.357 0.743 1
1 507 . 2 1 1 A 40 40 VAL N N 40 121.800 119.931 1.869 1
1 508 . 2 1 1 A 41 41 LEU H H 41 8.210 8.431 -0.221 1
1 509 . 2 1 1 A 41 41 LEU HA H 41 3.840 4.103 -0.263 1
1 519 . 2 1 1 A 41 41 LEU C C 41 178.800 178.066 0.734 1
1 520 . 2 1 1 A 41 41 LEU CA C 41 57.400 57.428 -0.028 1
1 521 . 2 1 1 A 41 41 LEU CB C 41 41.200 41.020 0.180 1
1 525 . 2 1 1 A 41 41 LEU N N 41 117.700 118.838 -1.138 1
1 526 . 2 1 1 A 42 42 SER H H 42 7.980 8.077 -0.097 1
1 527 . 2 1 1 A 42 42 SER HA H 42 4.260 4.498 -0.238 1
1 530 . 2 1 1 A 42 42 SER C C 42 174.900 175.035 -0.135 1
1 531 . 2 1 1 A 42 42 SER CA C 42 61.200 60.404 0.796 1
1 532 . 2 1 1 A 42 42 SER CB C 42 63.100 63.351 -0.251 1
1 533 . 2 1 1 A 42 42 SER N N 42 113.200 115.410 -2.210 1
1 534 . 2 1 1 A 43 43 ARG H H 43 7.100 7.747 -0.647 1
1 535 . 2 1 1 A 43 43 ARG HA H 43 4.500 4.655 -0.155 1
1 542 . 2 1 1 A 43 43 ARG C C 43 175.800 175.931 -0.131 1
1 543 . 2 1 1 A 43 43 ARG CA C 43 55.600 55.689 -0.089 1
1 544 . 2 1 1 A 43 43 ARG CB C 43 30.800 31.025 -0.225 1
1 547 . 2 1 1 A 43 43 ARG N N 43 118.400 118.202 0.198 1
1 548 . 2 1 1 A 44 44 LEU H H 44 7.610 7.679 -0.069 1
1 549 . 2 1 1 A 44 44 LEU HA H 44 4.590 4.609 -0.019 1
1 559 . 2 1 1 A 44 44 LEU C C 44 175.300 175.237 0.063 1
1 560 . 2 1 1 A 44 44 LEU CA C 44 53.900 53.664 0.236 1
1 561 . 2 1 1 A 44 44 LEU CB C 44 44.100 42.381 1.719 1
1 565 . 2 1 1 A 44 44 LEU N N 44 120.400 122.076 -1.676 1
1 566 . 2 1 1 A 45 45 TYR H H 45 7.630 8.143 -0.513 1
1 567 . 2 1 1 A 45 45 TYR HA H 45 5.180 4.775 0.405 1
1 574 . 2 1 1 A 45 45 TYR C C 45 174.600 174.895 -0.295 1
1 575 . 2 1 1 A 45 45 TYR CA C 45 56.300 57.735 -1.435 1
1 576 . 2 1 1 A 45 45 TYR CB C 45 41.400 37.520 3.880 1
1 581 . 2 1 1 A 45 45 TYR N N 45 115.300 121.973 -6.673 1
1 582 . 2 1 1 A 46 46 VAL H H 46 8.770 8.413 0.357 1
1 583 . 2 1 1 A 46 46 VAL HA H 46 4.540 5.047 -0.507 1
1 591 . 2 1 1 A 46 46 VAL C C 46 174.600 173.953 0.647 1
1 592 . 2 1 1 A 46 46 VAL CA C 46 59.600 59.941 -0.341 1
1 593 . 2 1 1 A 46 46 VAL CB C 46 34.700 34.775 -0.075 1
1 596 . 2 1 1 A 46 46 VAL N N 46 115.400 124.714 -9.314 1
1 597 . 2 1 1 A 47 47 GLY H H 47 8.280 8.732 -0.452 1
1 598 . 2 1 1 A 47 47 GLY HA2 H 47 3.610 4.206 -0.596 1
1 599 . 2 1 1 A 47 47 GLY HA3 H 47 4.970 4.207 0.763 1
1 600 . 2 1 1 A 47 47 GLY C C 47 173.100 172.378 0.722 1
1 601 . 2 1 1 A 47 47 GLY CA C 47 43.600 45.031 -1.431 1
1 602 . 2 1 1 A 47 47 GLY N N 47 109.900 113.800 -3.900 1
1 603 . 2 1 1 A 48 48 VAL H H 48 7.630 8.626 -0.996 1
1 604 . 2 1 1 A 48 48 VAL HA H 48 4.320 4.572 -0.252 1
1 612 . 2 1 1 A 48 48 VAL CA C 48 58.700 58.719 -0.019 1
1 613 . 2 1 1 A 48 48 VAL CB C 48 32.100 34.688 -2.588 1
1 616 . 2 1 1 A 48 48 VAL N N 48 109.900 123.534 -13.634 1
1 617 . 2 1 1 A 49 49 PRO HA H 49 4.800 4.862 -0.062 1
1 624 . 2 1 1 A 49 49 PRO C C 49 176.700 176.587 0.113 1
1 625 . 2 1 1 A 49 49 PRO CA C 49 62.300 62.581 -0.281 1
1 626 . 2 1 1 A 49 49 PRO CB C 49 35.400 31.895 3.505 1
1 629 . 2 1 1 A 50 50 THR H H 50 8.790 8.447 0.343 1
1 630 . 2 1 1 A 50 50 THR HA H 50 4.690 5.107 -0.417 1
1 635 . 2 1 1 A 50 50 THR C C 50 173.500 173.922 -0.422 1
1 636 . 2 1 1 A 50 50 THR CA C 50 60.800 59.452 1.348 1
1 637 . 2 1 1 A 50 50 THR CB C 50 70.800 71.829 -1.029 1
1 639 . 2 1 1 A 50 50 THR N N 50 113.500 112.651 0.849 1
1 640 . 2 1 1 A 51 51 LYS H H 51 7.810 8.541 -0.731 1
1 641 . 2 1 1 A 51 51 LYS HA H 51 4.890 4.767 0.123 1
1 650 . 2 1 1 A 51 51 LYS C C 51 175.900 175.966 -0.066 1
1 651 . 2 1 1 A 51 51 LYS CA C 51 54.100 54.458 -0.358 1
1 652 . 2 1 1 A 51 51 LYS CB C 51 35.300 34.598 0.702 1
1 656 . 2 1 1 A 51 51 LYS N N 51 122.200 119.008 3.192 1
1 657 . 2 1 1 A 52 52 SER H H 52 8.410 8.568 -0.158 1
1 658 . 2 1 1 A 52 52 SER HA H 52 3.630 4.288 -0.658 1
1 661 . 2 1 1 A 52 52 SER C C 52 175.800 175.056 0.744 1
1 662 . 2 1 1 A 52 52 SER CA C 52 58.800 59.844 -1.044 1
1 663 . 2 1 1 A 52 52 SER CB C 52 62.600 62.706 -0.106 1
1 664 . 2 1 1 A 52 52 SER N N 52 118.900 114.942 3.958 1
1 665 . 2 1 1 A 53 53 GLY H H 53 9.070 9.096 -0.026 1
1 666 . 2 1 1 A 53 53 GLY HA2 H 53 3.390 3.877 -0.487 1
1 667 . 2 1 1 A 53 53 GLY HA3 H 53 4.460 3.878 0.582 1
1 668 . 2 1 1 A 53 53 GLY C C 53 174.100 174.348 -0.248 1
1 669 . 2 1 1 A 53 53 GLY CA C 53 44.800 46.045 -1.245 1
1 670 . 2 1 1 A 53 53 GLY N N 53 115.600 113.363 2.237 1
1 671 . 2 1 1 A 54 54 ASN H H 54 7.870 7.798 0.072 1
1 672 . 2 1 1 A 54 54 ASN HA H 54 4.570 4.831 -0.261 1
1 677 . 2 1 1 A 54 54 ASN C C 54 175.500 174.720 0.780 1
1 678 . 2 1 1 A 54 54 ASN CA C 54 53.000 52.426 0.574 1
1 679 . 2 1 1 A 54 54 ASN CB C 54 38.600 39.256 -0.656 1
1 680 . 2 1 1 A 54 54 ASN N N 54 119.600 118.939 0.661 1
1 682 . 2 1 1 A 55 55 VAL H H 55 8.770 8.858 -0.088 1
1 683 . 2 1 1 A 55 55 VAL HA H 55 3.880 4.194 -0.314 1
1 691 . 2 1 1 A 55 55 VAL C C 55 176.200 175.252 0.948 1
1 692 . 2 1 1 A 55 55 VAL CA C 55 63.700 62.797 0.903 1
1 693 . 2 1 1 A 55 55 VAL CB C 55 31.600 31.197 0.403 1
1 696 . 2 1 1 A 55 55 VAL N N 55 123.900 123.842 0.058 1
1 697 . 2 1 1 A 56 56 VAL H H 56 9.050 8.919 0.131 1
1 698 . 2 1 1 A 56 56 VAL HA H 56 3.990 3.947 0.043 1
1 706 . 2 1 1 A 56 56 VAL C C 56 175.200 176.166 -0.966 1
1 707 . 2 1 1 A 56 56 VAL CA C 56 62.700 64.643 -1.943 1
1 708 . 2 1 1 A 56 56 VAL CB C 56 32.900 32.371 0.529 1
1 711 . 2 1 1 A 56 56 VAL N N 56 127.500 128.820 -1.320 1
1 712 . 2 1 1 A 57 57 CYS H H 57 7.250 7.953 -0.703 1
1 713 . 2 1 1 A 57 57 CYS HA H 57 4.370 4.813 -0.443 1
1 716 . 2 1 1 A 57 57 CYS C C 57 171.900 172.860 -0.960 1
1 717 . 2 1 1 A 57 57 CYS CA C 57 58.600 57.418 1.182 1
1 718 . 2 1 1 A 57 57 CYS CB C 57 28.600 30.085 -1.485 1
1 719 . 2 1 1 A 57 57 CYS N N 57 117.600 117.040 0.560 1
1 720 . 2 1 1 A 58 58 LYS H H 58 8.880 8.657 0.223 1
1 721 . 2 1 1 A 58 58 LYS HA H 58 4.220 4.488 -0.268 1
1 730 . 2 1 1 A 58 58 LYS C C 58 176.000 177.064 -1.064 1
1 731 . 2 1 1 A 58 58 LYS CA C 58 54.400 56.185 -1.785 1
1 732 . 2 1 1 A 58 58 LYS CB C 58 33.600 33.369 0.231 1
1 736 . 2 1 1 A 58 58 LYS N N 58 132.000 129.024 2.976 1
1 737 . 2 1 1 A 59 59 ASN H H 59 9.500 9.299 0.201 1
1 738 . 2 1 1 A 59 59 ASN HA H 59 4.040 4.406 -0.366 1
1 743 . 2 1 1 A 59 59 ASN C C 59 176.400 175.474 0.926 1
1 744 . 2 1 1 A 59 59 ASN CA C 59 53.200 54.182 -0.982 1
1 745 . 2 1 1 A 59 59 ASN CB C 59 35.900 36.581 -0.681 1
1 746 . 2 1 1 A 59 59 ASN N N 59 127.500 121.414 6.086 1
1 748 . 2 1 1 A 60 60 ILE H H 60 8.050 7.689 0.361 1
1 749 . 2 1 1 A 60 60 ILE HA H 60 3.680 3.878 -0.198 1
1 759 . 2 1 1 A 60 60 ILE C C 60 175.700 176.742 -1.042 1
1 760 . 2 1 1 A 60 60 ILE CA C 60 61.900 63.786 -1.886 1
1 761 . 2 1 1 A 60 60 ILE CB C 60 38.300 38.057 0.243 1
1 765 . 2 1 1 A 60 60 ILE N N 60 120.200 118.777 1.423 1
1 766 . 2 1 1 A 61 61 MET H H 61 9.590 7.841 1.749 1
1 767 . 2 1 1 A 61 61 MET HA H 61 3.920 4.683 -0.763 1
1 775 . 2 1 1 A 61 61 MET C C 61 174.300 175.613 -1.313 1
1 776 . 2 1 1 A 61 61 MET CA C 61 57.000 54.099 2.901 1
1 777 . 2 1 1 A 61 61 MET CB C 61 31.300 33.133 -1.833 1
1 780 . 2 1 1 A 61 61 MET N N 61 124.400 119.805 4.595 1
1 781 . 2 1 1 A 62 62 ASN H H 62 8.250 8.137 0.113 1
1 782 . 2 1 1 A 62 62 ASN HA H 62 4.400 4.446 -0.046 1
1 787 . 2 1 1 A 62 62 ASN C C 62 176.800 176.143 0.657 1
1 788 . 2 1 1 A 62 62 ASN CA C 62 54.400 54.398 0.002 1
1 789 . 2 1 1 A 62 62 ASN CB C 62 37.600 38.611 -1.011 1
1 790 . 2 1 1 A 62 62 ASN N N 62 111.900 118.704 -6.804 1
1 792 . 2 1 1 A 63 63 THR H H 63 7.480 8.145 -0.665 1
1 793 . 2 1 1 A 63 63 THR HA H 63 4.210 4.361 -0.151 1
1 798 . 2 1 1 A 63 63 THR C C 63 177.100 176.250 0.850 1
1 799 . 2 1 1 A 63 63 THR CA C 63 62.900 62.904 -0.004 1
1 800 . 2 1 1 A 63 63 THR CB C 63 72.500 70.590 1.910 1
1 802 . 2 1 1 A 63 63 THR N N 63 105.900 112.435 -6.535 1
1 803 . 2 1 1 A 64 64 GLY H H 64 9.110 8.234 0.876 1
1 804 . 2 1 1 A 64 64 GLY HA2 H 64 3.580 3.941 -0.361 1
1 805 . 2 1 1 A 64 64 GLY HA3 H 64 4.090 3.947 0.143 1
1 806 . 2 1 1 A 64 64 GLY C C 64 173.200 174.806 -1.606 1
1 807 . 2 1 1 A 64 64 GLY CA C 64 45.300 45.794 -0.494 1
1 808 . 2 1 1 A 64 64 GLY N N 64 111.500 111.870 -0.370 1
1 809 . 2 1 1 A 65 65 VAL H H 65 7.580 7.566 0.014 1
1 810 . 2 1 1 A 65 65 VAL HA H 65 4.060 4.186 -0.126 1
1 818 . 2 1 1 A 65 65 VAL C C 65 172.900 174.825 -1.925 1
1 819 . 2 1 1 A 65 65 VAL CA C 65 61.400 62.098 -0.698 1
1 820 . 2 1 1 A 65 65 VAL CB C 65 32.900 32.307 0.593 1
1 823 . 2 1 1 A 65 65 VAL N N 65 121.600 122.618 -1.018 1
1 824 . 2 1 1 A 66 66 ASP H H 66 8.210 9.358 -1.148 1
1 825 . 2 1 1 A 66 66 ASP HA H 66 5.320 4.993 0.327 1
1 828 . 2 1 1 A 66 66 ASP C C 66 174.800 175.068 -0.268 1
1 829 . 2 1 1 A 66 66 ASP CA C 66 51.700 53.387 -1.687 1
1 830 . 2 1 1 A 66 66 ASP CB C 66 43.200 41.182 2.018 1
1 831 . 2 1 1 A 66 66 ASP N N 66 123.100 127.599 -4.499 1
1 832 . 2 1 1 A 67 67 ILE H H 67 8.540 8.184 0.356 1
1 833 . 2 1 1 A 67 67 ILE HA H 67 4.630 4.583 0.047 1
1 843 . 2 1 1 A 67 67 ILE C C 67 175.600 175.780 -0.180 1
1 844 . 2 1 1 A 67 67 ILE CA C 67 56.900 60.917 -4.017 1
1 845 . 2 1 1 A 67 67 ILE CB C 67 35.300 37.002 -1.702 1
1 849 . 2 1 1 A 67 67 ILE N N 67 119.200 125.566 -6.366 1
1 850 . 2 1 1 A 68 68 ILE H H 68 9.420 8.936 0.484 1
1 851 . 2 1 1 A 68 68 ILE HA H 68 4.980 5.677 -0.697 1
1 861 . 2 1 1 A 68 68 ILE C C 68 175.000 174.407 0.593 1
1 862 . 2 1 1 A 68 68 ILE CA C 68 58.600 59.089 -0.489 1
1 863 . 2 1 1 A 68 68 ILE CB C 68 40.900 40.850 0.050 1
1 867 . 2 1 1 A 68 68 ILE N N 68 125.000 123.639 1.361 1
1 868 . 2 1 1 A 69 69 CYS H H 69 8.870 8.818 0.052 1
1 869 . 2 1 1 A 69 69 CYS HA H 69 4.610 4.830 -0.220 1
1 872 . 2 1 1 A 69 69 CYS C C 69 176.200 174.846 1.354 1
1 873 . 2 1 1 A 69 69 CYS CA C 69 58.900 58.468 0.432 1
1 874 . 2 1 1 A 69 69 CYS CB C 69 27.100 28.450 -1.350 1
1 875 . 2 1 1 A 69 69 CYS N N 69 122.300 124.050 -1.750 1
1 876 . 2 1 1 A 70 70 THR H H 70 8.270 8.582 -0.312 1
1 877 . 2 1 1 A 70 70 THR HA H 70 4.710 4.521 0.189 1
1 882 . 2 1 1 A 70 70 THR C C 70 173.600 173.662 -0.062 1
1 883 . 2 1 1 A 70 70 THR CA C 70 61.500 62.197 -0.697 1
1 884 . 2 1 1 A 70 70 THR CB C 70 68.100 69.784 -1.684 1
1 886 . 2 1 1 A 70 70 THR N N 70 116.700 119.476 -2.776 1
1 887 . 2 1 1 A 71 71 LYS H H 71 7.370 7.475 -0.105 1
1 888 . 2 1 1 A 71 71 LYS HA H 71 4.520 4.806 -0.286 1
1 897 . 2 1 1 A 71 71 LYS CA C 71 55.100 54.661 0.439 1
1 898 . 2 1 1 A 71 71 LYS CB C 71 37.800 34.852 2.948 1
1 902 . 2 1 1 A 71 71 LYS N N 71 120.900 122.572 -1.672 1
1 903 . 2 1 1 A 72 72 ASN H H 72 8.580 8.628 -0.048 1
1 904 . 2 1 1 A 72 72 ASN HA H 72 4.620 5.332 -0.712 1
1 909 . 2 1 1 A 72 72 ASN C C 72 173.500 174.727 -1.227 1
1 910 . 2 1 1 A 72 72 ASN CA C 72 52.200 52.974 -0.774 1
1 911 . 2 1 1 A 72 72 ASN CB C 72 38.500 39.654 -1.154 1
1 912 . 2 1 1 A 72 72 ASN N N 72 122.700 123.963 -1.263 1
1 914 . 2 1 1 A 73 73 LEU H H 73 8.100 8.947 -0.847 1
1 915 . 2 1 1 A 73 73 LEU HA H 73 4.680 4.869 -0.189 1
1 925 . 2 1 1 A 73 73 LEU CA C 73 51.000 51.366 -0.366 1
1 926 . 2 1 1 A 73 73 LEU CB C 73 42.500 42.188 0.312 1
1 930 . 2 1 1 A 73 73 LEU N N 73 125.100 125.979 -0.879 1
1 931 . 2 1 1 A 74 74 PRO HA H 74 4.670 4.635 0.035 1
1 938 . 2 1 1 A 74 74 PRO C C 74 176.500 177.744 -1.244 1
1 939 . 2 1 1 A 74 74 PRO CA C 74 61.800 63.367 -1.567 1
1 940 . 2 1 1 A 74 74 PRO CB C 74 32.800 31.878 0.922 1
1 943 . 2 1 1 A 75 75 LYS H H 75 8.280 8.849 -0.569 1
1 944 . 2 1 1 A 75 75 LYS HA H 75 4.110 4.071 0.039 1
1 953 . 2 1 1 A 75 75 LYS CA C 75 56.500 58.499 -1.999 1
1 954 . 2 1 1 A 75 75 LYS CB C 75 33.300 32.646 0.654 1
1 958 . 2 1 1 A 75 75 LYS N N 75 117.000 121.474 -4.474 1
1 959 . 2 1 1 A 76 76 ASP H H 76 8.570 7.866 0.704 1
1 960 . 2 1 1 A 76 76 ASP HA H 76 4.530 4.801 -0.271 1
1 963 . 2 1 1 A 76 76 ASP C C 76 176.300 177.063 -0.763 1
1 964 . 2 1 1 A 76 76 ASP CA C 76 55.000 54.023 0.977 1
1 965 . 2 1 1 A 76 76 ASP CB C 76 41.100 41.407 -0.307 1
1 966 . 2 1 1 A 76 76 ASP N N 76 122.700 120.492 2.208 1
1 967 . 2 1 1 A 77 77 SER H H 77 8.330 8.753 -0.423 1
1 968 . 2 1 1 A 77 77 SER HA H 77 4.410 4.659 -0.249 1
1 971 . 2 1 1 A 77 77 SER C C 77 174.300 175.185 -0.885 1
1 972 . 2 1 1 A 77 77 SER CA C 77 58.000 57.288 0.712 1
1 973 . 2 1 1 A 77 77 SER CB C 77 63.900 62.886 1.014 1
1 974 . 2 1 1 A 77 77 SER N N 77 116.100 117.437 -1.337 1
1 975 . 2 1 1 A 78 78 LEU H H 78 8.350 7.854 0.496 1
1 976 . 2 1 1 A 78 78 LEU HA H 78 4.280 4.159 0.121 1
1 986 . 2 1 1 A 78 78 LEU C C 78 177.200 176.802 0.398 1
1 987 . 2 1 1 A 78 78 LEU CA C 78 55.200 56.769 -1.569 1
1 988 . 2 1 1 A 78 78 LEU CB C 78 42.100 41.764 0.336 1
1 992 . 2 1 1 A 78 78 LEU N N 78 124.300 121.568 2.732 1
1 993 . 2 1 1 A 79 79 GLU H H 79 8.300 7.839 0.461 1
1 994 . 2 1 1 A 79 79 GLU CA C 79 56.400 55.441 0.959 1
1 995 . 2 1 1 A 79 79 GLU CB C 79 30.200 28.515 1.685 1
1 1 . 3 1 1 A 2 2 HIS HA H 2 4.640 5.241 -0.601 1
1 4 . 3 1 1 A 2 2 HIS C C 2 173.600 173.588 0.012 1
1 5 . 3 1 1 A 2 2 HIS CA C 2 56.500 54.292 2.208 1
1 6 . 3 1 1 A 2 2 HIS CB C 2 31.000 31.994 -0.994 1
1 7 . 3 1 1 A 3 3 LYS H H 3 8.160 8.663 -0.503 1
1 8 . 3 1 1 A 3 3 LYS HA H 3 4.660 4.413 0.247 1
1 17 . 3 1 1 A 3 3 LYS C C 3 174.400 175.163 -0.763 1
1 18 . 3 1 1 A 3 3 LYS CA C 3 54.800 56.158 -1.358 1
1 19 . 3 1 1 A 3 3 LYS CB C 3 35.800 32.917 2.883 1
1 23 . 3 1 1 A 3 3 LYS N N 3 121.900 126.559 -4.659 1
1 24 . 3 1 1 A 4 4 ASP H H 4 8.470 9.304 -0.834 1
1 25 . 3 1 1 A 4 4 ASP HA H 4 4.900 5.106 -0.206 1
1 28 . 3 1 1 A 4 4 ASP C C 4 176.900 174.658 2.242 1
1 29 . 3 1 1 A 4 4 ASP CA C 4 52.700 52.822 -0.122 1
1 30 . 3 1 1 A 4 4 ASP CB C 4 44.100 45.148 -1.048 1
1 31 . 3 1 1 A 4 4 ASP N N 4 117.900 123.033 -5.133 1
1 32 . 3 1 1 A 5 5 ILE H H 5 9.570 8.687 0.883 1
1 33 . 3 1 1 A 5 5 ILE HA H 5 3.640 4.346 -0.706 1
1 43 . 3 1 1 A 5 5 ILE C C 5 174.800 175.567 -0.767 1
1 44 . 3 1 1 A 5 5 ILE CA C 5 60.900 60.797 0.103 1
1 45 . 3 1 1 A 5 5 ILE CB C 5 37.000 37.914 -0.914 1
1 49 . 3 1 1 A 5 5 ILE N N 5 124.400 121.399 3.001 1
1 50 . 3 1 1 A 6 6 PHE H H 6 7.790 8.881 -1.091 1
1 51 . 3 1 1 A 6 6 PHE HA H 6 3.160 4.327 -1.167 1
1 58 . 3 1 1 A 6 6 PHE C C 6 173.500 174.207 -0.707 1
1 59 . 3 1 1 A 6 6 PHE CA C 6 56.900 58.322 -1.422 1
1 60 . 3 1 1 A 6 6 PHE CB C 6 40.100 38.928 1.172 1
1 65 . 3 1 1 A 6 6 PHE N N 6 130.200 129.195 1.005 1
1 66 . 3 1 1 A 7 7 THR H H 7 6.790 8.530 -1.740 1
1 67 . 3 1 1 A 7 7 THR HA H 7 4.530 5.061 -0.531 1
1 72 . 3 1 1 A 7 7 THR C C 7 172.300 173.329 -1.029 1
1 73 . 3 1 1 A 7 7 THR CA C 7 59.200 60.970 -1.770 1
1 74 . 3 1 1 A 7 7 THR CB C 7 71.000 70.325 0.675 1
1 76 . 3 1 1 A 7 7 THR N N 7 117.900 123.629 -5.729 1
1 77 . 3 1 1 A 8 8 SER H H 8 7.600 8.802 -1.202 1
1 78 . 3 1 1 A 8 8 SER HA H 8 4.180 4.739 -0.559 1
1 81 . 3 1 1 A 8 8 SER C C 8 175.300 172.226 3.074 1
1 82 . 3 1 1 A 8 8 SER CA C 8 55.800 55.921 -0.121 1
1 83 . 3 1 1 A 8 8 SER CB C 8 64.000 64.495 -0.495 1
1 84 . 3 1 1 A 8 8 SER N N 8 113.400 120.338 -6.938 1
1 85 . 3 1 1 A 9 9 VAL H H 9 8.880 8.572 0.308 1
1 86 . 3 1 1 A 9 9 VAL HA H 9 5.220 5.035 0.185 1
1 94 . 3 1 1 A 9 9 VAL C C 9 174.000 173.666 0.334 1
1 95 . 3 1 1 A 9 9 VAL CA C 9 59.100 59.340 -0.240 1
1 96 . 3 1 1 A 9 9 VAL CB C 9 36.500 34.730 1.770 1
1 99 . 3 1 1 A 9 9 VAL N N 9 114.700 118.975 -4.275 1
1 100 . 3 1 1 A 10 10 VAL H H 10 8.510 9.117 -0.607 1
1 101 . 3 1 1 A 10 10 VAL HA H 10 4.470 4.911 -0.441 1
1 109 . 3 1 1 A 10 10 VAL C C 10 173.700 174.515 -0.815 1
1 110 . 3 1 1 A 10 10 VAL CA C 10 59.400 59.467 -0.067 1
1 111 . 3 1 1 A 10 10 VAL CB C 10 36.000 35.461 0.539 1
1 114 . 3 1 1 A 10 10 VAL N N 10 117.100 123.407 -6.307 1
1 115 . 3 1 1 A 11 11 ARG H H 11 8.500 8.331 0.169 1
1 116 . 3 1 1 A 11 11 ARG HA H 11 4.460 4.932 -0.472 1
1 123 . 3 1 1 A 11 11 ARG C C 11 174.500 175.504 -1.004 1
1 124 . 3 1 1 A 11 11 ARG CA C 11 57.400 55.992 1.408 1
1 125 . 3 1 1 A 11 11 ARG CB C 11 31.000 31.056 -0.056 1
1 128 . 3 1 1 A 11 11 ARG N N 11 124.800 126.229 -1.429 1
1 129 . 3 1 1 A 12 12 VAL H H 12 7.650 9.323 -1.673 1
1 130 . 3 1 1 A 12 12 VAL HA H 12 4.970 4.998 -0.028 1
1 138 . 3 1 1 A 12 12 VAL C C 12 176.700 174.954 1.746 1
1 139 . 3 1 1 A 12 12 VAL CA C 12 59.400 61.254 -1.854 1
1 140 . 3 1 1 A 12 12 VAL CB C 12 34.400 33.420 0.980 1
1 143 . 3 1 1 A 12 12 VAL N N 12 120.900 124.549 -3.649 1
1 144 . 3 1 1 A 13 13 ARG H H 13 9.020 8.831 0.189 1
1 145 . 3 1 1 A 13 13 ARG HA H 13 4.700 5.055 -0.355 1
1 152 . 3 1 1 A 13 13 ARG C C 13 176.000 175.241 0.759 1
1 153 . 3 1 1 A 13 13 ARG CA C 13 54.600 54.965 -0.365 1
1 154 . 3 1 1 A 13 13 ARG CB C 13 32.900 33.027 -0.127 1
1 157 . 3 1 1 A 13 13 ARG N N 13 127.500 127.811 -0.311 1
1 158 . 3 1 1 A 14 14 GLY H H 14 8.640 8.371 0.269 1
1 159 . 3 1 1 A 14 14 GLY HA2 H 14 3.680 4.250 -0.570 1
1 160 . 3 1 1 A 14 14 GLY HA3 H 14 4.190 4.257 -0.067 1
1 161 . 3 1 1 A 14 14 GLY C C 14 173.700 171.691 2.009 1
1 162 . 3 1 1 A 14 14 GLY CA C 14 45.600 45.623 -0.023 1
1 163 . 3 1 1 A 14 14 GLY N N 14 108.800 113.776 -4.976 1
1 164 . 3 1 1 A 15 15 SER H H 15 8.220 8.416 -0.196 1
1 165 . 3 1 1 A 15 15 SER HA H 15 5.020 4.710 0.310 1
1 168 . 3 1 1 A 15 15 SER C C 15 175.400 172.996 2.404 1
1 169 . 3 1 1 A 15 15 SER CA C 15 55.300 57.469 -2.169 1
1 170 . 3 1 1 A 15 15 SER CB C 15 64.900 61.880 3.020 1
1 171 . 3 1 1 A 15 15 SER N N 15 113.200 115.303 -2.103 1
1 172 . 3 1 1 A 16 16 LYS H H 16 9.930 8.088 1.842 1
1 173 . 3 1 1 A 16 16 LYS HA H 16 4.190 5.032 -0.842 1
1 182 . 3 1 1 A 16 16 LYS C C 16 176.500 174.859 1.641 1
1 183 . 3 1 1 A 16 16 LYS CA C 16 57.300 54.853 2.447 1
1 184 . 3 1 1 A 16 16 LYS CB C 16 32.300 35.904 -3.604 1
1 188 . 3 1 1 A 16 16 LYS N N 16 129.200 122.488 6.712 1
1 189 . 3 1 1 A 17 17 LYS H H 17 7.960 8.162 -0.202 1
1 190 . 3 1 1 A 17 17 LYS HA H 17 4.030 4.407 -0.377 1
1 199 . 3 1 1 A 17 17 LYS C C 17 175.600 174.765 0.835 1
1 200 . 3 1 1 A 17 17 LYS CA C 17 56.900 55.509 1.391 1
1 201 . 3 1 1 A 17 17 LYS CB C 17 34.700 31.650 3.050 1
1 205 . 3 1 1 A 17 17 LYS N N 17 118.500 122.330 -3.830 1
1 206 . 3 1 1 A 18 18 TYR H H 18 7.780 7.727 0.053 1
1 207 . 3 1 1 A 18 18 TYR HA H 18 4.760 5.046 -0.286 1
1 214 . 3 1 1 A 18 18 TYR C C 18 174.000 175.532 -1.532 1
1 215 . 3 1 1 A 18 18 TYR CA C 18 56.800 56.576 0.224 1
1 216 . 3 1 1 A 18 18 TYR CB C 18 41.100 40.586 0.514 1
1 221 . 3 1 1 A 18 18 TYR N N 18 117.100 121.345 -4.245 1
1 222 . 3 1 1 A 19 19 ASN H H 19 8.890 8.771 0.119 1
1 223 . 3 1 1 A 19 19 ASN HA H 19 4.960 4.958 0.002 1
1 228 . 3 1 1 A 19 19 ASN C C 19 176.100 174.735 1.365 1
1 229 . 3 1 1 A 19 19 ASN CA C 19 53.600 53.587 0.013 1
1 230 . 3 1 1 A 19 19 ASN CB C 19 40.300 39.305 0.995 1
1 231 . 3 1 1 A 19 19 ASN N N 19 116.600 122.136 -5.536 1
1 233 . 3 1 1 A 20 20 VAL H H 20 7.730 7.642 0.088 1
1 234 . 3 1 1 A 20 20 VAL HA H 20 5.250 5.104 0.146 1
1 242 . 3 1 1 A 20 20 VAL C C 20 173.800 174.209 -0.409 1
1 243 . 3 1 1 A 20 20 VAL CA C 20 59.400 59.681 -0.281 1
1 244 . 3 1 1 A 20 20 VAL CB C 20 37.600 35.413 2.187 1
1 247 . 3 1 1 A 20 20 VAL N N 20 113.900 115.119 -1.219 1
1 248 . 3 1 1 A 21 21 VAL H H 21 8.890 8.838 0.052 1
1 249 . 3 1 1 A 21 21 VAL HA H 21 4.840 4.799 0.041 1
1 257 . 3 1 1 A 21 21 VAL CA C 21 56.800 57.525 -0.725 1
1 258 . 3 1 1 A 21 21 VAL CB C 21 36.000 35.357 0.643 1
1 261 . 3 1 1 A 21 21 VAL N N 21 118.500 123.521 -5.021 1
1 262 . 3 1 1 A 22 22 PRO HA H 22 4.940 5.073 -0.133 1
1 269 . 3 1 1 A 22 22 PRO C C 22 175.600 176.350 -0.750 1
1 270 . 3 1 1 A 22 22 PRO CA C 22 62.700 62.492 0.208 1
1 271 . 3 1 1 A 22 22 PRO CB C 22 31.800 31.723 0.077 1
1 274 . 3 1 1 A 23 23 VAL H H 23 8.060 8.710 -0.650 1
1 275 . 3 1 1 A 23 23 VAL HA H 23 5.390 5.055 0.335 1
1 283 . 3 1 1 A 23 23 VAL C C 23 175.400 174.401 0.999 1
1 284 . 3 1 1 A 23 23 VAL CA C 23 57.800 59.155 -1.355 1
1 285 . 3 1 1 A 23 23 VAL CB C 23 36.300 34.664 1.636 1
1 288 . 3 1 1 A 23 23 VAL N N 23 110.900 116.523 -5.623 1
1 289 . 3 1 1 A 24 24 LYS H H 24 8.960 9.287 -0.327 1
1 290 . 3 1 1 A 24 24 LYS HA H 24 5.600 5.268 0.332 1
1 299 . 3 1 1 A 24 24 LYS C C 24 175.600 174.695 0.905 1
1 300 . 3 1 1 A 24 24 LYS CA C 24 54.200 54.020 0.180 1
1 301 . 3 1 1 A 24 24 LYS CB C 24 37.000 36.249 0.751 1
1 305 . 3 1 1 A 24 24 LYS N N 24 117.900 121.266 -3.366 1
1 306 . 3 1 1 A 25 25 SER H H 25 8.950 8.767 0.183 1
1 307 . 3 1 1 A 25 25 SER HA H 25 5.190 4.859 0.331 1
1 310 . 3 1 1 A 25 25 SER C C 25 173.800 175.115 -1.315 1
1 311 . 3 1 1 A 25 25 SER CA C 25 57.700 58.281 -0.581 1
1 312 . 3 1 1 A 25 25 SER CB C 25 65.100 64.742 0.358 1
1 313 . 3 1 1 A 25 25 SER N N 25 114.600 118.100 -3.500 1
1 314 . 3 1 1 A 26 26 ASN H H 26 9.020 8.537 0.483 1
1 315 . 3 1 1 A 26 26 ASN HA H 26 4.370 4.606 -0.236 1
1 320 . 3 1 1 A 26 26 ASN C C 26 173.500 174.706 -1.206 1
1 321 . 3 1 1 A 26 26 ASN CA C 26 53.700 54.489 -0.789 1
1 322 . 3 1 1 A 26 26 ASN CB C 26 37.100 38.276 -1.176 1
1 323 . 3 1 1 A 26 26 ASN N N 26 118.300 122.250 -3.950 1
1 325 . 3 1 1 A 27 27 LYS H H 27 7.400 7.633 -0.233 1
1 326 . 3 1 1 A 27 27 LYS HA H 27 4.780 4.696 0.084 1
1 335 . 3 1 1 A 27 27 LYS CA C 27 53.500 52.694 0.806 1
1 336 . 3 1 1 A 27 27 LYS CB C 27 34.100 34.683 -0.583 1
1 340 . 3 1 1 A 27 27 LYS N N 27 116.600 119.427 -2.827 1
1 341 . 3 1 1 A 28 28 PRO HA H 28 4.040 4.827 -0.787 1
1 348 . 3 1 1 A 28 28 PRO C C 28 174.500 176.523 -2.023 1
1 349 . 3 1 1 A 28 28 PRO CA C 28 63.200 62.857 0.343 1
1 350 . 3 1 1 A 28 28 PRO CB C 28 32.500 31.737 0.763 1
1 353 . 3 1 1 A 29 29 VAL H H 29 8.860 8.402 0.458 1
1 354 . 3 1 1 A 29 29 VAL HA H 29 4.420 4.646 -0.226 1
1 362 . 3 1 1 A 29 29 VAL C C 29 174.800 175.556 -0.756 1
1 363 . 3 1 1 A 29 29 VAL CA C 29 60.300 59.382 0.918 1
1 364 . 3 1 1 A 29 29 VAL CB C 29 36.400 34.236 2.164 1
1 367 . 3 1 1 A 29 29 VAL N N 29 119.800 116.886 2.914 1
1 368 . 3 1 1 A 30 30 GLU H H 30 9.550 8.423 1.127 1
1 369 . 3 1 1 A 30 30 GLU HA H 30 4.260 4.519 -0.259 1
1 374 . 3 1 1 A 30 30 GLU C C 30 177.800 177.943 -0.143 1
1 375 . 3 1 1 A 30 30 GLU CA C 30 58.000 57.035 0.965 1
1 376 . 3 1 1 A 30 30 GLU CB C 30 29.700 30.092 -0.392 1
1 378 . 3 1 1 A 30 30 GLU N N 30 128.900 122.670 6.230 1
1 379 . 3 1 1 A 31 31 ILE H H 31 7.910 8.745 -0.835 1
1 380 . 3 1 1 A 31 31 ILE HA H 31 2.120 3.872 -1.752 1
1 390 . 3 1 1 A 31 31 ILE C C 31 178.000 176.214 1.786 1
1 391 . 3 1 1 A 31 31 ILE CA C 31 63.500 62.348 1.152 1
1 392 . 3 1 1 A 31 31 ILE CB C 31 37.200 37.369 -0.169 1
1 396 . 3 1 1 A 31 31 ILE N N 31 122.500 122.196 0.304 1
1 397 . 3 1 1 A 32 32 SER H H 32 7.940 8.097 -0.157 1
1 398 . 3 1 1 A 32 32 SER HA H 32 4.070 4.976 -0.906 1
1 401 . 3 1 1 A 32 32 SER C C 32 175.800 174.818 0.982 1
1 402 . 3 1 1 A 32 32 SER CA C 32 60.200 58.195 2.005 1
1 403 . 3 1 1 A 32 32 SER CB C 32 62.100 63.935 -1.835 1
1 404 . 3 1 1 A 32 32 SER N N 32 115.300 116.850 -1.550 1
1 405 . 3 1 1 A 33 33 LYS H H 33 7.640 7.575 0.065 1
1 406 . 3 1 1 A 33 33 LYS HA H 33 4.400 4.625 -0.225 1
1 415 . 3 1 1 A 33 33 LYS C C 33 176.600 177.037 -0.437 1
1 416 . 3 1 1 A 33 33 LYS CA C 33 56.200 55.857 0.343 1
1 417 . 3 1 1 A 33 33 LYS CB C 33 32.700 32.585 0.115 1
1 421 . 3 1 1 A 33 33 LYS N N 33 119.800 119.494 0.306 1
1 422 . 3 1 1 A 34 34 TRP H H 34 7.860 7.763 0.097 1
1 423 . 3 1 1 A 34 34 TRP HA H 34 3.870 4.590 -0.720 1
1 426 . 3 1 1 A 34 34 TRP C C 34 178.600 178.528 0.072 1
1 427 . 3 1 1 A 34 34 TRP CA C 34 60.200 59.797 0.403 1
1 428 . 3 1 1 A 34 34 TRP CB C 34 28.500 29.549 -1.049 1
1 429 . 3 1 1 A 34 34 TRP N N 34 120.000 121.191 -1.191 1
1 430 . 3 1 1 A 35 35 ILE H H 35 8.200 8.352 -0.152 1
1 431 . 3 1 1 A 35 35 ILE HA H 35 3.990 3.913 0.077 1
1 441 . 3 1 1 A 35 35 ILE C C 35 177.900 177.472 0.428 1
1 442 . 3 1 1 A 35 35 ILE CA C 35 64.300 64.603 -0.303 1
1 443 . 3 1 1 A 35 35 ILE CB C 35 37.200 37.475 -0.275 1
1 447 . 3 1 1 A 35 35 ILE N N 35 119.500 121.000 -1.500 1
1 448 . 3 1 1 A 36 36 ASP H H 36 7.680 8.237 -0.557 1
1 449 . 3 1 1 A 36 36 ASP HA H 36 4.490 4.247 0.243 1
1 452 . 3 1 1 A 36 36 ASP C C 36 179.200 179.013 0.187 1
1 453 . 3 1 1 A 36 36 ASP CA C 36 57.500 57.267 0.233 1
1 454 . 3 1 1 A 36 36 ASP CB C 36 40.400 40.424 -0.024 1
1 455 . 3 1 1 A 36 36 ASP N N 36 122.000 121.331 0.669 1
1 456 . 3 1 1 A 37 37 PHE H H 37 8.450 7.762 0.688 1
1 457 . 3 1 1 A 37 37 PHE HA H 37 4.080 4.064 0.016 1
1 465 . 3 1 1 A 37 37 PHE C C 37 178.300 177.793 0.507 1
1 466 . 3 1 1 A 37 37 PHE CA C 37 58.600 60.422 -1.822 1
1 467 . 3 1 1 A 37 37 PHE CB C 37 37.000 37.613 -0.613 1
1 473 . 3 1 1 A 37 37 PHE N N 37 119.800 119.411 0.389 1
1 474 . 3 1 1 A 38 38 SER H H 38 8.580 8.439 0.141 1
1 475 . 3 1 1 A 38 38 SER HA H 38 4.250 4.373 -0.123 1
1 478 . 3 1 1 A 38 38 SER C C 38 176.800 176.641 0.159 1
1 479 . 3 1 1 A 38 38 SER CA C 38 62.700 61.612 1.088 1
1 480 . 3 1 1 A 38 38 SER CB C 38 62.700 62.906 -0.206 1
1 481 . 3 1 1 A 38 38 SER N N 38 115.800 114.626 1.174 1
1 482 . 3 1 1 A 39 39 ASN H H 39 8.190 8.226 -0.036 1
1 483 . 3 1 1 A 39 39 ASN HA H 39 4.540 4.475 0.065 1
1 488 . 3 1 1 A 39 39 ASN C C 39 178.500 178.236 0.264 1
1 489 . 3 1 1 A 39 39 ASN CA C 39 56.200 56.464 -0.264 1
1 490 . 3 1 1 A 39 39 ASN CB C 39 37.900 37.893 0.007 1
1 491 . 3 1 1 A 39 39 ASN N N 39 121.300 120.780 0.520 1
1 493 . 3 1 1 A 40 40 VAL H H 40 7.840 7.725 0.115 1
1 494 . 3 1 1 A 40 40 VAL HA H 40 3.650 3.571 0.079 1
1 502 . 3 1 1 A 40 40 VAL C C 40 179.000 178.044 0.956 1
1 503 . 3 1 1 A 40 40 VAL CA C 40 66.600 66.454 0.146 1
1 504 . 3 1 1 A 40 40 VAL CB C 40 32.100 31.604 0.496 1
1 507 . 3 1 1 A 40 40 VAL N N 40 121.800 119.992 1.808 1
1 508 . 3 1 1 A 41 41 LEU H H 41 8.210 8.282 -0.072 1
1 509 . 3 1 1 A 41 41 LEU HA H 41 3.840 4.066 -0.226 1
1 519 . 3 1 1 A 41 41 LEU C C 41 178.800 179.040 -0.240 1
1 520 . 3 1 1 A 41 41 LEU CA C 41 57.400 57.570 -0.170 1
1 521 . 3 1 1 A 41 41 LEU CB C 41 41.200 40.953 0.247 1
1 525 . 3 1 1 A 41 41 LEU N N 41 117.700 118.734 -1.034 1
1 526 . 3 1 1 A 42 42 SER H H 42 7.980 7.902 0.078 1
1 527 . 3 1 1 A 42 42 SER HA H 42 4.260 4.129 0.131 1
1 530 . 3 1 1 A 42 42 SER C C 42 174.900 175.406 -0.506 1
1 531 . 3 1 1 A 42 42 SER CA C 42 61.200 60.984 0.216 1
1 532 . 3 1 1 A 42 42 SER CB C 42 63.100 62.939 0.161 1
1 533 . 3 1 1 A 42 42 SER N N 42 113.200 114.446 -1.246 1
1 534 . 3 1 1 A 43 43 ARG H H 43 7.100 7.445 -0.345 1
1 535 . 3 1 1 A 43 43 ARG HA H 43 4.500 4.501 -0.001 1
1 542 . 3 1 1 A 43 43 ARG C C 43 175.800 176.005 -0.205 1
1 543 . 3 1 1 A 43 43 ARG CA C 43 55.600 55.949 -0.349 1
1 544 . 3 1 1 A 43 43 ARG CB C 43 30.800 31.048 -0.248 1
1 547 . 3 1 1 A 43 43 ARG N N 43 118.400 117.933 0.467 1
1 548 . 3 1 1 A 44 44 LEU H H 44 7.610 7.346 0.264 1
1 549 . 3 1 1 A 44 44 LEU HA H 44 4.590 4.614 -0.024 1
1 559 . 3 1 1 A 44 44 LEU C C 44 175.300 174.263 1.037 1
1 560 . 3 1 1 A 44 44 LEU CA C 44 53.900 53.625 0.275 1
1 561 . 3 1 1 A 44 44 LEU CB C 44 44.100 43.131 0.969 1
1 565 . 3 1 1 A 44 44 LEU N N 44 120.400 122.590 -2.190 1
1 566 . 3 1 1 A 45 45 TYR H H 45 7.630 9.151 -1.521 1
1 567 . 3 1 1 A 45 45 TYR HA H 45 5.180 4.951 0.229 1
1 574 . 3 1 1 A 45 45 TYR C C 45 174.600 174.722 -0.122 1
1 575 . 3 1 1 A 45 45 TYR CA C 45 56.300 57.201 -0.901 1
1 576 . 3 1 1 A 45 45 TYR CB C 45 41.400 37.612 3.788 1
1 581 . 3 1 1 A 45 45 TYR N N 45 115.300 127.185 -11.885 1
1 582 . 3 1 1 A 46 46 VAL H H 46 8.770 8.866 -0.096 1
1 583 . 3 1 1 A 46 46 VAL HA H 46 4.540 4.818 -0.278 1
1 591 . 3 1 1 A 46 46 VAL C C 46 174.600 175.656 -1.056 1
1 592 . 3 1 1 A 46 46 VAL CA C 46 59.600 60.212 -0.612 1
1 593 . 3 1 1 A 46 46 VAL CB C 46 34.700 33.807 0.893 1
1 596 . 3 1 1 A 46 46 VAL N N 46 115.400 125.206 -9.806 1
1 597 . 3 1 1 A 47 47 GLY H H 47 8.280 8.623 -0.343 1
1 598 . 3 1 1 A 47 47 GLY HA2 H 47 3.610 4.160 -0.550 1
1 599 . 3 1 1 A 47 47 GLY HA3 H 47 4.970 4.166 0.804 1
1 600 . 3 1 1 A 47 47 GLY C C 47 173.100 173.328 -0.228 1
1 601 . 3 1 1 A 47 47 GLY CA C 47 43.600 44.501 -0.901 1
1 602 . 3 1 1 A 47 47 GLY N N 47 109.900 114.576 -4.676 1
1 603 . 3 1 1 A 48 48 VAL H H 48 7.630 8.671 -1.041 1
1 604 . 3 1 1 A 48 48 VAL HA H 48 4.320 4.219 0.101 1
1 612 . 3 1 1 A 48 48 VAL CA C 48 58.700 63.365 -4.665 1
1 613 . 3 1 1 A 48 48 VAL CB C 48 32.100 30.734 1.366 1
1 616 . 3 1 1 A 48 48 VAL N N 48 109.900 118.849 -8.949 1
1 617 . 3 1 1 A 49 49 PRO HA H 49 4.800 4.862 -0.062 1
1 624 . 3 1 1 A 49 49 PRO C C 49 176.700 176.110 0.590 1
1 625 . 3 1 1 A 49 49 PRO CA C 49 62.300 62.499 -0.199 1
1 626 . 3 1 1 A 49 49 PRO CB C 49 35.400 30.798 4.602 1
1 629 . 3 1 1 A 50 50 THR H H 50 8.790 8.287 0.503 1
1 630 . 3 1 1 A 50 50 THR HA H 50 4.690 4.941 -0.251 1
1 635 . 3 1 1 A 50 50 THR C C 50 173.500 173.952 -0.452 1
1 636 . 3 1 1 A 50 50 THR CA C 50 60.800 59.829 0.971 1
1 637 . 3 1 1 A 50 50 THR CB C 50 70.800 71.824 -1.024 1
1 639 . 3 1 1 A 50 50 THR N N 50 113.500 112.628 0.872 1
1 640 . 3 1 1 A 51 51 LYS H H 51 7.810 8.607 -0.797 1
1 641 . 3 1 1 A 51 51 LYS HA H 51 4.890 4.789 0.101 1
1 650 . 3 1 1 A 51 51 LYS C C 51 175.900 175.965 -0.065 1
1 651 . 3 1 1 A 51 51 LYS CA C 51 54.100 54.279 -0.179 1
1 652 . 3 1 1 A 51 51 LYS CB C 51 35.300 35.095 0.205 1
1 656 . 3 1 1 A 51 51 LYS N N 51 122.200 120.349 1.851 1
1 657 . 3 1 1 A 52 52 SER H H 52 8.410 8.565 -0.155 1
1 658 . 3 1 1 A 52 52 SER HA H 52 3.630 4.150 -0.520 1
1 661 . 3 1 1 A 52 52 SER C C 52 175.800 175.305 0.495 1
1 662 . 3 1 1 A 52 52 SER CA C 52 58.800 59.903 -1.103 1
1 663 . 3 1 1 A 52 52 SER CB C 52 62.600 62.743 -0.143 1
1 664 . 3 1 1 A 52 52 SER N N 52 118.900 117.141 1.759 1
1 665 . 3 1 1 A 53 53 GLY H H 53 9.070 8.940 0.130 1
1 666 . 3 1 1 A 53 53 GLY HA2 H 53 3.390 3.898 -0.508 1
1 667 . 3 1 1 A 53 53 GLY HA3 H 53 4.460 3.899 0.561 1
1 668 . 3 1 1 A 53 53 GLY C C 53 174.100 174.239 -0.139 1
1 669 . 3 1 1 A 53 53 GLY CA C 53 44.800 45.542 -0.742 1
1 670 . 3 1 1 A 53 53 GLY N N 53 115.600 114.739 0.861 1
1 671 . 3 1 1 A 54 54 ASN H H 54 7.870 7.699 0.171 1
1 672 . 3 1 1 A 54 54 ASN HA H 54 4.570 4.895 -0.325 1
1 677 . 3 1 1 A 54 54 ASN C C 54 175.500 174.298 1.202 1
1 678 . 3 1 1 A 54 54 ASN CA C 54 53.000 52.139 0.861 1
1 679 . 3 1 1 A 54 54 ASN CB C 54 38.600 39.251 -0.651 1
1 680 . 3 1 1 A 54 54 ASN N N 54 119.600 119.041 0.559 1
1 682 . 3 1 1 A 55 55 VAL H H 55 8.770 8.918 -0.148 1
1 683 . 3 1 1 A 55 55 VAL HA H 55 3.880 4.230 -0.350 1
1 691 . 3 1 1 A 55 55 VAL C C 55 176.200 177.251 -1.051 1
1 692 . 3 1 1 A 55 55 VAL CA C 55 63.700 62.848 0.852 1
1 693 . 3 1 1 A 55 55 VAL CB C 55 31.600 31.184 0.416 1
1 696 . 3 1 1 A 55 55 VAL N N 55 123.900 123.833 0.067 1
1 697 . 3 1 1 A 56 56 VAL H H 56 9.050 8.567 0.483 1
1 698 . 3 1 1 A 56 56 VAL HA H 56 3.990 4.076 -0.086 1
1 706 . 3 1 1 A 56 56 VAL C C 56 175.200 175.884 -0.684 1
1 707 . 3 1 1 A 56 56 VAL CA C 56 62.700 63.817 -1.117 1
1 708 . 3 1 1 A 56 56 VAL CB C 56 32.900 32.199 0.701 1
1 711 . 3 1 1 A 56 56 VAL N N 56 127.500 123.715 3.785 1
1 712 . 3 1 1 A 57 57 CYS H H 57 7.250 7.475 -0.225 1
1 713 . 3 1 1 A 57 57 CYS HA H 57 4.370 4.830 -0.460 1
1 716 . 3 1 1 A 57 57 CYS C C 57 171.900 172.886 -0.986 1
1 717 . 3 1 1 A 57 57 CYS CA C 57 58.600 57.343 1.257 1
1 718 . 3 1 1 A 57 57 CYS CB C 57 28.600 29.874 -1.274 1
1 719 . 3 1 1 A 57 57 CYS N N 57 117.600 120.292 -2.692 1
1 720 . 3 1 1 A 58 58 LYS H H 58 8.880 8.677 0.203 1
1 721 . 3 1 1 A 58 58 LYS HA H 58 4.220 4.665 -0.445 1
1 730 . 3 1 1 A 58 58 LYS C C 58 176.000 176.637 -0.637 1
1 731 . 3 1 1 A 58 58 LYS CA C 58 54.400 55.670 -1.270 1
1 732 . 3 1 1 A 58 58 LYS CB C 58 33.600 33.908 -0.308 1
1 736 . 3 1 1 A 58 58 LYS N N 58 132.000 128.837 3.163 1
1 737 . 3 1 1 A 59 59 ASN H H 59 9.500 9.338 0.162 1
1 738 . 3 1 1 A 59 59 ASN HA H 59 4.040 4.257 -0.217 1
1 743 . 3 1 1 A 59 59 ASN C C 59 176.400 174.261 2.139 1
1 744 . 3 1 1 A 59 59 ASN CA C 59 53.200 54.170 -0.970 1
1 745 . 3 1 1 A 59 59 ASN CB C 59 35.900 36.965 -1.065 1
1 746 . 3 1 1 A 59 59 ASN N N 59 127.500 119.833 7.667 1
1 748 . 3 1 1 A 60 60 ILE H H 60 8.050 8.003 0.047 1
1 749 . 3 1 1 A 60 60 ILE HA H 60 3.680 3.739 -0.059 1
1 759 . 3 1 1 A 60 60 ILE C C 60 175.700 176.793 -1.093 1
1 760 . 3 1 1 A 60 60 ILE CA C 60 61.900 62.368 -0.468 1
1 761 . 3 1 1 A 60 60 ILE CB C 60 38.300 37.860 0.440 1
1 765 . 3 1 1 A 60 60 ILE N N 60 120.200 119.581 0.619 1
1 766 . 3 1 1 A 61 61 MET H H 61 9.590 9.290 0.300 1
1 767 . 3 1 1 A 61 61 MET HA H 61 3.920 4.095 -0.175 1
1 775 . 3 1 1 A 61 61 MET C C 61 174.300 175.425 -1.125 1
1 776 . 3 1 1 A 61 61 MET CA C 61 57.000 56.874 0.126 1
1 777 . 3 1 1 A 61 61 MET CB C 61 31.300 30.862 0.438 1
1 780 . 3 1 1 A 61 61 MET N N 61 124.400 125.919 -1.519 1
1 781 . 3 1 1 A 62 62 ASN H H 62 8.250 8.467 -0.217 1
1 782 . 3 1 1 A 62 62 ASN HA H 62 4.400 4.420 -0.020 1
1 787 . 3 1 1 A 62 62 ASN C C 62 176.800 174.756 2.044 1
1 788 . 3 1 1 A 62 62 ASN CA C 62 54.400 54.703 -0.303 1
1 789 . 3 1 1 A 62 62 ASN CB C 62 37.600 36.910 0.690 1
1 790 . 3 1 1 A 62 62 ASN N N 62 111.900 110.128 1.772 1
1 792 . 3 1 1 A 63 63 THR H H 63 7.480 7.620 -0.140 1
1 793 . 3 1 1 A 63 63 THR HA H 63 4.210 4.475 -0.265 1
1 798 . 3 1 1 A 63 63 THR C C 63 177.100 174.801 2.299 1
1 799 . 3 1 1 A 63 63 THR CA C 63 62.900 62.599 0.301 1
1 800 . 3 1 1 A 63 63 THR CB C 63 72.500 69.909 2.591 1
1 802 . 3 1 1 A 63 63 THR N N 63 105.900 112.423 -6.523 1
1 803 . 3 1 1 A 64 64 GLY H H 64 9.110 8.067 1.043 1
1 804 . 3 1 1 A 64 64 GLY HA2 H 64 3.580 3.930 -0.350 1
1 805 . 3 1 1 A 64 64 GLY HA3 H 64 4.090 3.931 0.159 1
1 806 . 3 1 1 A 64 64 GLY C C 64 173.200 174.294 -1.094 1
1 807 . 3 1 1 A 64 64 GLY CA C 64 45.300 45.243 0.057 1
1 808 . 3 1 1 A 64 64 GLY N N 64 111.500 110.785 0.715 1
1 809 . 3 1 1 A 65 65 VAL H H 65 7.580 7.737 -0.157 1
1 810 . 3 1 1 A 65 65 VAL HA H 65 4.060 4.056 0.004 1
1 818 . 3 1 1 A 65 65 VAL C C 65 172.900 175.018 -2.118 1
1 819 . 3 1 1 A 65 65 VAL CA C 65 61.400 62.504 -1.104 1
1 820 . 3 1 1 A 65 65 VAL CB C 65 32.900 31.869 1.031 1
1 823 . 3 1 1 A 65 65 VAL N N 65 121.600 122.668 -1.068 1
1 824 . 3 1 1 A 66 66 ASP H H 66 8.210 9.523 -1.313 1
1 825 . 3 1 1 A 66 66 ASP HA H 66 5.320 5.212 0.108 1
1 828 . 3 1 1 A 66 66 ASP C C 66 174.800 175.028 -0.228 1
1 829 . 3 1 1 A 66 66 ASP CA C 66 51.700 53.314 -1.614 1
1 830 . 3 1 1 A 66 66 ASP CB C 66 43.200 42.100 1.100 1
1 831 . 3 1 1 A 66 66 ASP N N 66 123.100 127.549 -4.449 1
1 832 . 3 1 1 A 67 67 ILE H H 67 8.540 8.746 -0.206 1
1 833 . 3 1 1 A 67 67 ILE HA H 67 4.630 4.515 0.115 1
1 843 . 3 1 1 A 67 67 ILE C C 67 175.600 175.790 -0.190 1
1 844 . 3 1 1 A 67 67 ILE CA C 67 56.900 60.923 -4.023 1
1 845 . 3 1 1 A 67 67 ILE CB C 67 35.300 37.173 -1.873 1
1 849 . 3 1 1 A 67 67 ILE N N 67 119.200 125.604 -6.404 1
1 850 . 3 1 1 A 68 68 ILE H H 68 9.420 8.846 0.574 1
1 851 . 3 1 1 A 68 68 ILE HA H 68 4.980 5.487 -0.507 1
1 861 . 3 1 1 A 68 68 ILE C C 68 175.000 174.467 0.533 1
1 862 . 3 1 1 A 68 68 ILE CA C 68 58.600 59.133 -0.533 1
1 863 . 3 1 1 A 68 68 ILE CB C 68 40.900 40.798 0.102 1
1 867 . 3 1 1 A 68 68 ILE N N 68 125.000 123.427 1.573 1
1 868 . 3 1 1 A 69 69 CYS H H 69 8.870 8.821 0.049 1
1 869 . 3 1 1 A 69 69 CYS HA H 69 4.610 4.967 -0.357 1
1 872 . 3 1 1 A 69 69 CYS C C 69 176.200 174.961 1.239 1
1 873 . 3 1 1 A 69 69 CYS CA C 69 58.900 58.071 0.829 1
1 874 . 3 1 1 A 69 69 CYS CB C 69 27.100 28.874 -1.774 1
1 875 . 3 1 1 A 69 69 CYS N N 69 122.300 123.894 -1.594 1
1 876 . 3 1 1 A 70 70 THR H H 70 8.270 8.537 -0.267 1
1 877 . 3 1 1 A 70 70 THR HA H 70 4.710 4.560 0.150 1
1 882 . 3 1 1 A 70 70 THR C C 70 173.600 173.891 -0.291 1
1 883 . 3 1 1 A 70 70 THR CA C 70 61.500 61.683 -0.183 1
1 884 . 3 1 1 A 70 70 THR CB C 70 68.100 69.312 -1.212 1
1 886 . 3 1 1 A 70 70 THR N N 70 116.700 119.450 -2.750 1
1 887 . 3 1 1 A 71 71 LYS H H 71 7.370 7.464 -0.094 1
1 888 . 3 1 1 A 71 71 LYS HA H 71 4.520 4.816 -0.296 1
1 897 . 3 1 1 A 71 71 LYS CA C 71 55.100 54.647 0.453 1
1 898 . 3 1 1 A 71 71 LYS CB C 71 37.800 34.418 3.382 1
1 902 . 3 1 1 A 71 71 LYS N N 71 120.900 122.961 -2.061 1
1 903 . 3 1 1 A 72 72 ASN H H 72 8.580 8.712 -0.132 1
1 904 . 3 1 1 A 72 72 ASN HA H 72 4.620 5.276 -0.656 1
1 909 . 3 1 1 A 72 72 ASN C C 72 173.500 174.234 -0.734 1
1 910 . 3 1 1 A 72 72 ASN CA C 72 52.200 52.405 -0.205 1
1 911 . 3 1 1 A 72 72 ASN CB C 72 38.500 39.546 -1.046 1
1 912 . 3 1 1 A 72 72 ASN N N 72 122.700 123.110 -0.410 1
1 914 . 3 1 1 A 73 73 LEU H H 73 8.100 9.551 -1.451 1
1 915 . 3 1 1 A 73 73 LEU HA H 73 4.680 4.742 -0.062 1
1 925 . 3 1 1 A 73 73 LEU CA C 73 51.000 50.912 0.088 1
1 926 . 3 1 1 A 73 73 LEU CB C 73 42.500 43.079 -0.579 1
1 930 . 3 1 1 A 73 73 LEU N N 73 125.100 125.754 -0.654 1
1 931 . 3 1 1 A 74 74 PRO HA H 74 4.670 4.804 -0.134 1
1 938 . 3 1 1 A 74 74 PRO C C 74 176.500 176.111 0.389 1
1 939 . 3 1 1 A 74 74 PRO CA C 74 61.800 62.741 -0.941 1
1 940 . 3 1 1 A 74 74 PRO CB C 74 32.800 32.578 0.222 1
1 943 . 3 1 1 A 75 75 LYS H H 75 8.280 8.427 -0.147 1
1 944 . 3 1 1 A 75 75 LYS HA H 75 4.110 4.470 -0.360 1
1 953 . 3 1 1 A 75 75 LYS CA C 75 56.500 55.414 1.086 1
1 954 . 3 1 1 A 75 75 LYS CB C 75 33.300 33.947 -0.647 1
1 958 . 3 1 1 A 75 75 LYS N N 75 117.000 121.620 -4.620 1
1 959 . 3 1 1 A 76 76 ASP H H 76 8.570 8.556 0.014 1
1 960 . 3 1 1 A 76 76 ASP HA H 76 4.530 4.736 -0.206 1
1 963 . 3 1 1 A 76 76 ASP C C 76 176.300 175.641 0.659 1
1 964 . 3 1 1 A 76 76 ASP CA C 76 55.000 52.941 2.059 1
1 965 . 3 1 1 A 76 76 ASP CB C 76 41.100 41.840 -0.740 1
1 966 . 3 1 1 A 76 76 ASP N N 76 122.700 122.615 0.085 1
1 967 . 3 1 1 A 77 77 SER H H 77 8.330 7.630 0.700 1
1 968 . 3 1 1 A 77 77 SER HA H 77 4.410 4.745 -0.335 1
1 971 . 3 1 1 A 77 77 SER C C 77 174.300 175.144 -0.844 1
1 972 . 3 1 1 A 77 77 SER CA C 77 58.000 55.765 2.235 1
1 973 . 3 1 1 A 77 77 SER CB C 77 63.900 64.363 -0.463 1
1 974 . 3 1 1 A 77 77 SER N N 77 116.100 116.004 0.096 1
1 975 . 3 1 1 A 78 78 LEU H H 78 8.350 9.027 -0.677 1
1 976 . 3 1 1 A 78 78 LEU HA H 78 4.280 4.194 0.086 1
1 986 . 3 1 1 A 78 78 LEU C C 78 177.200 177.646 -0.446 1
1 987 . 3 1 1 A 78 78 LEU CA C 78 55.200 56.805 -1.605 1
1 988 . 3 1 1 A 78 78 LEU CB C 78 42.100 41.635 0.465 1
1 992 . 3 1 1 A 78 78 LEU N N 78 124.300 129.923 -5.623 1
1 993 . 3 1 1 A 79 79 GLU H H 79 8.300 7.390 0.910 1
1 994 . 3 1 1 A 79 79 GLU CA C 79 56.400 56.470 -0.070 1
1 995 . 3 1 1 A 79 79 GLU CB C 79 30.200 29.346 0.854 1
1 1 . 4 1 1 A 2 2 HIS HA H 2 4.640 4.710 -0.070 1
1 4 . 4 1 1 A 2 2 HIS C C 2 173.600 173.969 -0.369 1
1 5 . 4 1 1 A 2 2 HIS CA C 2 56.500 55.617 0.883 1
1 6 . 4 1 1 A 2 2 HIS CB C 2 31.000 29.763 1.237 1
1 7 . 4 1 1 A 3 3 LYS H H 3 8.160 8.818 -0.658 1
1 8 . 4 1 1 A 3 3 LYS HA H 3 4.660 4.783 -0.123 1
1 17 . 4 1 1 A 3 3 LYS C C 3 174.400 174.823 -0.423 1
1 18 . 4 1 1 A 3 3 LYS CA C 3 54.800 54.362 0.438 1
1 19 . 4 1 1 A 3 3 LYS CB C 3 35.800 35.296 0.504 1
1 23 . 4 1 1 A 3 3 LYS N N 3 121.900 126.258 -4.358 1
1 24 . 4 1 1 A 4 4 ASP H H 4 8.470 9.075 -0.605 1
1 25 . 4 1 1 A 4 4 ASP HA H 4 4.900 5.212 -0.312 1
1 28 . 4 1 1 A 4 4 ASP C C 4 176.900 175.581 1.319 1
1 29 . 4 1 1 A 4 4 ASP CA C 4 52.700 52.376 0.324 1
1 30 . 4 1 1 A 4 4 ASP CB C 4 44.100 44.268 -0.168 1
1 31 . 4 1 1 A 4 4 ASP N N 4 117.900 121.020 -3.120 1
1 32 . 4 1 1 A 5 5 ILE H H 5 9.570 8.589 0.981 1
1 33 . 4 1 1 A 5 5 ILE HA H 5 3.640 4.073 -0.433 1
1 43 . 4 1 1 A 5 5 ILE C C 5 174.800 176.141 -1.341 1
1 44 . 4 1 1 A 5 5 ILE CA C 5 60.900 61.610 -0.710 1
1 45 . 4 1 1 A 5 5 ILE CB C 5 37.000 37.690 -0.690 1
1 49 . 4 1 1 A 5 5 ILE N N 5 124.400 123.983 0.417 1
1 50 . 4 1 1 A 6 6 PHE H H 6 7.790 8.805 -1.015 1
1 51 . 4 1 1 A 6 6 PHE HA H 6 3.160 4.498 -1.338 1
1 58 . 4 1 1 A 6 6 PHE C C 6 173.500 174.341 -0.841 1
1 59 . 4 1 1 A 6 6 PHE CA C 6 56.900 59.317 -2.417 1
1 60 . 4 1 1 A 6 6 PHE CB C 6 40.100 39.033 1.067 1
1 65 . 4 1 1 A 6 6 PHE N N 6 130.200 128.385 1.815 1
1 66 . 4 1 1 A 7 7 THR H H 7 6.790 8.424 -1.634 1
1 67 . 4 1 1 A 7 7 THR HA H 7 4.530 5.087 -0.557 1
1 72 . 4 1 1 A 7 7 THR C C 7 172.300 172.862 -0.562 1
1 73 . 4 1 1 A 7 7 THR CA C 7 59.200 60.566 -1.366 1
1 74 . 4 1 1 A 7 7 THR CB C 7 71.000 71.155 -0.155 1
1 76 . 4 1 1 A 7 7 THR N N 7 117.900 123.832 -5.932 1
1 77 . 4 1 1 A 8 8 SER H H 8 7.600 8.569 -0.969 1
1 78 . 4 1 1 A 8 8 SER HA H 8 4.180 4.835 -0.655 1
1 81 . 4 1 1 A 8 8 SER C C 8 175.300 172.391 2.909 1
1 82 . 4 1 1 A 8 8 SER CA C 8 55.800 57.082 -1.282 1
1 83 . 4 1 1 A 8 8 SER CB C 8 64.000 67.234 -3.234 1
1 84 . 4 1 1 A 8 8 SER N N 8 113.400 119.519 -6.119 1
1 85 . 4 1 1 A 9 9 VAL H H 9 8.880 8.788 0.092 1
1 86 . 4 1 1 A 9 9 VAL HA H 9 5.220 5.023 0.197 1
1 94 . 4 1 1 A 9 9 VAL C C 9 174.000 173.001 0.999 1
1 95 . 4 1 1 A 9 9 VAL CA C 9 59.100 59.939 -0.839 1
1 96 . 4 1 1 A 9 9 VAL CB C 9 36.500 35.005 1.495 1
1 99 . 4 1 1 A 9 9 VAL N N 9 114.700 121.456 -6.756 1
1 100 . 4 1 1 A 10 10 VAL H H 10 8.510 9.158 -0.648 1
1 101 . 4 1 1 A 10 10 VAL HA H 10 4.470 4.925 -0.455 1
1 109 . 4 1 1 A 10 10 VAL C C 10 173.700 174.886 -1.186 1
1 110 . 4 1 1 A 10 10 VAL CA C 10 59.400 59.624 -0.224 1
1 111 . 4 1 1 A 10 10 VAL CB C 10 36.000 34.895 1.105 1
1 114 . 4 1 1 A 10 10 VAL N N 10 117.100 127.962 -10.862 1
1 115 . 4 1 1 A 11 11 ARG H H 11 8.500 8.364 0.136 1
1 116 . 4 1 1 A 11 11 ARG HA H 11 4.460 4.624 -0.164 1
1 123 . 4 1 1 A 11 11 ARG C C 11 174.500 176.120 -1.620 1
1 124 . 4 1 1 A 11 11 ARG CA C 11 57.400 56.153 1.247 1
1 125 . 4 1 1 A 11 11 ARG CB C 11 31.000 31.038 -0.038 1
1 128 . 4 1 1 A 11 11 ARG N N 11 124.800 126.297 -1.497 1
1 129 . 4 1 1 A 12 12 VAL H H 12 7.650 9.019 -1.369 1
1 130 . 4 1 1 A 12 12 VAL HA H 12 4.970 4.592 0.378 1
1 138 . 4 1 1 A 12 12 VAL C C 12 176.700 174.703 1.997 1
1 139 . 4 1 1 A 12 12 VAL CA C 12 59.400 61.788 -2.388 1
1 140 . 4 1 1 A 12 12 VAL CB C 12 34.400 32.105 2.295 1
1 143 . 4 1 1 A 12 12 VAL N N 12 120.900 124.888 -3.988 1
1 144 . 4 1 1 A 13 13 ARG H H 13 9.020 9.089 -0.069 1
1 145 . 4 1 1 A 13 13 ARG HA H 13 4.700 5.105 -0.405 1
1 152 . 4 1 1 A 13 13 ARG C C 13 176.000 174.950 1.050 1
1 153 . 4 1 1 A 13 13 ARG CA C 13 54.600 54.708 -0.108 1
1 154 . 4 1 1 A 13 13 ARG CB C 13 32.900 32.515 0.385 1
1 157 . 4 1 1 A 13 13 ARG N N 13 127.500 128.420 -0.920 1
1 158 . 4 1 1 A 14 14 GLY H H 14 8.640 8.324 0.316 1
1 159 . 4 1 1 A 14 14 GLY HA2 H 14 3.680 4.192 -0.512 1
1 160 . 4 1 1 A 14 14 GLY HA3 H 14 4.190 4.202 -0.012 1
1 161 . 4 1 1 A 14 14 GLY C C 14 173.700 172.502 1.198 1
1 162 . 4 1 1 A 14 14 GLY CA C 14 45.600 44.436 1.164 1
1 163 . 4 1 1 A 14 14 GLY N N 14 108.800 113.319 -4.519 1
1 164 . 4 1 1 A 15 15 SER H H 15 8.220 8.547 -0.327 1
1 165 . 4 1 1 A 15 15 SER HA H 15 5.020 4.784 0.236 1
1 168 . 4 1 1 A 15 15 SER C C 15 175.400 174.108 1.292 1
1 169 . 4 1 1 A 15 15 SER CA C 15 55.300 59.334 -4.034 1
1 170 . 4 1 1 A 15 15 SER CB C 15 64.900 62.474 2.426 1
1 171 . 4 1 1 A 15 15 SER N N 15 113.200 117.507 -4.307 1
1 172 . 4 1 1 A 16 16 LYS H H 16 9.930 7.919 2.011 1
1 173 . 4 1 1 A 16 16 LYS HA H 16 4.190 4.960 -0.770 1
1 182 . 4 1 1 A 16 16 LYS C C 16 176.500 176.230 0.270 1
1 183 . 4 1 1 A 16 16 LYS CA C 16 57.300 54.187 3.113 1
1 184 . 4 1 1 A 16 16 LYS CB C 16 32.300 35.892 -3.592 1
1 188 . 4 1 1 A 16 16 LYS N N 16 129.200 124.298 4.902 1
1 189 . 4 1 1 A 17 17 LYS H H 17 7.960 8.380 -0.420 1
1 190 . 4 1 1 A 17 17 LYS HA H 17 4.030 4.472 -0.442 1
1 199 . 4 1 1 A 17 17 LYS C C 17 175.600 176.006 -0.406 1
1 200 . 4 1 1 A 17 17 LYS CA C 17 56.900 57.413 -0.513 1
1 201 . 4 1 1 A 17 17 LYS CB C 17 34.700 34.516 0.184 1
1 205 . 4 1 1 A 17 17 LYS N N 17 118.500 119.461 -0.961 1
1 206 . 4 1 1 A 18 18 TYR H H 18 7.780 7.643 0.137 1
1 207 . 4 1 1 A 18 18 TYR HA H 18 4.760 4.740 0.020 1
1 214 . 4 1 1 A 18 18 TYR C C 18 174.000 176.418 -2.418 1
1 215 . 4 1 1 A 18 18 TYR CA C 18 56.800 58.125 -1.325 1
1 216 . 4 1 1 A 18 18 TYR CB C 18 41.100 40.121 0.979 1
1 221 . 4 1 1 A 18 18 TYR N N 18 117.100 117.978 -0.878 1
1 222 . 4 1 1 A 19 19 ASN H H 19 8.890 8.945 -0.055 1
1 223 . 4 1 1 A 19 19 ASN HA H 19 4.960 4.664 0.296 1
1 228 . 4 1 1 A 19 19 ASN C C 19 176.100 175.458 0.642 1
1 229 . 4 1 1 A 19 19 ASN CA C 19 53.600 55.159 -1.559 1
1 230 . 4 1 1 A 19 19 ASN CB C 19 40.300 39.323 0.977 1
1 231 . 4 1 1 A 19 19 ASN N N 19 116.600 123.182 -6.582 1
1 233 . 4 1 1 A 20 20 VAL H H 20 7.730 7.580 0.150 1
1 234 . 4 1 1 A 20 20 VAL HA H 20 5.250 5.090 0.160 1
1 242 . 4 1 1 A 20 20 VAL C C 20 173.800 174.210 -0.410 1
1 243 . 4 1 1 A 20 20 VAL CA C 20 59.400 59.465 -0.065 1
1 244 . 4 1 1 A 20 20 VAL CB C 20 37.600 35.317 2.283 1
1 247 . 4 1 1 A 20 20 VAL N N 20 113.900 114.732 -0.832 1
1 248 . 4 1 1 A 21 21 VAL H H 21 8.890 9.163 -0.273 1
1 249 . 4 1 1 A 21 21 VAL HA H 21 4.840 4.807 0.033 1
1 257 . 4 1 1 A 21 21 VAL CA C 21 56.800 58.267 -1.467 1
1 258 . 4 1 1 A 21 21 VAL CB C 21 36.000 34.840 1.160 1
1 261 . 4 1 1 A 21 21 VAL N N 21 118.500 122.395 -3.895 1
1 262 . 4 1 1 A 22 22 PRO HA H 22 4.940 4.968 -0.028 1
1 269 . 4 1 1 A 22 22 PRO C C 22 175.600 176.466 -0.866 1
1 270 . 4 1 1 A 22 22 PRO CA C 22 62.700 63.108 -0.408 1
1 271 . 4 1 1 A 22 22 PRO CB C 22 31.800 31.915 -0.115 1
1 274 . 4 1 1 A 23 23 VAL H H 23 8.060 8.654 -0.594 1
1 275 . 4 1 1 A 23 23 VAL HA H 23 5.390 5.032 0.358 1
1 283 . 4 1 1 A 23 23 VAL C C 23 175.400 174.253 1.147 1
1 284 . 4 1 1 A 23 23 VAL CA C 23 57.800 59.147 -1.347 1
1 285 . 4 1 1 A 23 23 VAL CB C 23 36.300 34.837 1.463 1
1 288 . 4 1 1 A 23 23 VAL N N 23 110.900 116.535 -5.635 1
1 289 . 4 1 1 A 24 24 LYS H H 24 8.960 9.245 -0.285 1
1 290 . 4 1 1 A 24 24 LYS HA H 24 5.600 5.300 0.300 1
1 299 . 4 1 1 A 24 24 LYS C C 24 175.600 173.920 1.680 1
1 300 . 4 1 1 A 24 24 LYS CA C 24 54.200 54.147 0.053 1
1 301 . 4 1 1 A 24 24 LYS CB C 24 37.000 36.274 0.726 1
1 305 . 4 1 1 A 24 24 LYS N N 24 117.900 120.899 -2.999 1
1 306 . 4 1 1 A 25 25 SER H H 25 8.950 8.344 0.606 1
1 307 . 4 1 1 A 25 25 SER HA H 25 5.190 4.954 0.236 1
1 310 . 4 1 1 A 25 25 SER C C 25 173.800 175.592 -1.792 1
1 311 . 4 1 1 A 25 25 SER CA C 25 57.700 55.925 1.775 1
1 312 . 4 1 1 A 25 25 SER CB C 25 65.100 64.936 0.164 1
1 313 . 4 1 1 A 25 25 SER N N 25 114.600 114.778 -0.178 1
1 314 . 4 1 1 A 26 26 ASN H H 26 9.020 8.903 0.117 1
1 315 . 4 1 1 A 26 26 ASN HA H 26 4.370 4.621 -0.251 1
1 320 . 4 1 1 A 26 26 ASN C C 26 173.500 174.407 -0.907 1
1 321 . 4 1 1 A 26 26 ASN CA C 26 53.700 53.576 0.124 1
1 322 . 4 1 1 A 26 26 ASN CB C 26 37.100 38.662 -1.562 1
1 323 . 4 1 1 A 26 26 ASN N N 26 118.300 122.473 -4.173 1
1 325 . 4 1 1 A 27 27 LYS H H 27 7.400 7.154 0.246 1
1 326 . 4 1 1 A 27 27 LYS HA H 27 4.780 4.676 0.104 1
1 335 . 4 1 1 A 27 27 LYS CA C 27 53.500 53.016 0.484 1
1 336 . 4 1 1 A 27 27 LYS CB C 27 34.100 33.509 0.591 1
1 340 . 4 1 1 A 27 27 LYS N N 27 116.600 118.576 -1.976 1
1 341 . 4 1 1 A 28 28 PRO HA H 28 4.040 4.592 -0.552 1
1 348 . 4 1 1 A 28 28 PRO C C 28 174.500 176.400 -1.900 1
1 349 . 4 1 1 A 28 28 PRO CA C 28 63.200 62.966 0.234 1
1 350 . 4 1 1 A 28 28 PRO CB C 28 32.500 32.002 0.498 1
1 353 . 4 1 1 A 29 29 VAL H H 29 8.860 8.317 0.543 1
1 354 . 4 1 1 A 29 29 VAL HA H 29 4.420 4.883 -0.463 1
1 362 . 4 1 1 A 29 29 VAL C C 29 174.800 175.376 -0.576 1
1 363 . 4 1 1 A 29 29 VAL CA C 29 60.300 59.357 0.943 1
1 364 . 4 1 1 A 29 29 VAL CB C 29 36.400 35.152 1.248 1
1 367 . 4 1 1 A 29 29 VAL N N 29 119.800 116.631 3.169 1
1 368 . 4 1 1 A 30 30 GLU H H 30 9.550 8.780 0.770 1
1 369 . 4 1 1 A 30 30 GLU HA H 30 4.260 4.319 -0.059 1
1 374 . 4 1 1 A 30 30 GLU C C 30 177.800 177.539 0.261 1
1 375 . 4 1 1 A 30 30 GLU CA C 30 58.000 57.070 0.930 1
1 376 . 4 1 1 A 30 30 GLU CB C 30 29.700 30.101 -0.401 1
1 378 . 4 1 1 A 30 30 GLU N N 30 128.900 121.163 7.737 1
1 379 . 4 1 1 A 31 31 ILE H H 31 7.910 8.859 -0.949 1
1 380 . 4 1 1 A 31 31 ILE HA H 31 2.120 4.134 -2.014 1
1 390 . 4 1 1 A 31 31 ILE C C 31 178.000 177.310 0.690 1
1 391 . 4 1 1 A 31 31 ILE CA C 31 63.500 63.229 0.271 1
1 392 . 4 1 1 A 31 31 ILE CB C 31 37.200 38.269 -1.069 1
1 396 . 4 1 1 A 31 31 ILE N N 31 122.500 127.302 -4.802 1
1 397 . 4 1 1 A 32 32 SER H H 32 7.940 8.072 -0.132 1
1 398 . 4 1 1 A 32 32 SER HA H 32 4.070 4.700 -0.630 1
1 401 . 4 1 1 A 32 32 SER C C 32 175.800 175.265 0.535 1
1 402 . 4 1 1 A 32 32 SER CA C 32 60.200 60.017 0.183 1
1 403 . 4 1 1 A 32 32 SER CB C 32 62.100 63.625 -1.525 1
1 404 . 4 1 1 A 32 32 SER N N 32 115.300 116.275 -0.975 1
1 405 . 4 1 1 A 33 33 LYS H H 33 7.640 8.025 -0.385 1
1 406 . 4 1 1 A 33 33 LYS HA H 33 4.400 4.453 -0.053 1
1 415 . 4 1 1 A 33 33 LYS C C 33 176.600 177.790 -1.190 1
1 416 . 4 1 1 A 33 33 LYS CA C 33 56.200 56.301 -0.101 1
1 417 . 4 1 1 A 33 33 LYS CB C 33 32.700 32.599 0.101 1
1 421 . 4 1 1 A 33 33 LYS N N 33 119.800 119.367 0.433 1
1 422 . 4 1 1 A 34 34 TRP H H 34 7.860 8.076 -0.216 1
1 423 . 4 1 1 A 34 34 TRP HA H 34 3.870 4.692 -0.822 1
1 426 . 4 1 1 A 34 34 TRP C C 34 178.600 178.031 0.569 1
1 427 . 4 1 1 A 34 34 TRP CA C 34 60.200 60.219 -0.019 1
1 428 . 4 1 1 A 34 34 TRP CB C 34 28.500 28.371 0.129 1
1 429 . 4 1 1 A 34 34 TRP N N 34 120.000 121.395 -1.395 1
1 430 . 4 1 1 A 35 35 ILE H H 35 8.200 7.211 0.989 1
1 431 . 4 1 1 A 35 35 ILE HA H 35 3.990 3.186 0.804 1
1 441 . 4 1 1 A 35 35 ILE C C 35 177.900 177.579 0.321 1
1 442 . 4 1 1 A 35 35 ILE CA C 35 64.300 64.061 0.239 1
1 443 . 4 1 1 A 35 35 ILE CB C 35 37.200 37.112 0.088 1
1 447 . 4 1 1 A 35 35 ILE N N 35 119.500 117.467 2.033 1
1 448 . 4 1 1 A 36 36 ASP H H 36 7.680 7.645 0.035 1
1 449 . 4 1 1 A 36 36 ASP HA H 36 4.490 4.213 0.277 1
1 452 . 4 1 1 A 36 36 ASP C C 36 179.200 178.976 0.224 1
1 453 . 4 1 1 A 36 36 ASP CA C 36 57.500 56.890 0.610 1
1 454 . 4 1 1 A 36 36 ASP CB C 36 40.400 40.567 -0.167 1
1 455 . 4 1 1 A 36 36 ASP N N 36 122.000 121.995 0.005 1
1 456 . 4 1 1 A 37 37 PHE H H 37 8.450 7.921 0.529 1
1 457 . 4 1 1 A 37 37 PHE HA H 37 4.080 4.097 -0.017 1
1 465 . 4 1 1 A 37 37 PHE C C 37 178.300 178.723 -0.423 1
1 466 . 4 1 1 A 37 37 PHE CA C 37 58.600 60.368 -1.768 1
1 467 . 4 1 1 A 37 37 PHE CB C 37 37.000 37.637 -0.637 1
1 473 . 4 1 1 A 37 37 PHE N N 37 119.800 119.543 0.257 1
1 474 . 4 1 1 A 38 38 SER H H 38 8.580 8.270 0.310 1
1 475 . 4 1 1 A 38 38 SER HA H 38 4.250 4.383 -0.133 1
1 478 . 4 1 1 A 38 38 SER C C 38 176.800 176.181 0.619 1
1 479 . 4 1 1 A 38 38 SER CA C 38 62.700 62.028 0.672 1
1 480 . 4 1 1 A 38 38 SER CB C 38 62.700 63.075 -0.375 1
1 481 . 4 1 1 A 38 38 SER N N 38 115.800 115.489 0.311 1
1 482 . 4 1 1 A 39 39 ASN H H 39 8.190 7.779 0.411 1
1 483 . 4 1 1 A 39 39 ASN HA H 39 4.540 4.376 0.164 1
1 488 . 4 1 1 A 39 39 ASN C C 39 178.500 177.809 0.691 1
1 489 . 4 1 1 A 39 39 ASN CA C 39 56.200 56.816 -0.616 1
1 490 . 4 1 1 A 39 39 ASN CB C 39 37.900 39.227 -1.327 1
1 491 . 4 1 1 A 39 39 ASN N N 39 121.300 120.047 1.253 1
1 493 . 4 1 1 A 40 40 VAL H H 40 7.840 7.569 0.271 1
1 494 . 4 1 1 A 40 40 VAL HA H 40 3.650 3.564 0.086 1
1 502 . 4 1 1 A 40 40 VAL C C 40 179.000 178.026 0.974 1
1 503 . 4 1 1 A 40 40 VAL CA C 40 66.600 66.298 0.302 1
1 504 . 4 1 1 A 40 40 VAL CB C 40 32.100 31.442 0.658 1
1 507 . 4 1 1 A 40 40 VAL N N 40 121.800 118.706 3.094 1
1 508 . 4 1 1 A 41 41 LEU H H 41 8.210 8.282 -0.072 1
1 509 . 4 1 1 A 41 41 LEU HA H 41 3.840 3.937 -0.097 1
1 519 . 4 1 1 A 41 41 LEU C C 41 178.800 179.446 -0.646 1
1 520 . 4 1 1 A 41 41 LEU CA C 41 57.400 57.876 -0.476 1
1 521 . 4 1 1 A 41 41 LEU CB C 41 41.200 40.960 0.240 1
1 525 . 4 1 1 A 41 41 LEU N N 41 117.700 120.024 -2.324 1
1 526 . 4 1 1 A 42 42 SER H H 42 7.980 8.181 -0.201 1
1 527 . 4 1 1 A 42 42 SER HA H 42 4.260 4.176 0.084 1
1 530 . 4 1 1 A 42 42 SER C C 42 174.900 176.015 -1.115 1
1 531 . 4 1 1 A 42 42 SER CA C 42 61.200 60.953 0.247 1
1 532 . 4 1 1 A 42 42 SER CB C 42 63.100 62.863 0.237 1
1 533 . 4 1 1 A 42 42 SER N N 42 113.200 114.264 -1.064 1
1 534 . 4 1 1 A 43 43 ARG H H 43 7.100 7.925 -0.825 1
1 535 . 4 1 1 A 43 43 ARG HA H 43 4.500 4.498 0.002 1
1 542 . 4 1 1 A 43 43 ARG C C 43 175.800 175.933 -0.133 1
1 543 . 4 1 1 A 43 43 ARG CA C 43 55.600 56.241 -0.641 1
1 544 . 4 1 1 A 43 43 ARG CB C 43 30.800 30.743 0.057 1
1 547 . 4 1 1 A 43 43 ARG N N 43 118.400 121.277 -2.877 1
1 548 . 4 1 1 A 44 44 LEU H H 44 7.610 7.165 0.445 1
1 549 . 4 1 1 A 44 44 LEU HA H 44 4.590 4.617 -0.027 1
1 559 . 4 1 1 A 44 44 LEU C C 44 175.300 174.157 1.143 1
1 560 . 4 1 1 A 44 44 LEU CA C 44 53.900 53.604 0.296 1
1 561 . 4 1 1 A 44 44 LEU CB C 44 44.100 43.102 0.998 1
1 565 . 4 1 1 A 44 44 LEU N N 44 120.400 120.942 -0.542 1
1 566 . 4 1 1 A 45 45 TYR H H 45 7.630 8.987 -1.357 1
1 567 . 4 1 1 A 45 45 TYR HA H 45 5.180 5.032 0.148 1
1 574 . 4 1 1 A 45 45 TYR C C 45 174.600 175.440 -0.840 1
1 575 . 4 1 1 A 45 45 TYR CA C 45 56.300 56.972 -0.672 1
1 576 . 4 1 1 A 45 45 TYR CB C 45 41.400 38.021 3.379 1
1 581 . 4 1 1 A 45 45 TYR N N 45 115.300 127.254 -11.954 1
1 582 . 4 1 1 A 46 46 VAL H H 46 8.770 8.699 0.071 1
1 583 . 4 1 1 A 46 46 VAL HA H 46 4.540 4.766 -0.226 1
1 591 . 4 1 1 A 46 46 VAL C C 46 174.600 174.369 0.231 1
1 592 . 4 1 1 A 46 46 VAL CA C 46 59.600 59.875 -0.275 1
1 593 . 4 1 1 A 46 46 VAL CB C 46 34.700 34.854 -0.154 1
1 596 . 4 1 1 A 46 46 VAL N N 46 115.400 118.817 -3.417 1
1 597 . 4 1 1 A 47 47 GLY H H 47 8.280 8.319 -0.039 1
1 598 . 4 1 1 A 47 47 GLY HA2 H 47 3.610 4.117 -0.507 1
1 599 . 4 1 1 A 47 47 GLY HA3 H 47 4.970 4.128 0.842 1
1 600 . 4 1 1 A 47 47 GLY C C 47 173.100 173.831 -0.731 1
1 601 . 4 1 1 A 47 47 GLY CA C 47 43.600 45.750 -2.150 1
1 602 . 4 1 1 A 47 47 GLY N N 47 109.900 108.601 1.299 1
1 603 . 4 1 1 A 48 48 VAL H H 48 7.630 8.275 -0.645 1
1 604 . 4 1 1 A 48 48 VAL HA H 48 4.320 3.985 0.335 1
1 612 . 4 1 1 A 48 48 VAL CA C 48 58.700 62.794 -4.094 1
1 613 . 4 1 1 A 48 48 VAL CB C 48 32.100 30.792 1.308 1
1 616 . 4 1 1 A 48 48 VAL N N 48 109.900 117.767 -7.867 1
1 617 . 4 1 1 A 49 49 PRO HA H 49 4.800 4.390 0.410 1
1 624 . 4 1 1 A 49 49 PRO C C 49 176.700 176.210 0.490 1
1 625 . 4 1 1 A 49 49 PRO CA C 49 62.300 63.270 -0.970 1
1 626 . 4 1 1 A 49 49 PRO CB C 49 35.400 31.694 3.706 1
1 629 . 4 1 1 A 50 50 THR H H 50 8.790 8.440 0.350 1
1 630 . 4 1 1 A 50 50 THR HA H 50 4.690 5.196 -0.506 1
1 635 . 4 1 1 A 50 50 THR C C 50 173.500 173.025 0.475 1
1 636 . 4 1 1 A 50 50 THR CA C 50 60.800 59.561 1.239 1
1 637 . 4 1 1 A 50 50 THR CB C 50 70.800 72.419 -1.619 1
1 639 . 4 1 1 A 50 50 THR N N 50 113.500 112.588 0.912 1
1 640 . 4 1 1 A 51 51 LYS H H 51 7.810 8.484 -0.674 1
1 641 . 4 1 1 A 51 51 LYS HA H 51 4.890 4.780 0.110 1
1 650 . 4 1 1 A 51 51 LYS C C 51 175.900 176.320 -0.420 1
1 651 . 4 1 1 A 51 51 LYS CA C 51 54.100 54.289 -0.189 1
1 652 . 4 1 1 A 51 51 LYS CB C 51 35.300 35.630 -0.330 1
1 656 . 4 1 1 A 51 51 LYS N N 51 122.200 120.003 2.197 1
1 657 . 4 1 1 A 52 52 SER H H 52 8.410 8.538 -0.128 1
1 658 . 4 1 1 A 52 52 SER HA H 52 3.630 4.130 -0.500 1
1 661 . 4 1 1 A 52 52 SER C C 52 175.800 175.455 0.345 1
1 662 . 4 1 1 A 52 52 SER CA C 52 58.800 60.496 -1.696 1
1 663 . 4 1 1 A 52 52 SER CB C 52 62.600 62.600 0.000 1
1 664 . 4 1 1 A 52 52 SER N N 52 118.900 116.590 2.310 1
1 665 . 4 1 1 A 53 53 GLY H H 53 9.070 9.149 -0.079 1
1 666 . 4 1 1 A 53 53 GLY HA2 H 53 3.390 3.905 -0.515 1
1 667 . 4 1 1 A 53 53 GLY HA3 H 53 4.460 3.906 0.554 1
1 668 . 4 1 1 A 53 53 GLY C C 53 174.100 174.386 -0.286 1
1 669 . 4 1 1 A 53 53 GLY CA C 53 44.800 45.446 -0.646 1
1 670 . 4 1 1 A 53 53 GLY N N 53 115.600 113.829 1.771 1
1 671 . 4 1 1 A 54 54 ASN H H 54 7.870 7.815 0.055 1
1 672 . 4 1 1 A 54 54 ASN HA H 54 4.570 4.818 -0.248 1
1 677 . 4 1 1 A 54 54 ASN C C 54 175.500 174.806 0.694 1
1 678 . 4 1 1 A 54 54 ASN CA C 54 53.000 52.795 0.205 1
1 679 . 4 1 1 A 54 54 ASN CB C 54 38.600 39.169 -0.569 1
1 680 . 4 1 1 A 54 54 ASN N N 54 119.600 119.467 0.133 1
1 682 . 4 1 1 A 55 55 VAL H H 55 8.770 8.896 -0.126 1
1 683 . 4 1 1 A 55 55 VAL HA H 55 3.880 4.227 -0.347 1
1 691 . 4 1 1 A 55 55 VAL C C 55 176.200 176.846 -0.646 1
1 692 . 4 1 1 A 55 55 VAL CA C 55 63.700 63.079 0.621 1
1 693 . 4 1 1 A 55 55 VAL CB C 55 31.600 31.631 -0.031 1
1 696 . 4 1 1 A 55 55 VAL N N 55 123.900 123.578 0.322 1
1 697 . 4 1 1 A 56 56 VAL H H 56 9.050 8.840 0.210 1
1 698 . 4 1 1 A 56 56 VAL HA H 56 3.990 4.278 -0.288 1
1 706 . 4 1 1 A 56 56 VAL C C 56 175.200 175.413 -0.213 1
1 707 . 4 1 1 A 56 56 VAL CA C 56 62.700 63.068 -0.368 1
1 708 . 4 1 1 A 56 56 VAL CB C 56 32.900 32.202 0.698 1
1 711 . 4 1 1 A 56 56 VAL N N 56 127.500 122.520 4.980 1
1 712 . 4 1 1 A 57 57 CYS H H 57 7.250 7.992 -0.742 1
1 713 . 4 1 1 A 57 57 CYS HA H 57 4.370 5.085 -0.715 1
1 716 . 4 1 1 A 57 57 CYS C C 57 171.900 172.570 -0.670 1
1 717 . 4 1 1 A 57 57 CYS CA C 57 58.600 57.549 1.051 1
1 718 . 4 1 1 A 57 57 CYS CB C 57 28.600 30.009 -1.409 1
1 719 . 4 1 1 A 57 57 CYS N N 57 117.600 119.241 -1.641 1
1 720 . 4 1 1 A 58 58 LYS H H 58 8.880 8.767 0.113 1
1 721 . 4 1 1 A 58 58 LYS HA H 58 4.220 4.630 -0.410 1
1 730 . 4 1 1 A 58 58 LYS C C 58 176.000 176.391 -0.391 1
1 731 . 4 1 1 A 58 58 LYS CA C 58 54.400 55.199 -0.799 1
1 732 . 4 1 1 A 58 58 LYS CB C 58 33.600 34.346 -0.746 1
1 736 . 4 1 1 A 58 58 LYS N N 58 132.000 126.815 5.185 1
1 737 . 4 1 1 A 59 59 ASN H H 59 9.500 9.158 0.342 1
1 738 . 4 1 1 A 59 59 ASN HA H 59 4.040 4.320 -0.280 1
1 743 . 4 1 1 A 59 59 ASN C C 59 176.400 175.263 1.137 1
1 744 . 4 1 1 A 59 59 ASN CA C 59 53.200 54.119 -0.919 1
1 745 . 4 1 1 A 59 59 ASN CB C 59 35.900 37.424 -1.524 1
1 746 . 4 1 1 A 59 59 ASN N N 59 127.500 123.924 3.576 1
1 748 . 4 1 1 A 60 60 ILE H H 60 8.050 7.430 0.620 1
1 749 . 4 1 1 A 60 60 ILE HA H 60 3.680 3.734 -0.054 1
1 759 . 4 1 1 A 60 60 ILE C C 60 175.700 176.862 -1.162 1
1 760 . 4 1 1 A 60 60 ILE CA C 60 61.900 62.304 -0.404 1
1 761 . 4 1 1 A 60 60 ILE CB C 60 38.300 37.794 0.506 1
1 765 . 4 1 1 A 60 60 ILE N N 60 120.200 119.992 0.208 1
1 766 . 4 1 1 A 61 61 MET H H 61 9.590 9.301 0.289 1
1 767 . 4 1 1 A 61 61 MET HA H 61 3.920 4.095 -0.175 1
1 775 . 4 1 1 A 61 61 MET C C 61 174.300 175.434 -1.134 1
1 776 . 4 1 1 A 61 61 MET CA C 61 57.000 56.836 0.164 1
1 777 . 4 1 1 A 61 61 MET CB C 61 31.300 30.978 0.322 1
1 780 . 4 1 1 A 61 61 MET N N 61 124.400 125.885 -1.485 1
1 781 . 4 1 1 A 62 62 ASN H H 62 8.250 8.498 -0.248 1
1 782 . 4 1 1 A 62 62 ASN HA H 62 4.400 4.469 -0.069 1
1 787 . 4 1 1 A 62 62 ASN C C 62 176.800 175.445 1.355 1
1 788 . 4 1 1 A 62 62 ASN CA C 62 54.400 54.585 -0.185 1
1 789 . 4 1 1 A 62 62 ASN CB C 62 37.600 36.959 0.641 1
1 790 . 4 1 1 A 62 62 ASN N N 62 111.900 109.882 2.018 1
1 792 . 4 1 1 A 63 63 THR H H 63 7.480 7.887 -0.407 1
1 793 . 4 1 1 A 63 63 THR HA H 63 4.210 4.334 -0.124 1
1 798 . 4 1 1 A 63 63 THR C C 63 177.100 176.247 0.853 1
1 799 . 4 1 1 A 63 63 THR CA C 63 62.900 62.876 0.024 1
1 800 . 4 1 1 A 63 63 THR CB C 63 72.500 70.541 1.959 1
1 802 . 4 1 1 A 63 63 THR N N 63 105.900 111.093 -5.193 1
1 803 . 4 1 1 A 64 64 GLY H H 64 9.110 8.507 0.603 1
1 804 . 4 1 1 A 64 64 GLY HA2 H 64 3.580 3.955 -0.375 1
1 805 . 4 1 1 A 64 64 GLY HA3 H 64 4.090 3.956 0.134 1
1 806 . 4 1 1 A 64 64 GLY C C 64 173.200 174.358 -1.158 1
1 807 . 4 1 1 A 64 64 GLY CA C 64 45.300 45.583 -0.283 1
1 808 . 4 1 1 A 64 64 GLY N N 64 111.500 111.676 -0.176 1
1 809 . 4 1 1 A 65 65 VAL H H 65 7.580 7.602 -0.022 1
1 810 . 4 1 1 A 65 65 VAL HA H 65 4.060 4.337 -0.277 1
1 818 . 4 1 1 A 65 65 VAL C C 65 172.900 174.387 -1.487 1
1 819 . 4 1 1 A 65 65 VAL CA C 65 61.400 61.591 -0.191 1
1 820 . 4 1 1 A 65 65 VAL CB C 65 32.900 33.696 -0.796 1
1 823 . 4 1 1 A 65 65 VAL N N 65 121.600 122.257 -0.657 1
1 824 . 4 1 1 A 66 66 ASP H H 66 8.210 8.975 -0.765 1
1 825 . 4 1 1 A 66 66 ASP HA H 66 5.320 5.501 -0.181 1
1 828 . 4 1 1 A 66 66 ASP C C 66 174.800 175.181 -0.381 1
1 829 . 4 1 1 A 66 66 ASP CA C 66 51.700 52.607 -0.907 1
1 830 . 4 1 1 A 66 66 ASP CB C 66 43.200 41.962 1.238 1
1 831 . 4 1 1 A 66 66 ASP N N 66 123.100 126.421 -3.321 1
1 832 . 4 1 1 A 67 67 ILE H H 67 8.540 8.861 -0.321 1
1 833 . 4 1 1 A 67 67 ILE HA H 67 4.630 4.458 0.172 1
1 843 . 4 1 1 A 67 67 ILE C C 67 175.600 175.934 -0.334 1
1 844 . 4 1 1 A 67 67 ILE CA C 67 56.900 61.012 -4.112 1
1 845 . 4 1 1 A 67 67 ILE CB C 67 35.300 37.749 -2.449 1
1 849 . 4 1 1 A 67 67 ILE N N 67 119.200 124.784 -5.584 1
1 850 . 4 1 1 A 68 68 ILE H H 68 9.420 9.013 0.407 1
1 851 . 4 1 1 A 68 68 ILE HA H 68 4.980 5.498 -0.518 1
1 861 . 4 1 1 A 68 68 ILE C C 68 175.000 174.430 0.570 1
1 862 . 4 1 1 A 68 68 ILE CA C 68 58.600 59.033 -0.433 1
1 863 . 4 1 1 A 68 68 ILE CB C 68 40.900 41.005 -0.105 1
1 867 . 4 1 1 A 68 68 ILE N N 68 125.000 123.340 1.660 1
1 868 . 4 1 1 A 69 69 CYS H H 69 8.870 8.909 -0.039 1
1 869 . 4 1 1 A 69 69 CYS HA H 69 4.610 4.886 -0.276 1
1 872 . 4 1 1 A 69 69 CYS C C 69 176.200 174.997 1.203 1
1 873 . 4 1 1 A 69 69 CYS CA C 69 58.900 58.167 0.733 1
1 874 . 4 1 1 A 69 69 CYS CB C 69 27.100 29.037 -1.937 1
1 875 . 4 1 1 A 69 69 CYS N N 69 122.300 123.739 -1.439 1
1 876 . 4 1 1 A 70 70 THR H H 70 8.270 8.554 -0.284 1
1 877 . 4 1 1 A 70 70 THR HA H 70 4.710 4.520 0.190 1
1 882 . 4 1 1 A 70 70 THR C C 70 173.600 174.289 -0.689 1
1 883 . 4 1 1 A 70 70 THR CA C 70 61.500 61.927 -0.427 1
1 884 . 4 1 1 A 70 70 THR CB C 70 68.100 69.629 -1.529 1
1 886 . 4 1 1 A 70 70 THR N N 70 116.700 119.224 -2.524 1
1 887 . 4 1 1 A 71 71 LYS H H 71 7.370 7.398 -0.028 1
1 888 . 4 1 1 A 71 71 LYS HA H 71 4.520 4.656 -0.136 1
1 897 . 4 1 1 A 71 71 LYS CA C 71 55.100 55.139 -0.039 1
1 898 . 4 1 1 A 71 71 LYS CB C 71 37.800 34.091 3.709 1
1 902 . 4 1 1 A 71 71 LYS N N 71 120.900 123.002 -2.102 1
1 903 . 4 1 1 A 72 72 ASN H H 72 8.580 8.593 -0.013 1
1 904 . 4 1 1 A 72 72 ASN HA H 72 4.620 5.229 -0.609 1
1 909 . 4 1 1 A 72 72 ASN C C 72 173.500 174.502 -1.002 1
1 910 . 4 1 1 A 72 72 ASN CA C 72 52.200 52.897 -0.697 1
1 911 . 4 1 1 A 72 72 ASN CB C 72 38.500 39.222 -0.722 1
1 912 . 4 1 1 A 72 72 ASN N N 72 122.700 124.126 -1.426 1
1 914 . 4 1 1 A 73 73 LEU H H 73 8.100 9.122 -1.022 1
1 915 . 4 1 1 A 73 73 LEU HA H 73 4.680 4.610 0.070 1
1 925 . 4 1 1 A 73 73 LEU CA C 73 51.000 51.203 -0.203 1
1 926 . 4 1 1 A 73 73 LEU CB C 73 42.500 42.319 0.181 1
1 930 . 4 1 1 A 73 73 LEU N N 73 125.100 126.855 -1.755 1
1 931 . 4 1 1 A 74 74 PRO HA H 74 4.670 4.537 0.133 1
1 938 . 4 1 1 A 74 74 PRO C C 74 176.500 175.923 0.577 1
1 939 . 4 1 1 A 74 74 PRO CA C 74 61.800 63.139 -1.339 1
1 940 . 4 1 1 A 74 74 PRO CB C 74 32.800 32.195 0.605 1
1 943 . 4 1 1 A 75 75 LYS H H 75 8.280 8.547 -0.267 1
1 944 . 4 1 1 A 75 75 LYS HA H 75 4.110 4.559 -0.449 1
1 953 . 4 1 1 A 75 75 LYS CA C 75 56.500 55.374 1.126 1
1 954 . 4 1 1 A 75 75 LYS CB C 75 33.300 33.359 -0.059 1
1 958 . 4 1 1 A 75 75 LYS N N 75 117.000 122.034 -5.034 1
1 959 . 4 1 1 A 76 76 ASP H H 76 8.570 7.665 0.905 1
1 960 . 4 1 1 A 76 76 ASP HA H 76 4.530 4.458 0.072 1
1 963 . 4 1 1 A 76 76 ASP C C 76 176.300 176.837 -0.537 1
1 964 . 4 1 1 A 76 76 ASP CA C 76 55.000 54.816 0.184 1
1 965 . 4 1 1 A 76 76 ASP CB C 76 41.100 40.701 0.399 1
1 966 . 4 1 1 A 76 76 ASP N N 76 122.700 122.310 0.390 1
1 967 . 4 1 1 A 77 77 SER H H 77 8.330 8.234 0.096 1
1 968 . 4 1 1 A 77 77 SER HA H 77 4.410 4.721 -0.311 1
1 971 . 4 1 1 A 77 77 SER C C 77 174.300 175.106 -0.806 1
1 972 . 4 1 1 A 77 77 SER CA C 77 58.000 56.273 1.727 1
1 973 . 4 1 1 A 77 77 SER CB C 77 63.900 63.062 0.838 1
1 974 . 4 1 1 A 77 77 SER N N 77 116.100 115.935 0.165 1
1 975 . 4 1 1 A 78 78 LEU H H 78 8.350 8.037 0.313 1
1 976 . 4 1 1 A 78 78 LEU HA H 78 4.280 3.989 0.291 1
1 986 . 4 1 1 A 78 78 LEU C C 78 177.200 177.593 -0.393 1
1 987 . 4 1 1 A 78 78 LEU CA C 78 55.200 58.122 -2.922 1
1 988 . 4 1 1 A 78 78 LEU CB C 78 42.100 41.639 0.461 1
1 992 . 4 1 1 A 78 78 LEU N N 78 124.300 124.983 -0.683 1
1 993 . 4 1 1 A 79 79 GLU H H 79 8.300 7.723 0.577 1
1 994 . 4 1 1 A 79 79 GLU CA C 79 56.400 55.010 1.390 1
1 995 . 4 1 1 A 79 79 GLU CB C 79 30.200 31.033 -0.833 1
1 1 . 5 1 1 A 2 2 HIS HA H 2 4.640 4.677 -0.037 1
1 4 . 5 1 1 A 2 2 HIS C C 2 173.600 175.725 -2.125 1
1 5 . 5 1 1 A 2 2 HIS CA C 2 56.500 56.315 0.185 1
1 6 . 5 1 1 A 2 2 HIS CB C 2 31.000 30.206 0.794 1
1 7 . 5 1 1 A 3 3 LYS H H 3 8.160 8.553 -0.393 1
1 8 . 5 1 1 A 3 3 LYS HA H 3 4.660 4.340 0.320 1
1 17 . 5 1 1 A 3 3 LYS C C 3 174.400 175.373 -0.973 1
1 18 . 5 1 1 A 3 3 LYS CA C 3 54.800 56.614 -1.814 1
1 19 . 5 1 1 A 3 3 LYS CB C 3 35.800 33.329 2.471 1
1 23 . 5 1 1 A 3 3 LYS N N 3 121.900 121.475 0.425 1
1 24 . 5 1 1 A 4 4 ASP H H 4 8.470 8.690 -0.220 1
1 25 . 5 1 1 A 4 4 ASP HA H 4 4.900 5.380 -0.480 1
1 28 . 5 1 1 A 4 4 ASP C C 4 176.900 174.904 1.996 1
1 29 . 5 1 1 A 4 4 ASP CA C 4 52.700 52.632 0.068 1
1 30 . 5 1 1 A 4 4 ASP CB C 4 44.100 45.072 -0.972 1
1 31 . 5 1 1 A 4 4 ASP N N 4 117.900 121.508 -3.608 1
1 32 . 5 1 1 A 5 5 ILE H H 5 9.570 8.785 0.785 1
1 33 . 5 1 1 A 5 5 ILE HA H 5 3.640 4.342 -0.702 1
1 43 . 5 1 1 A 5 5 ILE C C 5 174.800 175.939 -1.139 1
1 44 . 5 1 1 A 5 5 ILE CA C 5 60.900 61.151 -0.251 1
1 45 . 5 1 1 A 5 5 ILE CB C 5 37.000 37.627 -0.627 1
1 49 . 5 1 1 A 5 5 ILE N N 5 124.400 122.497 1.903 1
1 50 . 5 1 1 A 6 6 PHE H H 6 7.790 9.072 -1.282 1
1 51 . 5 1 1 A 6 6 PHE HA H 6 3.160 4.683 -1.523 1
1 58 . 5 1 1 A 6 6 PHE C C 6 173.500 174.354 -0.854 1
1 59 . 5 1 1 A 6 6 PHE CA C 6 56.900 57.629 -0.729 1
1 60 . 5 1 1 A 6 6 PHE CB C 6 40.100 38.856 1.244 1
1 65 . 5 1 1 A 6 6 PHE N N 6 130.200 128.990 1.210 1
1 66 . 5 1 1 A 7 7 THR H H 7 6.790 8.663 -1.873 1
1 67 . 5 1 1 A 7 7 THR HA H 7 4.530 5.040 -0.510 1
1 72 . 5 1 1 A 7 7 THR C C 7 172.300 172.849 -0.549 1
1 73 . 5 1 1 A 7 7 THR CA C 7 59.200 61.188 -1.988 1
1 74 . 5 1 1 A 7 7 THR CB C 7 71.000 70.239 0.761 1
1 76 . 5 1 1 A 7 7 THR N N 7 117.900 123.651 -5.751 1
1 77 . 5 1 1 A 8 8 SER H H 8 7.600 8.509 -0.909 1
1 78 . 5 1 1 A 8 8 SER HA H 8 4.180 4.818 -0.638 1
1 81 . 5 1 1 A 8 8 SER C C 8 175.300 172.362 2.938 1
1 82 . 5 1 1 A 8 8 SER CA C 8 55.800 57.080 -1.280 1
1 83 . 5 1 1 A 8 8 SER CB C 8 64.000 67.091 -3.091 1
1 84 . 5 1 1 A 8 8 SER N N 8 113.400 120.036 -6.636 1
1 85 . 5 1 1 A 9 9 VAL H H 9 8.880 8.345 0.535 1
1 86 . 5 1 1 A 9 9 VAL HA H 9 5.220 4.703 0.517 1
1 94 . 5 1 1 A 9 9 VAL C C 9 174.000 174.144 -0.144 1
1 95 . 5 1 1 A 9 9 VAL CA C 9 59.100 60.605 -1.505 1
1 96 . 5 1 1 A 9 9 VAL CB C 9 36.500 34.500 2.000 1
1 99 . 5 1 1 A 9 9 VAL N N 9 114.700 120.327 -5.627 1
1 100 . 5 1 1 A 10 10 VAL H H 10 8.510 9.280 -0.770 1
1 101 . 5 1 1 A 10 10 VAL HA H 10 4.470 4.781 -0.311 1
1 109 . 5 1 1 A 10 10 VAL C C 10 173.700 173.936 -0.236 1
1 110 . 5 1 1 A 10 10 VAL CA C 10 59.400 59.614 -0.214 1
1 111 . 5 1 1 A 10 10 VAL CB C 10 36.000 34.678 1.322 1
1 114 . 5 1 1 A 10 10 VAL N N 10 117.100 128.010 -10.910 1
1 115 . 5 1 1 A 11 11 ARG H H 11 8.500 8.226 0.274 1
1 116 . 5 1 1 A 11 11 ARG HA H 11 4.460 4.642 -0.182 1
1 123 . 5 1 1 A 11 11 ARG C C 11 174.500 175.024 -0.524 1
1 124 . 5 1 1 A 11 11 ARG CA C 11 57.400 55.694 1.706 1
1 125 . 5 1 1 A 11 11 ARG CB C 11 31.000 31.046 -0.046 1
1 128 . 5 1 1 A 11 11 ARG N N 11 124.800 126.291 -1.491 1
1 129 . 5 1 1 A 12 12 VAL H H 12 7.650 9.178 -1.528 1
1 130 . 5 1 1 A 12 12 VAL HA H 12 4.970 4.756 0.214 1
1 138 . 5 1 1 A 12 12 VAL C C 12 176.700 174.838 1.862 1
1 139 . 5 1 1 A 12 12 VAL CA C 12 59.400 61.149 -1.749 1
1 140 . 5 1 1 A 12 12 VAL CB C 12 34.400 33.128 1.272 1
1 143 . 5 1 1 A 12 12 VAL N N 12 120.900 124.099 -3.199 1
1 144 . 5 1 1 A 13 13 ARG H H 13 9.020 9.042 -0.022 1
1 145 . 5 1 1 A 13 13 ARG HA H 13 4.700 5.332 -0.632 1
1 152 . 5 1 1 A 13 13 ARG C C 13 176.000 175.406 0.594 1
1 153 . 5 1 1 A 13 13 ARG CA C 13 54.600 54.885 -0.285 1
1 154 . 5 1 1 A 13 13 ARG CB C 13 32.900 33.714 -0.814 1
1 157 . 5 1 1 A 13 13 ARG N N 13 127.500 127.054 0.446 1
1 158 . 5 1 1 A 14 14 GLY H H 14 8.640 8.271 0.369 1
1 159 . 5 1 1 A 14 14 GLY HA2 H 14 3.680 4.116 -0.436 1
1 160 . 5 1 1 A 14 14 GLY HA3 H 14 4.190 4.123 0.067 1
1 161 . 5 1 1 A 14 14 GLY C C 14 173.700 173.818 -0.118 1
1 162 . 5 1 1 A 14 14 GLY CA C 14 45.600 44.120 1.480 1
1 163 . 5 1 1 A 14 14 GLY N N 14 108.800 113.563 -4.763 1
1 164 . 5 1 1 A 15 15 SER H H 15 8.220 8.392 -0.172 1
1 165 . 5 1 1 A 15 15 SER HA H 15 5.020 4.773 0.247 1
1 168 . 5 1 1 A 15 15 SER C C 15 175.400 174.327 1.073 1
1 169 . 5 1 1 A 15 15 SER CA C 15 55.300 57.671 -2.371 1
1 170 . 5 1 1 A 15 15 SER CB C 15 64.900 63.451 1.449 1
1 171 . 5 1 1 A 15 15 SER N N 15 113.200 115.294 -2.094 1
1 172 . 5 1 1 A 16 16 LYS H H 16 9.930 8.364 1.566 1
1 173 . 5 1 1 A 16 16 LYS HA H 16 4.190 4.922 -0.732 1
1 182 . 5 1 1 A 16 16 LYS C C 16 176.500 175.887 0.613 1
1 183 . 5 1 1 A 16 16 LYS CA C 16 57.300 54.645 2.655 1
1 184 . 5 1 1 A 16 16 LYS CB C 16 32.300 34.785 -2.485 1
1 188 . 5 1 1 A 16 16 LYS N N 16 129.200 123.232 5.968 1
1 189 . 5 1 1 A 17 17 LYS H H 17 7.960 8.820 -0.860 1
1 190 . 5 1 1 A 17 17 LYS HA H 17 4.030 4.165 -0.135 1
1 199 . 5 1 1 A 17 17 LYS C C 17 175.600 176.618 -1.018 1
1 200 . 5 1 1 A 17 17 LYS CA C 17 56.900 57.789 -0.889 1
1 201 . 5 1 1 A 17 17 LYS CB C 17 34.700 32.999 1.701 1
1 205 . 5 1 1 A 17 17 LYS N N 17 118.500 118.900 -0.400 1
1 206 . 5 1 1 A 18 18 TYR H H 18 7.780 7.759 0.021 1
1 207 . 5 1 1 A 18 18 TYR HA H 18 4.760 4.591 0.169 1
1 214 . 5 1 1 A 18 18 TYR C C 18 174.000 176.278 -2.278 1
1 215 . 5 1 1 A 18 18 TYR CA C 18 56.800 58.280 -1.480 1
1 216 . 5 1 1 A 18 18 TYR CB C 18 41.100 38.968 2.132 1
1 221 . 5 1 1 A 18 18 TYR N N 18 117.100 117.378 -0.278 1
1 222 . 5 1 1 A 19 19 ASN H H 19 8.890 8.913 -0.023 1
1 223 . 5 1 1 A 19 19 ASN HA H 19 4.960 4.748 0.212 1
1 228 . 5 1 1 A 19 19 ASN C C 19 176.100 175.277 0.823 1
1 229 . 5 1 1 A 19 19 ASN CA C 19 53.600 55.123 -1.523 1
1 230 . 5 1 1 A 19 19 ASN CB C 19 40.300 39.677 0.623 1
1 231 . 5 1 1 A 19 19 ASN N N 19 116.600 122.365 -5.765 1
1 233 . 5 1 1 A 20 20 VAL H H 20 7.730 7.479 0.251 1
1 234 . 5 1 1 A 20 20 VAL HA H 20 5.250 4.975 0.275 1
1 242 . 5 1 1 A 20 20 VAL C C 20 173.800 174.571 -0.771 1
1 243 . 5 1 1 A 20 20 VAL CA C 20 59.400 59.556 -0.156 1
1 244 . 5 1 1 A 20 20 VAL CB C 20 37.600 35.522 2.078 1
1 247 . 5 1 1 A 20 20 VAL N N 20 113.900 113.231 0.669 1
1 248 . 5 1 1 A 21 21 VAL H H 21 8.890 8.956 -0.066 1
1 249 . 5 1 1 A 21 21 VAL HA H 21 4.840 4.762 0.078 1
1 257 . 5 1 1 A 21 21 VAL CA C 21 56.800 57.817 -1.017 1
1 258 . 5 1 1 A 21 21 VAL CB C 21 36.000 34.805 1.195 1
1 261 . 5 1 1 A 21 21 VAL N N 21 118.500 118.988 -0.488 1
1 262 . 5 1 1 A 22 22 PRO HA H 22 4.940 4.975 -0.035 1
1 269 . 5 1 1 A 22 22 PRO C C 22 175.600 176.472 -0.872 1
1 270 . 5 1 1 A 22 22 PRO CA C 22 62.700 62.618 0.082 1
1 271 . 5 1 1 A 22 22 PRO CB C 22 31.800 31.887 -0.087 1
1 274 . 5 1 1 A 23 23 VAL H H 23 8.060 8.690 -0.630 1
1 275 . 5 1 1 A 23 23 VAL HA H 23 5.390 5.298 0.092 1
1 283 . 5 1 1 A 23 23 VAL C C 23 175.400 173.946 1.454 1
1 284 . 5 1 1 A 23 23 VAL CA C 23 57.800 59.317 -1.517 1
1 285 . 5 1 1 A 23 23 VAL CB C 23 36.300 35.722 0.578 1
1 288 . 5 1 1 A 23 23 VAL N N 23 110.900 116.496 -5.596 1
1 289 . 5 1 1 A 24 24 LYS H H 24 8.960 9.451 -0.491 1
1 290 . 5 1 1 A 24 24 LYS HA H 24 5.600 5.391 0.209 1
1 299 . 5 1 1 A 24 24 LYS C C 24 175.600 174.386 1.214 1
1 300 . 5 1 1 A 24 24 LYS CA C 24 54.200 54.431 -0.231 1
1 301 . 5 1 1 A 24 24 LYS CB C 24 37.000 36.119 0.881 1
1 305 . 5 1 1 A 24 24 LYS N N 24 117.900 120.356 -2.456 1
1 306 . 5 1 1 A 25 25 SER H H 25 8.950 8.418 0.532 1
1 307 . 5 1 1 A 25 25 SER HA H 25 5.190 5.120 0.070 1
1 310 . 5 1 1 A 25 25 SER C C 25 173.800 175.254 -1.454 1
1 311 . 5 1 1 A 25 25 SER CA C 25 57.700 56.295 1.405 1
1 312 . 5 1 1 A 25 25 SER CB C 25 65.100 65.078 0.022 1
1 313 . 5 1 1 A 25 25 SER N N 25 114.600 113.663 0.937 1
1 314 . 5 1 1 A 26 26 ASN H H 26 9.020 9.069 -0.049 1
1 315 . 5 1 1 A 26 26 ASN HA H 26 4.370 4.496 -0.126 1
1 320 . 5 1 1 A 26 26 ASN C C 26 173.500 174.966 -1.466 1
1 321 . 5 1 1 A 26 26 ASN CA C 26 53.700 56.705 -3.005 1
1 322 . 5 1 1 A 26 26 ASN CB C 26 37.100 38.418 -1.318 1
1 323 . 5 1 1 A 26 26 ASN N N 26 118.300 122.219 -3.919 1
1 325 . 5 1 1 A 27 27 LYS H H 27 7.400 8.131 -0.731 1
1 326 . 5 1 1 A 27 27 LYS HA H 27 4.780 4.800 -0.020 1
1 335 . 5 1 1 A 27 27 LYS CA C 27 53.500 52.958 0.542 1
1 336 . 5 1 1 A 27 27 LYS CB C 27 34.100 34.032 0.068 1
1 340 . 5 1 1 A 27 27 LYS N N 27 116.600 117.085 -0.485 1
1 341 . 5 1 1 A 28 28 PRO HA H 28 4.040 4.638 -0.598 1
1 348 . 5 1 1 A 28 28 PRO C C 28 174.500 175.546 -1.046 1
1 349 . 5 1 1 A 28 28 PRO CA C 28 63.200 63.325 -0.125 1
1 350 . 5 1 1 A 28 28 PRO CB C 28 32.500 32.044 0.456 1
1 353 . 5 1 1 A 29 29 VAL H H 29 8.860 8.973 -0.113 1
1 354 . 5 1 1 A 29 29 VAL HA H 29 4.420 4.772 -0.352 1
1 362 . 5 1 1 A 29 29 VAL C C 29 174.800 174.920 -0.120 1
1 363 . 5 1 1 A 29 29 VAL CA C 29 60.300 59.685 0.615 1
1 364 . 5 1 1 A 29 29 VAL CB C 29 36.400 35.470 0.930 1
1 367 . 5 1 1 A 29 29 VAL N N 29 119.800 122.665 -2.865 1
1 368 . 5 1 1 A 30 30 GLU H H 30 9.550 8.819 0.731 1
1 369 . 5 1 1 A 30 30 GLU HA H 30 4.260 4.317 -0.057 1
1 374 . 5 1 1 A 30 30 GLU C C 30 177.800 178.157 -0.357 1
1 375 . 5 1 1 A 30 30 GLU CA C 30 58.000 56.849 1.151 1
1 376 . 5 1 1 A 30 30 GLU CB C 30 29.700 29.805 -0.105 1
1 378 . 5 1 1 A 30 30 GLU N N 30 128.900 124.704 4.196 1
1 379 . 5 1 1 A 31 31 ILE H H 31 7.910 8.624 -0.714 1
1 380 . 5 1 1 A 31 31 ILE HA H 31 2.120 4.156 -2.036 1
1 390 . 5 1 1 A 31 31 ILE C C 31 178.000 177.745 0.255 1
1 391 . 5 1 1 A 31 31 ILE CA C 31 63.500 63.244 0.256 1
1 392 . 5 1 1 A 31 31 ILE CB C 31 37.200 37.994 -0.794 1
1 396 . 5 1 1 A 31 31 ILE N N 31 122.500 124.024 -1.524 1
1 397 . 5 1 1 A 32 32 SER H H 32 7.940 8.072 -0.132 1
1 398 . 5 1 1 A 32 32 SER HA H 32 4.070 4.230 -0.160 1
1 401 . 5 1 1 A 32 32 SER C C 32 175.800 175.483 0.317 1
1 402 . 5 1 1 A 32 32 SER CA C 32 60.200 61.223 -1.023 1
1 403 . 5 1 1 A 32 32 SER CB C 32 62.100 62.833 -0.733 1
1 404 . 5 1 1 A 32 32 SER N N 32 115.300 117.961 -2.661 1
1 405 . 5 1 1 A 33 33 LYS H H 33 7.640 7.427 0.213 1
1 406 . 5 1 1 A 33 33 LYS HA H 33 4.400 4.249 0.151 1
1 415 . 5 1 1 A 33 33 LYS C C 33 176.600 176.907 -0.307 1
1 416 . 5 1 1 A 33 33 LYS CA C 33 56.200 55.708 0.492 1
1 417 . 5 1 1 A 33 33 LYS CB C 33 32.700 32.323 0.377 1
1 421 . 5 1 1 A 33 33 LYS N N 33 119.800 118.475 1.325 1
1 422 . 5 1 1 A 34 34 TRP H H 34 7.860 7.593 0.267 1
1 423 . 5 1 1 A 34 34 TRP HA H 34 3.870 4.359 -0.489 1
1 426 . 5 1 1 A 34 34 TRP C C 34 178.600 178.601 -0.001 1
1 427 . 5 1 1 A 34 34 TRP CA C 34 60.200 61.174 -0.974 1
1 428 . 5 1 1 A 34 34 TRP CB C 34 28.500 29.817 -1.317 1
1 429 . 5 1 1 A 34 34 TRP N N 34 120.000 121.973 -1.973 1
1 430 . 5 1 1 A 35 35 ILE H H 35 8.200 8.121 0.079 1
1 431 . 5 1 1 A 35 35 ILE HA H 35 3.990 4.175 -0.185 1
1 441 . 5 1 1 A 35 35 ILE C C 35 177.900 177.562 0.338 1
1 442 . 5 1 1 A 35 35 ILE CA C 35 64.300 64.700 -0.400 1
1 443 . 5 1 1 A 35 35 ILE CB C 35 37.200 37.496 -0.296 1
1 447 . 5 1 1 A 35 35 ILE N N 35 119.500 118.907 0.593 1
1 448 . 5 1 1 A 36 36 ASP H H 36 7.680 8.202 -0.522 1
1 449 . 5 1 1 A 36 36 ASP HA H 36 4.490 4.375 0.115 1
1 452 . 5 1 1 A 36 36 ASP C C 36 179.200 178.624 0.576 1
1 453 . 5 1 1 A 36 36 ASP CA C 36 57.500 57.164 0.336 1
1 454 . 5 1 1 A 36 36 ASP CB C 36 40.400 40.986 -0.586 1
1 455 . 5 1 1 A 36 36 ASP N N 36 122.000 121.706 0.294 1
1 456 . 5 1 1 A 37 37 PHE H H 37 8.450 8.386 0.064 1
1 457 . 5 1 1 A 37 37 PHE HA H 37 4.080 4.155 -0.075 1
1 465 . 5 1 1 A 37 37 PHE C C 37 178.300 178.979 -0.679 1
1 466 . 5 1 1 A 37 37 PHE CA C 37 58.600 59.914 -1.314 1
1 467 . 5 1 1 A 37 37 PHE CB C 37 37.000 37.306 -0.306 1
1 473 . 5 1 1 A 37 37 PHE N N 37 119.800 118.842 0.958 1
1 474 . 5 1 1 A 38 38 SER H H 38 8.580 8.403 0.177 1
1 475 . 5 1 1 A 38 38 SER HA H 38 4.250 4.365 -0.115 1
1 478 . 5 1 1 A 38 38 SER C C 38 176.800 177.415 -0.615 1
1 479 . 5 1 1 A 38 38 SER CA C 38 62.700 61.632 1.068 1
1 480 . 5 1 1 A 38 38 SER CB C 38 62.700 62.623 0.077 1
1 481 . 5 1 1 A 38 38 SER N N 38 115.800 116.823 -1.023 1
1 482 . 5 1 1 A 39 39 ASN H H 39 8.190 8.053 0.137 1
1 483 . 5 1 1 A 39 39 ASN HA H 39 4.540 4.432 0.108 1
1 488 . 5 1 1 A 39 39 ASN C C 39 178.500 178.224 0.276 1
1 489 . 5 1 1 A 39 39 ASN CA C 39 56.200 56.548 -0.348 1
1 490 . 5 1 1 A 39 39 ASN CB C 39 37.900 38.276 -0.376 1
1 491 . 5 1 1 A 39 39 ASN N N 39 121.300 121.220 0.080 1
1 493 . 5 1 1 A 40 40 VAL H H 40 7.840 7.864 -0.024 1
1 494 . 5 1 1 A 40 40 VAL HA H 40 3.650 3.570 0.080 1
1 502 . 5 1 1 A 40 40 VAL C C 40 179.000 178.114 0.886 1
1 503 . 5 1 1 A 40 40 VAL CA C 40 66.600 66.619 -0.019 1
1 504 . 5 1 1 A 40 40 VAL CB C 40 32.100 31.450 0.650 1
1 507 . 5 1 1 A 40 40 VAL N N 40 121.800 119.863 1.937 1
1 508 . 5 1 1 A 41 41 LEU H H 41 8.210 8.240 -0.030 1
1 509 . 5 1 1 A 41 41 LEU HA H 41 3.840 4.075 -0.235 1
1 519 . 5 1 1 A 41 41 LEU C C 41 178.800 178.343 0.457 1
1 520 . 5 1 1 A 41 41 LEU CA C 41 57.400 57.470 -0.070 1
1 521 . 5 1 1 A 41 41 LEU CB C 41 41.200 40.921 0.279 1
1 525 . 5 1 1 A 41 41 LEU N N 41 117.700 118.808 -1.108 1
1 526 . 5 1 1 A 42 42 SER H H 42 7.980 8.178 -0.198 1
1 527 . 5 1 1 A 42 42 SER HA H 42 4.260 4.357 -0.097 1
1 530 . 5 1 1 A 42 42 SER C C 42 174.900 175.142 -0.242 1
1 531 . 5 1 1 A 42 42 SER CA C 42 61.200 60.382 0.818 1
1 532 . 5 1 1 A 42 42 SER CB C 42 63.100 63.174 -0.074 1
1 533 . 5 1 1 A 42 42 SER N N 42 113.200 115.060 -1.860 1
1 534 . 5 1 1 A 43 43 ARG H H 43 7.100 7.796 -0.696 1
1 535 . 5 1 1 A 43 43 ARG HA H 43 4.500 4.689 -0.189 1
1 542 . 5 1 1 A 43 43 ARG C C 43 175.800 175.419 0.381 1
1 543 . 5 1 1 A 43 43 ARG CA C 43 55.600 55.464 0.136 1
1 544 . 5 1 1 A 43 43 ARG CB C 43 30.800 31.614 -0.814 1
1 547 . 5 1 1 A 43 43 ARG N N 43 118.400 118.201 0.199 1
1 548 . 5 1 1 A 44 44 LEU H H 44 7.610 7.165 0.445 1
1 549 . 5 1 1 A 44 44 LEU HA H 44 4.590 4.840 -0.250 1
1 559 . 5 1 1 A 44 44 LEU C C 44 175.300 174.426 0.874 1
1 560 . 5 1 1 A 44 44 LEU CA C 44 53.900 53.541 0.359 1
1 561 . 5 1 1 A 44 44 LEU CB C 44 44.100 43.836 0.264 1
1 565 . 5 1 1 A 44 44 LEU N N 44 120.400 122.749 -2.349 1
1 566 . 5 1 1 A 45 45 TYR H H 45 7.630 9.250 -1.620 1
1 567 . 5 1 1 A 45 45 TYR HA H 45 5.180 5.327 -0.147 1
1 574 . 5 1 1 A 45 45 TYR C C 45 174.600 174.847 -0.247 1
1 575 . 5 1 1 A 45 45 TYR CA C 45 56.300 57.170 -0.870 1
1 576 . 5 1 1 A 45 45 TYR CB C 45 41.400 38.893 2.507 1
1 581 . 5 1 1 A 45 45 TYR N N 45 115.300 127.193 -11.893 1
1 582 . 5 1 1 A 46 46 VAL H H 46 8.770 8.407 0.363 1
1 583 . 5 1 1 A 46 46 VAL HA H 46 4.540 4.483 0.057 1
1 591 . 5 1 1 A 46 46 VAL C C 46 174.600 176.673 -2.073 1
1 592 . 5 1 1 A 46 46 VAL CA C 46 59.600 61.581 -1.981 1
1 593 . 5 1 1 A 46 46 VAL CB C 46 34.700 32.907 1.793 1
1 596 . 5 1 1 A 46 46 VAL N N 46 115.400 125.720 -10.320 1
1 597 . 5 1 1 A 47 47 GLY H H 47 8.280 8.778 -0.498 1
1 598 . 5 1 1 A 47 47 GLY HA2 H 47 3.610 4.118 -0.508 1
1 599 . 5 1 1 A 47 47 GLY HA3 H 47 4.970 4.120 0.850 1
1 600 . 5 1 1 A 47 47 GLY C C 47 173.100 173.346 -0.246 1
1 601 . 5 1 1 A 47 47 GLY CA C 47 43.600 46.365 -2.765 1
1 602 . 5 1 1 A 47 47 GLY N N 47 109.900 116.062 -6.162 1
1 603 . 5 1 1 A 48 48 VAL H H 48 7.630 7.481 0.149 1
1 604 . 5 1 1 A 48 48 VAL HA H 48 4.320 4.556 -0.236 1
1 612 . 5 1 1 A 48 48 VAL CA C 48 58.700 59.110 -0.410 1
1 613 . 5 1 1 A 48 48 VAL CB C 48 32.100 33.076 -0.976 1
1 616 . 5 1 1 A 48 48 VAL N N 48 109.900 119.416 -9.516 1
1 617 . 5 1 1 A 49 49 PRO HA H 49 4.800 4.425 0.375 1
1 624 . 5 1 1 A 49 49 PRO C C 49 176.700 176.118 0.582 1
1 625 . 5 1 1 A 49 49 PRO CA C 49 62.300 63.277 -0.977 1
1 626 . 5 1 1 A 49 49 PRO CB C 49 35.400 31.979 3.421 1
1 629 . 5 1 1 A 50 50 THR H H 50 8.790 8.462 0.328 1
1 630 . 5 1 1 A 50 50 THR HA H 50 4.690 5.150 -0.460 1
1 635 . 5 1 1 A 50 50 THR C C 50 173.500 173.800 -0.300 1
1 636 . 5 1 1 A 50 50 THR CA C 50 60.800 59.490 1.310 1
1 637 . 5 1 1 A 50 50 THR CB C 50 70.800 72.568 -1.768 1
1 639 . 5 1 1 A 50 50 THR N N 50 113.500 112.544 0.956 1
1 640 . 5 1 1 A 51 51 LYS H H 51 7.810 8.284 -0.474 1
1 641 . 5 1 1 A 51 51 LYS HA H 51 4.890 4.642 0.248 1
1 650 . 5 1 1 A 51 51 LYS C C 51 175.900 175.867 0.033 1
1 651 . 5 1 1 A 51 51 LYS CA C 51 54.100 54.699 -0.599 1
1 652 . 5 1 1 A 51 51 LYS CB C 51 35.300 33.956 1.344 1
1 656 . 5 1 1 A 51 51 LYS N N 51 122.200 120.588 1.612 1
1 657 . 5 1 1 A 52 52 SER H H 52 8.410 8.490 -0.080 1
1 658 . 5 1 1 A 52 52 SER HA H 52 3.630 4.302 -0.672 1
1 661 . 5 1 1 A 52 52 SER C C 52 175.800 175.095 0.705 1
1 662 . 5 1 1 A 52 52 SER CA C 52 58.800 59.489 -0.689 1
1 663 . 5 1 1 A 52 52 SER CB C 52 62.600 62.905 -0.305 1
1 664 . 5 1 1 A 52 52 SER N N 52 118.900 114.589 4.311 1
1 665 . 5 1 1 A 53 53 GLY H H 53 9.070 8.944 0.126 1
1 666 . 5 1 1 A 53 53 GLY HA2 H 53 3.390 3.912 -0.522 1
1 667 . 5 1 1 A 53 53 GLY HA3 H 53 4.460 3.913 0.547 1
1 668 . 5 1 1 A 53 53 GLY C C 53 174.100 174.256 -0.156 1
1 669 . 5 1 1 A 53 53 GLY CA C 53 44.800 45.769 -0.969 1
1 670 . 5 1 1 A 53 53 GLY N N 53 115.600 113.271 2.329 1
1 671 . 5 1 1 A 54 54 ASN H H 54 7.870 7.737 0.133 1
1 672 . 5 1 1 A 54 54 ASN HA H 54 4.570 4.878 -0.308 1
1 677 . 5 1 1 A 54 54 ASN C C 54 175.500 174.623 0.877 1
1 678 . 5 1 1 A 54 54 ASN CA C 54 53.000 52.297 0.703 1
1 679 . 5 1 1 A 54 54 ASN CB C 54 38.600 39.536 -0.936 1
1 680 . 5 1 1 A 54 54 ASN N N 54 119.600 118.646 0.954 1
1 682 . 5 1 1 A 55 55 VAL H H 55 8.770 8.866 -0.096 1
1 683 . 5 1 1 A 55 55 VAL HA H 55 3.880 4.162 -0.282 1
1 691 . 5 1 1 A 55 55 VAL C C 55 176.200 175.319 0.881 1
1 692 . 5 1 1 A 55 55 VAL CA C 55 63.700 62.666 1.034 1
1 693 . 5 1 1 A 55 55 VAL CB C 55 31.600 31.105 0.495 1
1 696 . 5 1 1 A 55 55 VAL N N 55 123.900 123.606 0.294 1
1 697 . 5 1 1 A 56 56 VAL H H 56 9.050 8.788 0.262 1
1 698 . 5 1 1 A 56 56 VAL HA H 56 3.990 3.955 0.035 1
1 706 . 5 1 1 A 56 56 VAL C C 56 175.200 176.255 -1.055 1
1 707 . 5 1 1 A 56 56 VAL CA C 56 62.700 64.723 -2.023 1
1 708 . 5 1 1 A 56 56 VAL CB C 56 32.900 32.239 0.661 1
1 711 . 5 1 1 A 56 56 VAL N N 56 127.500 128.963 -1.463 1
1 712 . 5 1 1 A 57 57 CYS H H 57 7.250 7.739 -0.489 1
1 713 . 5 1 1 A 57 57 CYS HA H 57 4.370 4.752 -0.382 1
1 716 . 5 1 1 A 57 57 CYS C C 57 171.900 173.434 -1.534 1
1 717 . 5 1 1 A 57 57 CYS CA C 57 58.600 57.373 1.227 1
1 718 . 5 1 1 A 57 57 CYS CB C 57 28.600 29.224 -0.624 1
1 719 . 5 1 1 A 57 57 CYS N N 57 117.600 118.270 -0.670 1
1 720 . 5 1 1 A 58 58 LYS H H 58 8.880 8.627 0.253 1
1 721 . 5 1 1 A 58 58 LYS HA H 58 4.220 4.653 -0.433 1
1 730 . 5 1 1 A 58 58 LYS C C 58 176.000 176.516 -0.516 1
1 731 . 5 1 1 A 58 58 LYS CA C 58 54.400 55.505 -1.105 1
1 732 . 5 1 1 A 58 58 LYS CB C 58 33.600 31.639 1.961 1
1 736 . 5 1 1 A 58 58 LYS N N 58 132.000 125.355 6.645 1
1 737 . 5 1 1 A 59 59 ASN H H 59 9.500 9.069 0.431 1
1 738 . 5 1 1 A 59 59 ASN HA H 59 4.040 4.418 -0.378 1
1 743 . 5 1 1 A 59 59 ASN C C 59 176.400 175.334 1.066 1
1 744 . 5 1 1 A 59 59 ASN CA C 59 53.200 54.022 -0.822 1
1 745 . 5 1 1 A 59 59 ASN CB C 59 35.900 36.833 -0.933 1
1 746 . 5 1 1 A 59 59 ASN N N 59 127.500 121.836 5.664 1
1 748 . 5 1 1 A 60 60 ILE H H 60 8.050 7.339 0.711 1
1 749 . 5 1 1 A 60 60 ILE HA H 60 3.680 3.706 -0.026 1
1 759 . 5 1 1 A 60 60 ILE C C 60 175.700 176.346 -0.646 1
1 760 . 5 1 1 A 60 60 ILE CA C 60 61.900 64.304 -2.404 1
1 761 . 5 1 1 A 60 60 ILE CB C 60 38.300 37.745 0.555 1
1 765 . 5 1 1 A 60 60 ILE N N 60 120.200 120.819 -0.619 1
1 766 . 5 1 1 A 61 61 MET H H 61 9.590 7.395 2.195 1
1 767 . 5 1 1 A 61 61 MET HA H 61 3.920 4.825 -0.905 1
1 775 . 5 1 1 A 61 61 MET C C 61 174.300 175.743 -1.443 1
1 776 . 5 1 1 A 61 61 MET CA C 61 57.000 54.218 2.782 1
1 777 . 5 1 1 A 61 61 MET CB C 61 31.300 33.346 -2.046 1
1 780 . 5 1 1 A 61 61 MET N N 61 124.400 118.437 5.963 1
1 781 . 5 1 1 A 62 62 ASN H H 62 8.250 7.823 0.427 1
1 782 . 5 1 1 A 62 62 ASN HA H 62 4.400 4.459 -0.059 1
1 787 . 5 1 1 A 62 62 ASN C C 62 176.800 176.127 0.673 1
1 788 . 5 1 1 A 62 62 ASN CA C 62 54.400 54.270 0.130 1
1 789 . 5 1 1 A 62 62 ASN CB C 62 37.600 38.302 -0.702 1
1 790 . 5 1 1 A 62 62 ASN N N 62 111.900 116.464 -4.564 1
1 792 . 5 1 1 A 63 63 THR H H 63 7.480 8.109 -0.629 1
1 793 . 5 1 1 A 63 63 THR HA H 63 4.210 4.362 -0.152 1
1 798 . 5 1 1 A 63 63 THR C C 63 177.100 176.345 0.755 1
1 799 . 5 1 1 A 63 63 THR CA C 63 62.900 62.853 0.047 1
1 800 . 5 1 1 A 63 63 THR CB C 63 72.500 70.539 1.961 1
1 802 . 5 1 1 A 63 63 THR N N 63 105.900 112.353 -6.453 1
1 803 . 5 1 1 A 64 64 GLY H H 64 9.110 8.665 0.445 1
1 804 . 5 1 1 A 64 64 GLY HA2 H 64 3.580 3.940 -0.360 1
1 805 . 5 1 1 A 64 64 GLY HA3 H 64 4.090 3.950 0.140 1
1 806 . 5 1 1 A 64 64 GLY C C 64 173.200 173.957 -0.757 1
1 807 . 5 1 1 A 64 64 GLY CA C 64 45.300 45.611 -0.311 1
1 808 . 5 1 1 A 64 64 GLY N N 64 111.500 111.916 -0.416 1
1 809 . 5 1 1 A 65 65 VAL H H 65 7.580 7.537 0.043 1
1 810 . 5 1 1 A 65 65 VAL HA H 65 4.060 4.331 -0.271 1
1 818 . 5 1 1 A 65 65 VAL C C 65 172.900 174.540 -1.640 1
1 819 . 5 1 1 A 65 65 VAL CA C 65 61.400 61.300 0.100 1
1 820 . 5 1 1 A 65 65 VAL CB C 65 32.900 34.154 -1.254 1
1 823 . 5 1 1 A 65 65 VAL N N 65 121.600 122.451 -0.851 1
1 824 . 5 1 1 A 66 66 ASP H H 66 8.210 8.828 -0.618 1
1 825 . 5 1 1 A 66 66 ASP HA H 66 5.320 5.199 0.121 1
1 828 . 5 1 1 A 66 66 ASP C C 66 174.800 175.399 -0.599 1
1 829 . 5 1 1 A 66 66 ASP CA C 66 51.700 53.650 -1.950 1
1 830 . 5 1 1 A 66 66 ASP CB C 66 43.200 42.398 0.802 1
1 831 . 5 1 1 A 66 66 ASP N N 66 123.100 127.661 -4.561 1
1 832 . 5 1 1 A 67 67 ILE H H 67 8.540 8.881 -0.341 1
1 833 . 5 1 1 A 67 67 ILE HA H 67 4.630 4.570 0.060 1
1 843 . 5 1 1 A 67 67 ILE C C 67 175.600 175.621 -0.021 1
1 844 . 5 1 1 A 67 67 ILE CA C 67 56.900 60.232 -3.332 1
1 845 . 5 1 1 A 67 67 ILE CB C 67 35.300 37.475 -2.175 1
1 849 . 5 1 1 A 67 67 ILE N N 67 119.200 124.106 -4.906 1
1 850 . 5 1 1 A 68 68 ILE H H 68 9.420 8.905 0.515 1
1 851 . 5 1 1 A 68 68 ILE HA H 68 4.980 5.388 -0.408 1
1 861 . 5 1 1 A 68 68 ILE C C 68 175.000 174.212 0.788 1
1 862 . 5 1 1 A 68 68 ILE CA C 68 58.600 58.832 -0.232 1
1 863 . 5 1 1 A 68 68 ILE CB C 68 40.900 40.226 0.674 1
1 867 . 5 1 1 A 68 68 ILE N N 68 125.000 123.718 1.282 1
1 868 . 5 1 1 A 69 69 CYS H H 69 8.870 9.131 -0.261 1
1 869 . 5 1 1 A 69 69 CYS HA H 69 4.610 4.923 -0.313 1
1 872 . 5 1 1 A 69 69 CYS C C 69 176.200 175.086 1.114 1
1 873 . 5 1 1 A 69 69 CYS CA C 69 58.900 57.955 0.945 1
1 874 . 5 1 1 A 69 69 CYS CB C 69 27.100 29.971 -2.871 1
1 875 . 5 1 1 A 69 69 CYS N N 69 122.300 123.866 -1.566 1
1 876 . 5 1 1 A 70 70 THR H H 70 8.270 8.610 -0.340 1
1 877 . 5 1 1 A 70 70 THR HA H 70 4.710 4.542 0.168 1
1 882 . 5 1 1 A 70 70 THR C C 70 173.600 173.883 -0.283 1
1 883 . 5 1 1 A 70 70 THR CA C 70 61.500 61.701 -0.201 1
1 884 . 5 1 1 A 70 70 THR CB C 70 68.100 69.590 -1.490 1
1 886 . 5 1 1 A 70 70 THR N N 70 116.700 118.916 -2.216 1
1 887 . 5 1 1 A 71 71 LYS H H 71 7.370 7.125 0.245 1
1 888 . 5 1 1 A 71 71 LYS HA H 71 4.520 4.705 -0.185 1
1 897 . 5 1 1 A 71 71 LYS CA C 71 55.100 54.967 0.133 1
1 898 . 5 1 1 A 71 71 LYS CB C 71 37.800 34.291 3.509 1
1 902 . 5 1 1 A 71 71 LYS N N 71 120.900 122.812 -1.912 1
1 903 . 5 1 1 A 72 72 ASN H H 72 8.580 8.696 -0.116 1
1 904 . 5 1 1 A 72 72 ASN HA H 72 4.620 5.133 -0.513 1
1 909 . 5 1 1 A 72 72 ASN C C 72 173.500 174.367 -0.867 1
1 910 . 5 1 1 A 72 72 ASN CA C 72 52.200 52.653 -0.453 1
1 911 . 5 1 1 A 72 72 ASN CB C 72 38.500 39.489 -0.989 1
1 912 . 5 1 1 A 72 72 ASN N N 72 122.700 123.646 -0.946 1
1 914 . 5 1 1 A 73 73 LEU H H 73 8.100 9.499 -1.399 1
1 915 . 5 1 1 A 73 73 LEU HA H 73 4.680 4.894 -0.214 1
1 925 . 5 1 1 A 73 73 LEU CA C 73 51.000 51.809 -0.809 1
1 926 . 5 1 1 A 73 73 LEU CB C 73 42.500 41.884 0.616 1
1 930 . 5 1 1 A 73 73 LEU N N 73 125.100 126.368 -1.268 1
1 931 . 5 1 1 A 74 74 PRO HA H 74 4.670 4.821 -0.151 1
1 938 . 5 1 1 A 74 74 PRO C C 74 176.500 177.114 -0.614 1
1 939 . 5 1 1 A 74 74 PRO CA C 74 61.800 62.311 -0.511 1
1 940 . 5 1 1 A 74 74 PRO CB C 74 32.800 31.184 1.616 1
1 943 . 5 1 1 A 75 75 LYS H H 75 8.280 8.339 -0.059 1
1 944 . 5 1 1 A 75 75 LYS HA H 75 4.110 4.399 -0.289 1
1 953 . 5 1 1 A 75 75 LYS CA C 75 56.500 57.871 -1.371 1
1 954 . 5 1 1 A 75 75 LYS CB C 75 33.300 33.520 -0.220 1
1 958 . 5 1 1 A 75 75 LYS N N 75 117.000 120.557 -3.557 1
1 959 . 5 1 1 A 76 76 ASP H H 76 8.570 7.581 0.989 1
1 960 . 5 1 1 A 76 76 ASP HA H 76 4.530 4.629 -0.099 1
1 963 . 5 1 1 A 76 76 ASP C C 76 176.300 175.569 0.731 1
1 964 . 5 1 1 A 76 76 ASP CA C 76 55.000 54.517 0.483 1
1 965 . 5 1 1 A 76 76 ASP CB C 76 41.100 41.290 -0.190 1
1 966 . 5 1 1 A 76 76 ASP N N 76 122.700 121.313 1.387 1
1 967 . 5 1 1 A 77 77 SER H H 77 8.330 9.025 -0.695 1
1 968 . 5 1 1 A 77 77 SER HA H 77 4.410 5.059 -0.649 1
1 971 . 5 1 1 A 77 77 SER C C 77 174.300 173.072 1.228 1
1 972 . 5 1 1 A 77 77 SER CA C 77 58.000 57.310 0.690 1
1 973 . 5 1 1 A 77 77 SER CB C 77 63.900 64.134 -0.234 1
1 974 . 5 1 1 A 77 77 SER N N 77 116.100 123.196 -7.096 1
1 975 . 5 1 1 A 78 78 LEU H H 78 8.350 8.817 -0.467 1
1 976 . 5 1 1 A 78 78 LEU HA H 78 4.280 4.502 -0.222 1
1 986 . 5 1 1 A 78 78 LEU C C 78 177.200 175.728 1.472 1
1 987 . 5 1 1 A 78 78 LEU CA C 78 55.200 54.236 0.964 1
1 988 . 5 1 1 A 78 78 LEU CB C 78 42.100 40.283 1.817 1
1 992 . 5 1 1 A 78 78 LEU N N 78 124.300 127.377 -3.077 1
1 993 . 5 1 1 A 79 79 GLU H H 79 8.300 8.362 -0.062 1
1 994 . 5 1 1 A 79 79 GLU CA C 79 56.400 55.556 0.844 1
1 995 . 5 1 1 A 79 79 GLU CB C 79 30.200 31.352 -1.152 1
1 1 . 6 1 1 A 2 2 HIS HA H 2 4.640 4.887 -0.247 1
1 4 . 6 1 1 A 2 2 HIS C C 2 173.600 174.467 -0.867 1
1 5 . 6 1 1 A 2 2 HIS CA C 2 56.500 55.934 0.566 1
1 6 . 6 1 1 A 2 2 HIS CB C 2 31.000 29.895 1.105 1
1 7 . 6 1 1 A 3 3 LYS H H 3 8.160 8.981 -0.821 1
1 8 . 6 1 1 A 3 3 LYS HA H 3 4.660 4.727 -0.067 1
1 17 . 6 1 1 A 3 3 LYS C C 3 174.400 176.083 -1.683 1
1 18 . 6 1 1 A 3 3 LYS CA C 3 54.800 55.713 -0.913 1
1 19 . 6 1 1 A 3 3 LYS CB C 3 35.800 33.980 1.820 1
1 23 . 6 1 1 A 3 3 LYS N N 3 121.900 125.008 -3.108 1
1 24 . 6 1 1 A 4 4 ASP H H 4 8.470 9.219 -0.749 1
1 25 . 6 1 1 A 4 4 ASP HA H 4 4.900 5.273 -0.373 1
1 28 . 6 1 1 A 4 4 ASP C C 4 176.900 175.386 1.514 1
1 29 . 6 1 1 A 4 4 ASP CA C 4 52.700 51.996 0.704 1
1 30 . 6 1 1 A 4 4 ASP CB C 4 44.100 42.929 1.171 1
1 31 . 6 1 1 A 4 4 ASP N N 4 117.900 121.805 -3.905 1
1 32 . 6 1 1 A 5 5 ILE H H 5 9.570 8.700 0.870 1
1 33 . 6 1 1 A 5 5 ILE HA H 5 3.640 4.575 -0.935 1
1 43 . 6 1 1 A 5 5 ILE C C 5 174.800 174.966 -0.166 1
1 44 . 6 1 1 A 5 5 ILE CA C 5 60.900 60.460 0.440 1
1 45 . 6 1 1 A 5 5 ILE CB C 5 37.000 38.868 -1.868 1
1 49 . 6 1 1 A 5 5 ILE N N 5 124.400 120.227 4.173 1
1 50 . 6 1 1 A 6 6 PHE H H 6 7.790 9.107 -1.317 1
1 51 . 6 1 1 A 6 6 PHE HA H 6 3.160 4.585 -1.425 1
1 58 . 6 1 1 A 6 6 PHE C C 6 173.500 174.572 -1.072 1
1 59 . 6 1 1 A 6 6 PHE CA C 6 56.900 58.232 -1.332 1
1 60 . 6 1 1 A 6 6 PHE CB C 6 40.100 39.362 0.738 1
1 65 . 6 1 1 A 6 6 PHE N N 6 130.200 129.316 0.884 1
1 66 . 6 1 1 A 7 7 THR H H 7 6.790 8.080 -1.290 1
1 67 . 6 1 1 A 7 7 THR HA H 7 4.530 4.937 -0.407 1
1 72 . 6 1 1 A 7 7 THR C C 7 172.300 171.921 0.379 1
1 73 . 6 1 1 A 7 7 THR CA C 7 59.200 59.864 -0.664 1
1 74 . 6 1 1 A 7 7 THR CB C 7 71.000 71.348 -0.348 1
1 76 . 6 1 1 A 7 7 THR N N 7 117.900 121.573 -3.673 1
1 77 . 6 1 1 A 8 8 SER H H 8 7.600 8.206 -0.606 1
1 78 . 6 1 1 A 8 8 SER HA H 8 4.180 4.792 -0.612 1
1 81 . 6 1 1 A 8 8 SER C C 8 175.300 172.226 3.074 1
1 82 . 6 1 1 A 8 8 SER CA C 8 55.800 57.422 -1.622 1
1 83 . 6 1 1 A 8 8 SER CB C 8 64.000 67.055 -3.055 1
1 84 . 6 1 1 A 8 8 SER N N 8 113.400 121.551 -8.151 1
1 85 . 6 1 1 A 9 9 VAL H H 9 8.880 8.789 0.091 1
1 86 . 6 1 1 A 9 9 VAL HA H 9 5.220 5.017 0.203 1
1 94 . 6 1 1 A 9 9 VAL C C 9 174.000 173.151 0.849 1
1 95 . 6 1 1 A 9 9 VAL CA C 9 59.100 59.572 -0.472 1
1 96 . 6 1 1 A 9 9 VAL CB C 9 36.500 34.288 2.212 1
1 99 . 6 1 1 A 9 9 VAL N N 9 114.700 121.323 -6.623 1
1 100 . 6 1 1 A 10 10 VAL H H 10 8.510 9.251 -0.741 1
1 101 . 6 1 1 A 10 10 VAL HA H 10 4.470 4.822 -0.352 1
1 109 . 6 1 1 A 10 10 VAL C C 10 173.700 174.677 -0.977 1
1 110 . 6 1 1 A 10 10 VAL CA C 10 59.400 59.486 -0.086 1
1 111 . 6 1 1 A 10 10 VAL CB C 10 36.000 35.085 0.915 1
1 114 . 6 1 1 A 10 10 VAL N N 10 117.100 127.530 -10.430 1
1 115 . 6 1 1 A 11 11 ARG H H 11 8.500 8.188 0.312 1
1 116 . 6 1 1 A 11 11 ARG HA H 11 4.460 4.619 -0.159 1
1 123 . 6 1 1 A 11 11 ARG C C 11 174.500 175.803 -1.303 1
1 124 . 6 1 1 A 11 11 ARG CA C 11 57.400 55.892 1.508 1
1 125 . 6 1 1 A 11 11 ARG CB C 11 31.000 30.844 0.156 1
1 128 . 6 1 1 A 11 11 ARG N N 11 124.800 125.940 -1.140 1
1 129 . 6 1 1 A 12 12 VAL H H 12 7.650 8.668 -1.018 1
1 130 . 6 1 1 A 12 12 VAL HA H 12 4.970 4.369 0.601 1
1 138 . 6 1 1 A 12 12 VAL C C 12 176.700 175.158 1.542 1
1 139 . 6 1 1 A 12 12 VAL CA C 12 59.400 62.237 -2.837 1
1 140 . 6 1 1 A 12 12 VAL CB C 12 34.400 32.317 2.083 1
1 143 . 6 1 1 A 12 12 VAL N N 12 120.900 124.567 -3.667 1
1 144 . 6 1 1 A 13 13 ARG H H 13 9.020 8.768 0.252 1
1 145 . 6 1 1 A 13 13 ARG HA H 13 4.700 5.204 -0.504 1
1 152 . 6 1 1 A 13 13 ARG C C 13 176.000 175.227 0.773 1
1 153 . 6 1 1 A 13 13 ARG CA C 13 54.600 54.496 0.104 1
1 154 . 6 1 1 A 13 13 ARG CB C 13 32.900 33.225 -0.325 1
1 157 . 6 1 1 A 13 13 ARG N N 13 127.500 128.398 -0.898 1
1 158 . 6 1 1 A 14 14 GLY H H 14 8.640 8.428 0.212 1
1 159 . 6 1 1 A 14 14 GLY HA2 H 14 3.680 4.155 -0.475 1
1 160 . 6 1 1 A 14 14 GLY HA3 H 14 4.190 4.158 0.032 1
1 161 . 6 1 1 A 14 14 GLY C C 14 173.700 173.605 0.095 1
1 162 . 6 1 1 A 14 14 GLY CA C 14 45.600 44.052 1.548 1
1 163 . 6 1 1 A 14 14 GLY N N 14 108.800 112.514 -3.714 1
1 164 . 6 1 1 A 15 15 SER H H 15 8.220 8.289 -0.069 1
1 165 . 6 1 1 A 15 15 SER HA H 15 5.020 4.932 0.088 1
1 168 . 6 1 1 A 15 15 SER C C 15 175.400 174.214 1.186 1
1 169 . 6 1 1 A 15 15 SER CA C 15 55.300 57.562 -2.262 1
1 170 . 6 1 1 A 15 15 SER CB C 15 64.900 63.973 0.927 1
1 171 . 6 1 1 A 15 15 SER N N 15 113.200 113.735 -0.535 1
1 172 . 6 1 1 A 16 16 LYS H H 16 9.930 8.450 1.480 1
1 173 . 6 1 1 A 16 16 LYS HA H 16 4.190 4.951 -0.761 1
1 182 . 6 1 1 A 16 16 LYS C C 16 176.500 175.535 0.965 1
1 183 . 6 1 1 A 16 16 LYS CA C 16 57.300 54.903 2.397 1
1 184 . 6 1 1 A 16 16 LYS CB C 16 32.300 34.560 -2.260 1
1 188 . 6 1 1 A 16 16 LYS N N 16 129.200 122.769 6.431 1
1 189 . 6 1 1 A 17 17 LYS H H 17 7.960 8.388 -0.428 1
1 190 . 6 1 1 A 17 17 LYS HA H 17 4.030 4.572 -0.542 1
1 199 . 6 1 1 A 17 17 LYS C C 17 175.600 174.783 0.817 1
1 200 . 6 1 1 A 17 17 LYS CA C 17 56.900 55.608 1.292 1
1 201 . 6 1 1 A 17 17 LYS CB C 17 34.700 32.694 2.006 1
1 205 . 6 1 1 A 17 17 LYS N N 17 118.500 118.012 0.488 1
1 206 . 6 1 1 A 18 18 TYR H H 18 7.780 7.800 -0.020 1
1 207 . 6 1 1 A 18 18 TYR HA H 18 4.760 5.104 -0.344 1
1 214 . 6 1 1 A 18 18 TYR C C 18 174.000 175.591 -1.591 1
1 215 . 6 1 1 A 18 18 TYR CA C 18 56.800 56.716 0.084 1
1 216 . 6 1 1 A 18 18 TYR CB C 18 41.100 42.723 -1.623 1
1 221 . 6 1 1 A 18 18 TYR N N 18 117.100 119.567 -2.467 1
1 222 . 6 1 1 A 19 19 ASN H H 19 8.890 8.978 -0.088 1
1 223 . 6 1 1 A 19 19 ASN HA H 19 4.960 5.066 -0.106 1
1 228 . 6 1 1 A 19 19 ASN C C 19 176.100 175.360 0.740 1
1 229 . 6 1 1 A 19 19 ASN CA C 19 53.600 54.537 -0.937 1
1 230 . 6 1 1 A 19 19 ASN CB C 19 40.300 40.801 -0.501 1
1 231 . 6 1 1 A 19 19 ASN N N 19 116.600 119.855 -3.255 1
1 233 . 6 1 1 A 20 20 VAL H H 20 7.730 7.753 -0.023 1
1 234 . 6 1 1 A 20 20 VAL HA H 20 5.250 5.078 0.172 1
1 242 . 6 1 1 A 20 20 VAL C C 20 173.800 174.135 -0.335 1
1 243 . 6 1 1 A 20 20 VAL CA C 20 59.400 59.651 -0.251 1
1 244 . 6 1 1 A 20 20 VAL CB C 20 37.600 35.458 2.142 1
1 247 . 6 1 1 A 20 20 VAL N N 20 113.900 113.609 0.291 1
1 248 . 6 1 1 A 21 21 VAL H H 21 8.890 9.277 -0.387 1
1 249 . 6 1 1 A 21 21 VAL HA H 21 4.840 4.817 0.023 1
1 257 . 6 1 1 A 21 21 VAL CA C 21 56.800 57.124 -0.324 1
1 258 . 6 1 1 A 21 21 VAL CB C 21 36.000 35.342 0.658 1
1 261 . 6 1 1 A 21 21 VAL N N 21 118.500 122.330 -3.830 1
1 262 . 6 1 1 A 22 22 PRO HA H 22 4.940 4.969 -0.029 1
1 269 . 6 1 1 A 22 22 PRO C C 22 175.600 176.598 -0.998 1
1 270 . 6 1 1 A 22 22 PRO CA C 22 62.700 62.328 0.372 1
1 271 . 6 1 1 A 22 22 PRO CB C 22 31.800 31.867 -0.067 1
1 274 . 6 1 1 A 23 23 VAL H H 23 8.060 8.682 -0.622 1
1 275 . 6 1 1 A 23 23 VAL HA H 23 5.390 4.942 0.448 1
1 283 . 6 1 1 A 23 23 VAL C C 23 175.400 174.316 1.084 1
1 284 . 6 1 1 A 23 23 VAL CA C 23 57.800 59.200 -1.400 1
1 285 . 6 1 1 A 23 23 VAL CB C 23 36.300 34.750 1.550 1
1 288 . 6 1 1 A 23 23 VAL N N 23 110.900 116.544 -5.644 1
1 289 . 6 1 1 A 24 24 LYS H H 24 8.960 9.363 -0.403 1
1 290 . 6 1 1 A 24 24 LYS HA H 24 5.600 4.946 0.654 1
1 299 . 6 1 1 A 24 24 LYS C C 24 175.600 174.182 1.418 1
1 300 . 6 1 1 A 24 24 LYS CA C 24 54.200 54.129 0.071 1
1 301 . 6 1 1 A 24 24 LYS CB C 24 37.000 36.127 0.873 1
1 305 . 6 1 1 A 24 24 LYS N N 24 117.900 120.636 -2.736 1
1 306 . 6 1 1 A 25 25 SER H H 25 8.950 8.439 0.511 1
1 307 . 6 1 1 A 25 25 SER HA H 25 5.190 4.863 0.327 1
1 310 . 6 1 1 A 25 25 SER C C 25 173.800 175.047 -1.247 1
1 311 . 6 1 1 A 25 25 SER CA C 25 57.700 58.161 -0.461 1
1 312 . 6 1 1 A 25 25 SER CB C 25 65.100 64.961 0.139 1
1 313 . 6 1 1 A 25 25 SER N N 25 114.600 117.520 -2.920 1
1 314 . 6 1 1 A 26 26 ASN H H 26 9.020 8.534 0.486 1
1 315 . 6 1 1 A 26 26 ASN HA H 26 4.370 4.622 -0.252 1
1 320 . 6 1 1 A 26 26 ASN C C 26 173.500 175.354 -1.854 1
1 321 . 6 1 1 A 26 26 ASN CA C 26 53.700 54.928 -1.228 1
1 322 . 6 1 1 A 26 26 ASN CB C 26 37.100 38.500 -1.400 1
1 323 . 6 1 1 A 26 26 ASN N N 26 118.300 121.875 -3.575 1
1 325 . 6 1 1 A 27 27 LYS H H 27 7.400 8.032 -0.632 1
1 326 . 6 1 1 A 27 27 LYS HA H 27 4.780 4.778 0.002 1
1 335 . 6 1 1 A 27 27 LYS CA C 27 53.500 52.937 0.563 1
1 336 . 6 1 1 A 27 27 LYS CB C 27 34.100 33.593 0.507 1
1 340 . 6 1 1 A 27 27 LYS N N 27 116.600 119.005 -2.405 1
1 341 . 6 1 1 A 28 28 PRO HA H 28 4.040 4.898 -0.858 1
1 348 . 6 1 1 A 28 28 PRO C C 28 174.500 176.305 -1.805 1
1 349 . 6 1 1 A 28 28 PRO CA C 28 63.200 62.749 0.451 1
1 350 . 6 1 1 A 28 28 PRO CB C 28 32.500 32.508 -0.008 1
1 353 . 6 1 1 A 29 29 VAL H H 29 8.860 8.990 -0.130 1
1 354 . 6 1 1 A 29 29 VAL HA H 29 4.420 4.746 -0.326 1
1 362 . 6 1 1 A 29 29 VAL C C 29 174.800 174.518 0.282 1
1 363 . 6 1 1 A 29 29 VAL CA C 29 60.300 60.360 -0.060 1
1 364 . 6 1 1 A 29 29 VAL CB C 29 36.400 34.379 2.021 1
1 367 . 6 1 1 A 29 29 VAL N N 29 119.800 121.478 -1.678 1
1 368 . 6 1 1 A 30 30 GLU H H 30 9.550 8.718 0.832 1
1 369 . 6 1 1 A 30 30 GLU HA H 30 4.260 4.576 -0.316 1
1 374 . 6 1 1 A 30 30 GLU C C 30 177.800 177.535 0.265 1
1 375 . 6 1 1 A 30 30 GLU CA C 30 58.000 55.337 2.663 1
1 376 . 6 1 1 A 30 30 GLU CB C 30 29.700 31.292 -1.592 1
1 378 . 6 1 1 A 30 30 GLU N N 30 128.900 122.162 6.738 1
1 379 . 6 1 1 A 31 31 ILE H H 31 7.910 8.760 -0.850 1
1 380 . 6 1 1 A 31 31 ILE HA H 31 2.120 4.431 -2.311 1
1 390 . 6 1 1 A 31 31 ILE C C 31 178.000 177.813 0.187 1
1 391 . 6 1 1 A 31 31 ILE CA C 31 63.500 63.899 -0.399 1
1 392 . 6 1 1 A 31 31 ILE CB C 31 37.200 38.046 -0.846 1
1 396 . 6 1 1 A 31 31 ILE N N 31 122.500 127.613 -5.113 1
1 397 . 6 1 1 A 32 32 SER H H 32 7.940 8.089 -0.149 1
1 398 . 6 1 1 A 32 32 SER HA H 32 4.070 4.208 -0.138 1
1 401 . 6 1 1 A 32 32 SER C C 32 175.800 175.163 0.637 1
1 402 . 6 1 1 A 32 32 SER CA C 32 60.200 62.311 -2.111 1
1 403 . 6 1 1 A 32 32 SER CB C 32 62.100 62.956 -0.856 1
1 404 . 6 1 1 A 32 32 SER N N 32 115.300 117.953 -2.653 1
1 405 . 6 1 1 A 33 33 LYS H H 33 7.640 7.629 0.011 1
1 406 . 6 1 1 A 33 33 LYS HA H 33 4.400 4.406 -0.006 1
1 415 . 6 1 1 A 33 33 LYS C C 33 176.600 176.664 -0.064 1
1 416 . 6 1 1 A 33 33 LYS CA C 33 56.200 55.636 0.564 1
1 417 . 6 1 1 A 33 33 LYS CB C 33 32.700 32.073 0.627 1
1 421 . 6 1 1 A 33 33 LYS N N 33 119.800 117.372 2.428 1
1 422 . 6 1 1 A 34 34 TRP H H 34 7.860 7.643 0.217 1
1 423 . 6 1 1 A 34 34 TRP HA H 34 3.870 4.317 -0.447 1
1 426 . 6 1 1 A 34 34 TRP C C 34 178.600 178.897 -0.297 1
1 427 . 6 1 1 A 34 34 TRP CA C 34 60.200 59.766 0.434 1
1 428 . 6 1 1 A 34 34 TRP CB C 34 28.500 29.589 -1.089 1
1 429 . 6 1 1 A 34 34 TRP N N 34 120.000 120.690 -0.690 1
1 430 . 6 1 1 A 35 35 ILE H H 35 8.200 8.196 0.004 1
1 431 . 6 1 1 A 35 35 ILE HA H 35 3.990 3.987 0.003 1
1 441 . 6 1 1 A 35 35 ILE C C 35 177.900 177.689 0.211 1
1 442 . 6 1 1 A 35 35 ILE CA C 35 64.300 62.838 1.462 1
1 443 . 6 1 1 A 35 35 ILE CB C 35 37.200 37.798 -0.598 1
1 447 . 6 1 1 A 35 35 ILE N N 35 119.500 120.330 -0.830 1
1 448 . 6 1 1 A 36 36 ASP H H 36 7.680 8.118 -0.438 1
1 449 . 6 1 1 A 36 36 ASP HA H 36 4.490 4.345 0.145 1
1 452 . 6 1 1 A 36 36 ASP C C 36 179.200 178.748 0.452 1
1 453 . 6 1 1 A 36 36 ASP CA C 36 57.500 57.277 0.223 1
1 454 . 6 1 1 A 36 36 ASP CB C 36 40.400 40.929 -0.529 1
1 455 . 6 1 1 A 36 36 ASP N N 36 122.000 121.835 0.165 1
1 456 . 6 1 1 A 37 37 PHE H H 37 8.450 7.998 0.452 1
1 457 . 6 1 1 A 37 37 PHE HA H 37 4.080 3.985 0.095 1
1 465 . 6 1 1 A 37 37 PHE C C 37 178.300 178.382 -0.082 1
1 466 . 6 1 1 A 37 37 PHE CA C 37 58.600 60.304 -1.704 1
1 467 . 6 1 1 A 37 37 PHE CB C 37 37.000 37.377 -0.377 1
1 473 . 6 1 1 A 37 37 PHE N N 37 119.800 118.498 1.302 1
1 474 . 6 1 1 A 38 38 SER H H 38 8.580 8.388 0.192 1
1 475 . 6 1 1 A 38 38 SER HA H 38 4.250 4.264 -0.014 1
1 478 . 6 1 1 A 38 38 SER C C 38 176.800 177.359 -0.559 1
1 479 . 6 1 1 A 38 38 SER CA C 38 62.700 61.566 1.134 1
1 480 . 6 1 1 A 38 38 SER CB C 38 62.700 63.167 -0.467 1
1 481 . 6 1 1 A 38 38 SER N N 38 115.800 115.512 0.288 1
1 482 . 6 1 1 A 39 39 ASN H H 39 8.190 8.272 -0.082 1
1 483 . 6 1 1 A 39 39 ASN HA H 39 4.540 4.456 0.084 1
1 488 . 6 1 1 A 39 39 ASN C C 39 178.500 177.888 0.612 1
1 489 . 6 1 1 A 39 39 ASN CA C 39 56.200 56.920 -0.720 1
1 490 . 6 1 1 A 39 39 ASN CB C 39 37.900 39.374 -1.474 1
1 491 . 6 1 1 A 39 39 ASN N N 39 121.300 119.754 1.546 1
1 493 . 6 1 1 A 40 40 VAL H H 40 7.840 7.785 0.055 1
1 494 . 6 1 1 A 40 40 VAL HA H 40 3.650 3.595 0.055 1
1 502 . 6 1 1 A 40 40 VAL C C 40 179.000 178.155 0.845 1
1 503 . 6 1 1 A 40 40 VAL CA C 40 66.600 66.395 0.205 1
1 504 . 6 1 1 A 40 40 VAL CB C 40 32.100 31.633 0.467 1
1 507 . 6 1 1 A 40 40 VAL N N 40 121.800 118.951 2.849 1
1 508 . 6 1 1 A 41 41 LEU H H 41 8.210 8.324 -0.114 1
1 509 . 6 1 1 A 41 41 LEU HA H 41 3.840 4.023 -0.183 1
1 519 . 6 1 1 A 41 41 LEU C C 41 178.800 178.792 0.008 1
1 520 . 6 1 1 A 41 41 LEU CA C 41 57.400 57.645 -0.245 1
1 521 . 6 1 1 A 41 41 LEU CB C 41 41.200 40.760 0.440 1
1 525 . 6 1 1 A 41 41 LEU N N 41 117.700 118.681 -0.981 1
1 526 . 6 1 1 A 42 42 SER H H 42 7.980 7.994 -0.014 1
1 527 . 6 1 1 A 42 42 SER HA H 42 4.260 4.281 -0.021 1
1 530 . 6 1 1 A 42 42 SER C C 42 174.900 175.211 -0.311 1
1 531 . 6 1 1 A 42 42 SER CA C 42 61.200 60.582 0.618 1
1 532 . 6 1 1 A 42 42 SER CB C 42 63.100 63.036 0.064 1
1 533 . 6 1 1 A 42 42 SER N N 42 113.200 113.989 -0.789 1
1 534 . 6 1 1 A 43 43 ARG H H 43 7.100 7.855 -0.755 1
1 535 . 6 1 1 A 43 43 ARG HA H 43 4.500 4.577 -0.077 1
1 542 . 6 1 1 A 43 43 ARG C C 43 175.800 175.178 0.622 1
1 543 . 6 1 1 A 43 43 ARG CA C 43 55.600 55.913 -0.313 1
1 544 . 6 1 1 A 43 43 ARG CB C 43 30.800 31.174 -0.374 1
1 547 . 6 1 1 A 43 43 ARG N N 43 118.400 116.567 1.833 1
1 548 . 6 1 1 A 44 44 LEU H H 44 7.610 7.239 0.371 1
1 549 . 6 1 1 A 44 44 LEU HA H 44 4.590 4.916 -0.326 1
1 559 . 6 1 1 A 44 44 LEU C C 44 175.300 174.250 1.050 1
1 560 . 6 1 1 A 44 44 LEU CA C 44 53.900 53.430 0.470 1
1 561 . 6 1 1 A 44 44 LEU CB C 44 44.100 44.955 -0.855 1
1 565 . 6 1 1 A 44 44 LEU N N 44 120.400 122.688 -2.288 1
1 566 . 6 1 1 A 45 45 TYR H H 45 7.630 9.209 -1.579 1
1 567 . 6 1 1 A 45 45 TYR HA H 45 5.180 5.061 0.119 1
1 574 . 6 1 1 A 45 45 TYR C C 45 174.600 174.304 0.296 1
1 575 . 6 1 1 A 45 45 TYR CA C 45 56.300 56.527 -0.227 1
1 576 . 6 1 1 A 45 45 TYR CB C 45 41.400 39.577 1.823 1
1 581 . 6 1 1 A 45 45 TYR N N 45 115.300 126.326 -11.026 1
1 582 . 6 1 1 A 46 46 VAL H H 46 8.770 9.020 -0.250 1
1 583 . 6 1 1 A 46 46 VAL HA H 46 4.540 4.921 -0.381 1
1 591 . 6 1 1 A 46 46 VAL C C 46 174.600 175.588 -0.988 1
1 592 . 6 1 1 A 46 46 VAL CA C 46 59.600 61.035 -1.435 1
1 593 . 6 1 1 A 46 46 VAL CB C 46 34.700 34.408 0.292 1
1 596 . 6 1 1 A 46 46 VAL N N 46 115.400 124.557 -9.157 1
1 597 . 6 1 1 A 47 47 GLY H H 47 8.280 8.566 -0.286 1
1 598 . 6 1 1 A 47 47 GLY HA2 H 47 3.610 4.169 -0.559 1
1 599 . 6 1 1 A 47 47 GLY HA3 H 47 4.970 4.177 0.793 1
1 600 . 6 1 1 A 47 47 GLY C C 47 173.100 173.623 -0.523 1
1 601 . 6 1 1 A 47 47 GLY CA C 47 43.600 44.555 -0.955 1
1 602 . 6 1 1 A 47 47 GLY N N 47 109.900 113.626 -3.726 1
1 603 . 6 1 1 A 48 48 VAL H H 48 7.630 8.587 -0.957 1
1 604 . 6 1 1 A 48 48 VAL HA H 48 4.320 3.653 0.667 1
1 612 . 6 1 1 A 48 48 VAL CA C 48 58.700 62.558 -3.858 1
1 613 . 6 1 1 A 48 48 VAL CB C 48 32.100 30.338 1.762 1
1 616 . 6 1 1 A 48 48 VAL N N 48 109.900 117.837 -7.937 1
1 617 . 6 1 1 A 49 49 PRO HA H 49 4.800 4.433 0.367 1
1 624 . 6 1 1 A 49 49 PRO C C 49 176.700 176.099 0.601 1
1 625 . 6 1 1 A 49 49 PRO CA C 49 62.300 63.058 -0.758 1
1 626 . 6 1 1 A 49 49 PRO CB C 49 35.400 31.880 3.520 1
1 629 . 6 1 1 A 50 50 THR H H 50 8.790 8.402 0.388 1
1 630 . 6 1 1 A 50 50 THR HA H 50 4.690 5.121 -0.431 1
1 635 . 6 1 1 A 50 50 THR C C 50 173.500 173.755 -0.255 1
1 636 . 6 1 1 A 50 50 THR CA C 50 60.800 59.426 1.374 1
1 637 . 6 1 1 A 50 50 THR CB C 50 70.800 72.356 -1.556 1
1 639 . 6 1 1 A 50 50 THR N N 50 113.500 112.503 0.997 1
1 640 . 6 1 1 A 51 51 LYS H H 51 7.810 8.251 -0.441 1
1 641 . 6 1 1 A 51 51 LYS HA H 51 4.890 4.570 0.320 1
1 650 . 6 1 1 A 51 51 LYS C C 51 175.900 176.047 -0.147 1
1 651 . 6 1 1 A 51 51 LYS CA C 51 54.100 55.227 -1.127 1
1 652 . 6 1 1 A 51 51 LYS CB C 51 35.300 33.704 1.596 1
1 656 . 6 1 1 A 51 51 LYS N N 51 122.200 120.679 1.521 1
1 657 . 6 1 1 A 52 52 SER H H 52 8.410 8.562 -0.152 1
1 658 . 6 1 1 A 52 52 SER HA H 52 3.630 4.152 -0.522 1
1 661 . 6 1 1 A 52 52 SER C C 52 175.800 175.250 0.550 1
1 662 . 6 1 1 A 52 52 SER CA C 52 58.800 59.817 -1.017 1
1 663 . 6 1 1 A 52 52 SER CB C 52 62.600 62.817 -0.217 1
1 664 . 6 1 1 A 52 52 SER N N 52 118.900 116.581 2.319 1
1 665 . 6 1 1 A 53 53 GLY H H 53 9.070 9.220 -0.150 1
1 666 . 6 1 1 A 53 53 GLY HA2 H 53 3.390 3.897 -0.507 1
1 667 . 6 1 1 A 53 53 GLY HA3 H 53 4.460 3.899 0.561 1
1 668 . 6 1 1 A 53 53 GLY C C 53 174.100 174.228 -0.128 1
1 669 . 6 1 1 A 53 53 GLY CA C 53 44.800 45.449 -0.649 1
1 670 . 6 1 1 A 53 53 GLY N N 53 115.600 114.896 0.704 1
1 671 . 6 1 1 A 54 54 ASN H H 54 7.870 7.735 0.135 1
1 672 . 6 1 1 A 54 54 ASN HA H 54 4.570 4.861 -0.291 1
1 677 . 6 1 1 A 54 54 ASN C C 54 175.500 174.641 0.859 1
1 678 . 6 1 1 A 54 54 ASN CA C 54 53.000 52.407 0.593 1
1 679 . 6 1 1 A 54 54 ASN CB C 54 38.600 39.483 -0.883 1
1 680 . 6 1 1 A 54 54 ASN N N 54 119.600 118.618 0.982 1
1 682 . 6 1 1 A 55 55 VAL H H 55 8.770 8.848 -0.078 1
1 683 . 6 1 1 A 55 55 VAL HA H 55 3.880 4.046 -0.166 1
1 691 . 6 1 1 A 55 55 VAL C C 55 176.200 175.238 0.962 1
1 692 . 6 1 1 A 55 55 VAL CA C 55 63.700 62.950 0.750 1
1 693 . 6 1 1 A 55 55 VAL CB C 55 31.600 31.178 0.422 1
1 696 . 6 1 1 A 55 55 VAL N N 55 123.900 122.863 1.037 1
1 697 . 6 1 1 A 56 56 VAL H H 56 9.050 8.967 0.083 1
1 698 . 6 1 1 A 56 56 VAL HA H 56 3.990 3.962 0.028 1
1 706 . 6 1 1 A 56 56 VAL C C 56 175.200 176.161 -0.961 1
1 707 . 6 1 1 A 56 56 VAL CA C 56 62.700 64.155 -1.455 1
1 708 . 6 1 1 A 56 56 VAL CB C 56 32.900 32.589 0.311 1
1 711 . 6 1 1 A 56 56 VAL N N 56 127.500 128.581 -1.081 1
1 712 . 6 1 1 A 57 57 CYS H H 57 7.250 7.777 -0.527 1
1 713 . 6 1 1 A 57 57 CYS HA H 57 4.370 4.805 -0.435 1
1 716 . 6 1 1 A 57 57 CYS C C 57 171.900 172.764 -0.864 1
1 717 . 6 1 1 A 57 57 CYS CA C 57 58.600 57.327 1.273 1
1 718 . 6 1 1 A 57 57 CYS CB C 57 28.600 30.603 -2.003 1
1 719 . 6 1 1 A 57 57 CYS N N 57 117.600 116.884 0.716 1
1 720 . 6 1 1 A 58 58 LYS H H 58 8.880 8.710 0.170 1
1 721 . 6 1 1 A 58 58 LYS HA H 58 4.220 4.583 -0.363 1
1 730 . 6 1 1 A 58 58 LYS C C 58 176.000 176.110 -0.110 1
1 731 . 6 1 1 A 58 58 LYS CA C 58 54.400 55.142 -0.742 1
1 732 . 6 1 1 A 58 58 LYS CB C 58 33.600 34.330 -0.730 1
1 736 . 6 1 1 A 58 58 LYS N N 58 132.000 128.437 3.563 1
1 737 . 6 1 1 A 59 59 ASN H H 59 9.500 8.543 0.957 1
1 738 . 6 1 1 A 59 59 ASN HA H 59 4.040 4.185 -0.145 1
1 743 . 6 1 1 A 59 59 ASN C C 59 176.400 174.224 2.176 1
1 744 . 6 1 1 A 59 59 ASN CA C 59 53.200 54.184 -0.984 1
1 745 . 6 1 1 A 59 59 ASN CB C 59 35.900 36.911 -1.011 1
1 746 . 6 1 1 A 59 59 ASN N N 59 127.500 120.736 6.764 1
1 748 . 6 1 1 A 60 60 ILE H H 60 8.050 7.187 0.863 1
1 749 . 6 1 1 A 60 60 ILE HA H 60 3.680 3.769 -0.089 1
1 759 . 6 1 1 A 60 60 ILE C C 60 175.700 176.698 -0.998 1
1 760 . 6 1 1 A 60 60 ILE CA C 60 61.900 62.425 -0.525 1
1 761 . 6 1 1 A 60 60 ILE CB C 60 38.300 37.345 0.955 1
1 765 . 6 1 1 A 60 60 ILE N N 60 120.200 119.751 0.449 1
1 766 . 6 1 1 A 61 61 MET H H 61 9.590 9.438 0.152 1
1 767 . 6 1 1 A 61 61 MET HA H 61 3.920 4.177 -0.257 1
1 775 . 6 1 1 A 61 61 MET C C 61 174.300 176.015 -1.715 1
1 776 . 6 1 1 A 61 61 MET CA C 61 57.000 56.926 0.074 1
1 777 . 6 1 1 A 61 61 MET CB C 61 31.300 31.245 0.055 1
1 780 . 6 1 1 A 61 61 MET N N 61 124.400 126.997 -2.597 1
1 781 . 6 1 1 A 62 62 ASN H H 62 8.250 8.678 -0.428 1
1 782 . 6 1 1 A 62 62 ASN HA H 62 4.400 4.488 -0.088 1
1 787 . 6 1 1 A 62 62 ASN C C 62 176.800 176.184 0.616 1
1 788 . 6 1 1 A 62 62 ASN CA C 62 54.400 54.557 -0.157 1
1 789 . 6 1 1 A 62 62 ASN CB C 62 37.600 38.427 -0.827 1
1 790 . 6 1 1 A 62 62 ASN N N 62 111.900 116.141 -4.241 1
1 792 . 6 1 1 A 63 63 THR H H 63 7.480 7.804 -0.324 1
1 793 . 6 1 1 A 63 63 THR HA H 63 4.210 4.225 -0.015 1
1 798 . 6 1 1 A 63 63 THR C C 63 177.100 175.662 1.438 1
1 799 . 6 1 1 A 63 63 THR CA C 63 62.900 63.579 -0.679 1
1 800 . 6 1 1 A 63 63 THR CB C 63 72.500 70.234 2.266 1
1 802 . 6 1 1 A 63 63 THR N N 63 105.900 112.649 -6.749 1
1 803 . 6 1 1 A 64 64 GLY H H 64 9.110 7.949 1.161 1
1 804 . 6 1 1 A 64 64 GLY HA2 H 64 3.580 4.008 -0.428 1
1 805 . 6 1 1 A 64 64 GLY HA3 H 64 4.090 4.018 0.072 1
1 806 . 6 1 1 A 64 64 GLY C C 64 173.200 174.388 -1.188 1
1 807 . 6 1 1 A 64 64 GLY CA C 64 45.300 45.011 0.289 1
1 808 . 6 1 1 A 64 64 GLY N N 64 111.500 111.139 0.361 1
1 809 . 6 1 1 A 65 65 VAL H H 65 7.580 7.300 0.280 1
1 810 . 6 1 1 A 65 65 VAL HA H 65 4.060 3.966 0.094 1
1 818 . 6 1 1 A 65 65 VAL C C 65 172.900 174.822 -1.922 1
1 819 . 6 1 1 A 65 65 VAL CA C 65 61.400 62.353 -0.953 1
1 820 . 6 1 1 A 65 65 VAL CB C 65 32.900 31.995 0.905 1
1 823 . 6 1 1 A 65 65 VAL N N 65 121.600 122.106 -0.506 1
1 824 . 6 1 1 A 66 66 ASP H H 66 8.210 8.918 -0.708 1
1 825 . 6 1 1 A 66 66 ASP HA H 66 5.320 4.979 0.341 1
1 828 . 6 1 1 A 66 66 ASP C C 66 174.800 175.033 -0.233 1
1 829 . 6 1 1 A 66 66 ASP CA C 66 51.700 53.395 -1.695 1
1 830 . 6 1 1 A 66 66 ASP CB C 66 43.200 41.555 1.645 1
1 831 . 6 1 1 A 66 66 ASP N N 66 123.100 127.029 -3.929 1
1 832 . 6 1 1 A 67 67 ILE H H 67 8.540 8.814 -0.274 1
1 833 . 6 1 1 A 67 67 ILE HA H 67 4.630 4.464 0.166 1
1 843 . 6 1 1 A 67 67 ILE C C 67 175.600 175.684 -0.084 1
1 844 . 6 1 1 A 67 67 ILE CA C 67 56.900 60.915 -4.015 1
1 845 . 6 1 1 A 67 67 ILE CB C 67 35.300 36.932 -1.632 1
1 849 . 6 1 1 A 67 67 ILE N N 67 119.200 125.394 -6.194 1
1 850 . 6 1 1 A 68 68 ILE H H 68 9.420 8.666 0.754 1
1 851 . 6 1 1 A 68 68 ILE HA H 68 4.980 5.239 -0.259 1
1 861 . 6 1 1 A 68 68 ILE C C 68 175.000 174.249 0.751 1
1 862 . 6 1 1 A 68 68 ILE CA C 68 58.600 58.891 -0.291 1
1 863 . 6 1 1 A 68 68 ILE CB C 68 40.900 40.192 0.708 1
1 867 . 6 1 1 A 68 68 ILE N N 68 125.000 123.884 1.116 1
1 868 . 6 1 1 A 69 69 CYS H H 69 8.870 9.326 -0.456 1
1 869 . 6 1 1 A 69 69 CYS HA H 69 4.610 4.903 -0.293 1
1 872 . 6 1 1 A 69 69 CYS C C 69 176.200 175.032 1.168 1
1 873 . 6 1 1 A 69 69 CYS CA C 69 58.900 57.981 0.919 1
1 874 . 6 1 1 A 69 69 CYS CB C 69 27.100 29.389 -2.289 1
1 875 . 6 1 1 A 69 69 CYS N N 69 122.300 123.318 -1.018 1
1 876 . 6 1 1 A 70 70 THR H H 70 8.270 8.333 -0.063 1
1 877 . 6 1 1 A 70 70 THR HA H 70 4.710 4.547 0.163 1
1 882 . 6 1 1 A 70 70 THR C C 70 173.600 173.826 -0.226 1
1 883 . 6 1 1 A 70 70 THR CA C 70 61.500 61.253 0.247 1
1 884 . 6 1 1 A 70 70 THR CB C 70 68.100 69.391 -1.291 1
1 886 . 6 1 1 A 70 70 THR N N 70 116.700 119.137 -2.437 1
1 887 . 6 1 1 A 71 71 LYS H H 71 7.370 7.190 0.180 1
1 888 . 6 1 1 A 71 71 LYS HA H 71 4.520 4.706 -0.186 1
1 897 . 6 1 1 A 71 71 LYS CA C 71 55.100 54.929 0.171 1
1 898 . 6 1 1 A 71 71 LYS CB C 71 37.800 34.209 3.591 1
1 902 . 6 1 1 A 71 71 LYS N N 71 120.900 123.057 -2.157 1
1 903 . 6 1 1 A 72 72 ASN H H 72 8.580 8.652 -0.072 1
1 904 . 6 1 1 A 72 72 ASN HA H 72 4.620 4.950 -0.330 1
1 909 . 6 1 1 A 72 72 ASN C C 72 173.500 174.152 -0.652 1
1 910 . 6 1 1 A 72 72 ASN CA C 72 52.200 52.417 -0.217 1
1 911 . 6 1 1 A 72 72 ASN CB C 72 38.500 38.791 -0.291 1
1 912 . 6 1 1 A 72 72 ASN N N 72 122.700 123.749 -1.049 1
1 914 . 6 1 1 A 73 73 LEU H H 73 8.100 9.530 -1.430 1
1 915 . 6 1 1 A 73 73 LEU HA H 73 4.680 4.479 0.201 1
1 925 . 6 1 1 A 73 73 LEU CA C 73 51.000 50.835 0.165 1
1 926 . 6 1 1 A 73 73 LEU CB C 73 42.500 42.260 0.240 1
1 930 . 6 1 1 A 73 73 LEU N N 73 125.100 125.266 -0.166 1
1 931 . 6 1 1 A 74 74 PRO HA H 74 4.670 4.743 -0.073 1
1 938 . 6 1 1 A 74 74 PRO C C 74 176.500 177.589 -1.089 1
1 939 . 6 1 1 A 74 74 PRO CA C 74 61.800 62.520 -0.720 1
1 940 . 6 1 1 A 74 74 PRO CB C 74 32.800 31.509 1.291 1
1 943 . 6 1 1 A 75 75 LYS H H 75 8.280 8.770 -0.490 1
1 944 . 6 1 1 A 75 75 LYS HA H 75 4.110 3.918 0.192 1
1 953 . 6 1 1 A 75 75 LYS CA C 75 56.500 59.396 -2.896 1
1 954 . 6 1 1 A 75 75 LYS CB C 75 33.300 33.041 0.259 1
1 958 . 6 1 1 A 75 75 LYS N N 75 117.000 125.539 -8.539 1
1 959 . 6 1 1 A 76 76 ASP H H 76 8.570 7.993 0.577 1
1 960 . 6 1 1 A 76 76 ASP HA H 76 4.530 4.881 -0.351 1
1 963 . 6 1 1 A 76 76 ASP C C 76 176.300 176.583 -0.283 1
1 964 . 6 1 1 A 76 76 ASP CA C 76 55.000 53.455 1.545 1
1 965 . 6 1 1 A 76 76 ASP CB C 76 41.100 42.158 -1.058 1
1 966 . 6 1 1 A 76 76 ASP N N 76 122.700 114.820 7.880 1
1 967 . 6 1 1 A 77 77 SER H H 77 8.330 8.090 0.240 1
1 968 . 6 1 1 A 77 77 SER HA H 77 4.410 4.750 -0.340 1
1 971 . 6 1 1 A 77 77 SER C C 77 174.300 173.911 0.389 1
1 972 . 6 1 1 A 77 77 SER CA C 77 58.000 57.866 0.134 1
1 973 . 6 1 1 A 77 77 SER CB C 77 63.900 63.116 0.784 1
1 974 . 6 1 1 A 77 77 SER N N 77 116.100 114.180 1.920 1
1 975 . 6 1 1 A 78 78 LEU H H 78 8.350 7.428 0.922 1
1 976 . 6 1 1 A 78 78 LEU HA H 78 4.280 4.474 -0.194 1
1 986 . 6 1 1 A 78 78 LEU C C 78 177.200 175.180 2.020 1
1 987 . 6 1 1 A 78 78 LEU CA C 78 55.200 54.671 0.529 1
1 988 . 6 1 1 A 78 78 LEU CB C 78 42.100 42.871 -0.771 1
1 992 . 6 1 1 A 78 78 LEU N N 78 124.300 124.107 0.193 1
1 993 . 6 1 1 A 79 79 GLU H H 79 8.300 8.462 -0.162 1
1 994 . 6 1 1 A 79 79 GLU CA C 79 56.400 54.618 1.782 1
1 995 . 6 1 1 A 79 79 GLU CB C 79 30.200 32.628 -2.428 1
1 1 . 7 1 1 A 2 2 HIS HA H 2 4.640 4.796 -0.156 1
1 4 . 7 1 1 A 2 2 HIS C C 2 173.600 173.031 0.569 1
1 5 . 7 1 1 A 2 2 HIS CA C 2 56.500 56.095 0.405 1
1 6 . 7 1 1 A 2 2 HIS CB C 2 31.000 31.731 -0.731 1
1 7 . 7 1 1 A 3 3 LYS H H 3 8.160 8.707 -0.547 1
1 8 . 7 1 1 A 3 3 LYS HA H 3 4.660 5.390 -0.730 1
1 17 . 7 1 1 A 3 3 LYS C C 3 174.400 175.053 -0.653 1
1 18 . 7 1 1 A 3 3 LYS CA C 3 54.800 54.580 0.220 1
1 19 . 7 1 1 A 3 3 LYS CB C 3 35.800 35.527 0.273 1
1 23 . 7 1 1 A 3 3 LYS N N 3 121.900 125.851 -3.951 1
1 24 . 7 1 1 A 4 4 ASP H H 4 8.470 9.064 -0.594 1
1 25 . 7 1 1 A 4 4 ASP HA H 4 4.900 5.180 -0.280 1
1 28 . 7 1 1 A 4 4 ASP C C 4 176.900 174.634 2.266 1
1 29 . 7 1 1 A 4 4 ASP CA C 4 52.700 52.894 -0.194 1
1 30 . 7 1 1 A 4 4 ASP CB C 4 44.100 44.791 -0.691 1
1 31 . 7 1 1 A 4 4 ASP N N 4 117.900 122.465 -4.565 1
1 32 . 7 1 1 A 5 5 ILE H H 5 9.570 8.647 0.923 1
1 33 . 7 1 1 A 5 5 ILE HA H 5 3.640 4.108 -0.468 1
1 43 . 7 1 1 A 5 5 ILE C C 5 174.800 175.655 -0.855 1
1 44 . 7 1 1 A 5 5 ILE CA C 5 60.900 61.950 -1.050 1
1 45 . 7 1 1 A 5 5 ILE CB C 5 37.000 37.423 -0.423 1
1 49 . 7 1 1 A 5 5 ILE N N 5 124.400 122.829 1.571 1
1 50 . 7 1 1 A 6 6 PHE H H 6 7.790 9.016 -1.226 1
1 51 . 7 1 1 A 6 6 PHE HA H 6 3.160 4.782 -1.622 1
1 58 . 7 1 1 A 6 6 PHE C C 6 173.500 174.377 -0.877 1
1 59 . 7 1 1 A 6 6 PHE CA C 6 56.900 57.303 -0.403 1
1 60 . 7 1 1 A 6 6 PHE CB C 6 40.100 39.042 1.058 1
1 65 . 7 1 1 A 6 6 PHE N N 6 130.200 128.867 1.333 1
1 66 . 7 1 1 A 7 7 THR H H 7 6.790 8.542 -1.752 1
1 67 . 7 1 1 A 7 7 THR HA H 7 4.530 5.288 -0.758 1
1 72 . 7 1 1 A 7 7 THR C C 7 172.300 172.985 -0.685 1
1 73 . 7 1 1 A 7 7 THR CA C 7 59.200 59.545 -0.345 1
1 74 . 7 1 1 A 7 7 THR CB C 7 71.000 71.444 -0.444 1
1 76 . 7 1 1 A 7 7 THR N N 7 117.900 122.061 -4.161 1
1 77 . 7 1 1 A 8 8 SER H H 8 7.600 8.377 -0.777 1
1 78 . 7 1 1 A 8 8 SER HA H 8 4.180 4.845 -0.665 1
1 81 . 7 1 1 A 8 8 SER C C 8 175.300 172.557 2.743 1
1 82 . 7 1 1 A 8 8 SER CA C 8 55.800 57.112 -1.312 1
1 83 . 7 1 1 A 8 8 SER CB C 8 64.000 66.887 -2.887 1
1 84 . 7 1 1 A 8 8 SER N N 8 113.400 124.122 -10.722 1
1 85 . 7 1 1 A 9 9 VAL H H 9 8.880 8.342 0.538 1
1 86 . 7 1 1 A 9 9 VAL HA H 9 5.220 4.829 0.391 1
1 94 . 7 1 1 A 9 9 VAL C C 9 174.000 174.274 -0.274 1
1 95 . 7 1 1 A 9 9 VAL CA C 9 59.100 60.894 -1.794 1
1 96 . 7 1 1 A 9 9 VAL CB C 9 36.500 35.091 1.409 1
1 99 . 7 1 1 A 9 9 VAL N N 9 114.700 119.851 -5.151 1
1 100 . 7 1 1 A 10 10 VAL H H 10 8.510 8.934 -0.424 1
1 101 . 7 1 1 A 10 10 VAL HA H 10 4.470 4.824 -0.354 1
1 109 . 7 1 1 A 10 10 VAL C C 10 173.700 174.839 -1.139 1
1 110 . 7 1 1 A 10 10 VAL CA C 10 59.400 59.476 -0.076 1
1 111 . 7 1 1 A 10 10 VAL CB C 10 36.000 35.121 0.879 1
1 114 . 7 1 1 A 10 10 VAL N N 10 117.100 128.018 -10.918 1
1 115 . 7 1 1 A 11 11 ARG H H 11 8.500 8.478 0.022 1
1 116 . 7 1 1 A 11 11 ARG HA H 11 4.460 4.701 -0.241 1
1 123 . 7 1 1 A 11 11 ARG C C 11 174.500 176.179 -1.679 1
1 124 . 7 1 1 A 11 11 ARG CA C 11 57.400 56.093 1.307 1
1 125 . 7 1 1 A 11 11 ARG CB C 11 31.000 31.025 -0.025 1
1 128 . 7 1 1 A 11 11 ARG N N 11 124.800 126.562 -1.762 1
1 129 . 7 1 1 A 12 12 VAL H H 12 7.650 9.426 -1.776 1
1 130 . 7 1 1 A 12 12 VAL HA H 12 4.970 5.365 -0.395 1
1 138 . 7 1 1 A 12 12 VAL C C 12 176.700 175.090 1.610 1
1 139 . 7 1 1 A 12 12 VAL CA C 12 59.400 60.958 -1.558 1
1 140 . 7 1 1 A 12 12 VAL CB C 12 34.400 34.238 0.162 1
1 143 . 7 1 1 A 12 12 VAL N N 12 120.900 123.791 -2.891 1
1 144 . 7 1 1 A 13 13 ARG H H 13 9.020 9.105 -0.085 1
1 145 . 7 1 1 A 13 13 ARG HA H 13 4.700 4.836 -0.136 1
1 152 . 7 1 1 A 13 13 ARG C C 13 176.000 175.619 0.381 1
1 153 . 7 1 1 A 13 13 ARG CA C 13 54.600 54.791 -0.191 1
1 154 . 7 1 1 A 13 13 ARG CB C 13 32.900 33.415 -0.515 1
1 157 . 7 1 1 A 13 13 ARG N N 13 127.500 123.964 3.536 1
1 158 . 7 1 1 A 14 14 GLY H H 14 8.640 8.408 0.232 1
1 159 . 7 1 1 A 14 14 GLY HA2 H 14 3.680 4.113 -0.433 1
1 160 . 7 1 1 A 14 14 GLY HA3 H 14 4.190 4.121 0.069 1
1 161 . 7 1 1 A 14 14 GLY C C 14 173.700 173.887 -0.187 1
1 162 . 7 1 1 A 14 14 GLY CA C 14 45.600 44.176 1.424 1
1 163 . 7 1 1 A 14 14 GLY N N 14 108.800 108.673 0.127 1
1 164 . 7 1 1 A 15 15 SER H H 15 8.220 8.459 -0.239 1
1 165 . 7 1 1 A 15 15 SER HA H 15 5.020 4.747 0.273 1
1 168 . 7 1 1 A 15 15 SER C C 15 175.400 173.701 1.699 1
1 169 . 7 1 1 A 15 15 SER CA C 15 55.300 58.873 -3.573 1
1 170 . 7 1 1 A 15 15 SER CB C 15 64.900 62.714 2.186 1
1 171 . 7 1 1 A 15 15 SER N N 15 113.200 116.736 -3.536 1
1 172 . 7 1 1 A 16 16 LYS H H 16 9.930 8.021 1.909 1
1 173 . 7 1 1 A 16 16 LYS HA H 16 4.190 4.910 -0.720 1
1 182 . 7 1 1 A 16 16 LYS C C 16 176.500 176.003 0.497 1
1 183 . 7 1 1 A 16 16 LYS CA C 16 57.300 54.806 2.494 1
1 184 . 7 1 1 A 16 16 LYS CB C 16 32.300 34.147 -1.847 1
1 188 . 7 1 1 A 16 16 LYS N N 16 129.200 123.551 5.649 1
1 189 . 7 1 1 A 17 17 LYS H H 17 7.960 8.274 -0.314 1
1 190 . 7 1 1 A 17 17 LYS HA H 17 4.030 4.344 -0.314 1
1 199 . 7 1 1 A 17 17 LYS C C 17 175.600 176.648 -1.048 1
1 200 . 7 1 1 A 17 17 LYS CA C 17 56.900 57.709 -0.809 1
1 201 . 7 1 1 A 17 17 LYS CB C 17 34.700 33.621 1.079 1
1 205 . 7 1 1 A 17 17 LYS N N 17 118.500 119.264 -0.764 1
1 206 . 7 1 1 A 18 18 TYR H H 18 7.780 7.850 -0.070 1
1 207 . 7 1 1 A 18 18 TYR HA H 18 4.760 4.581 0.179 1
1 214 . 7 1 1 A 18 18 TYR C C 18 174.000 176.220 -2.220 1
1 215 . 7 1 1 A 18 18 TYR CA C 18 56.800 59.175 -2.375 1
1 216 . 7 1 1 A 18 18 TYR CB C 18 41.100 38.513 2.587 1
1 221 . 7 1 1 A 18 18 TYR N N 18 117.100 118.186 -1.086 1
1 222 . 7 1 1 A 19 19 ASN H H 19 8.890 8.939 -0.049 1
1 223 . 7 1 1 A 19 19 ASN HA H 19 4.960 4.746 0.214 1
1 228 . 7 1 1 A 19 19 ASN C C 19 176.100 175.382 0.718 1
1 229 . 7 1 1 A 19 19 ASN CA C 19 53.600 55.214 -1.614 1
1 230 . 7 1 1 A 19 19 ASN CB C 19 40.300 39.978 0.322 1
1 231 . 7 1 1 A 19 19 ASN N N 19 116.600 122.782 -6.182 1
1 233 . 7 1 1 A 20 20 VAL H H 20 7.730 7.551 0.179 1
1 234 . 7 1 1 A 20 20 VAL HA H 20 5.250 5.042 0.208 1
1 242 . 7 1 1 A 20 20 VAL C C 20 173.800 173.870 -0.070 1
1 243 . 7 1 1 A 20 20 VAL CA C 20 59.400 59.059 0.341 1
1 244 . 7 1 1 A 20 20 VAL CB C 20 37.600 35.641 1.959 1
1 247 . 7 1 1 A 20 20 VAL N N 20 113.900 113.194 0.706 1
1 248 . 7 1 1 A 21 21 VAL H H 21 8.890 9.069 -0.179 1
1 249 . 7 1 1 A 21 21 VAL HA H 21 4.840 4.775 0.065 1
1 257 . 7 1 1 A 21 21 VAL CA C 21 56.800 57.513 -0.713 1
1 258 . 7 1 1 A 21 21 VAL CB C 21 36.000 35.272 0.728 1
1 261 . 7 1 1 A 21 21 VAL N N 21 118.500 122.220 -3.720 1
1 262 . 7 1 1 A 22 22 PRO HA H 22 4.940 4.850 0.090 1
1 269 . 7 1 1 A 22 22 PRO C C 22 175.600 176.456 -0.856 1
1 270 . 7 1 1 A 22 22 PRO CA C 22 62.700 62.755 -0.055 1
1 271 . 7 1 1 A 22 22 PRO CB C 22 31.800 31.898 -0.098 1
1 274 . 7 1 1 A 23 23 VAL H H 23 8.060 8.728 -0.668 1
1 275 . 7 1 1 A 23 23 VAL HA H 23 5.390 4.993 0.397 1
1 283 . 7 1 1 A 23 23 VAL C C 23 175.400 174.437 0.963 1
1 284 . 7 1 1 A 23 23 VAL CA C 23 57.800 59.233 -1.433 1
1 285 . 7 1 1 A 23 23 VAL CB C 23 36.300 34.730 1.570 1
1 288 . 7 1 1 A 23 23 VAL N N 23 110.900 116.477 -5.577 1
1 289 . 7 1 1 A 24 24 LYS H H 24 8.960 9.330 -0.370 1
1 290 . 7 1 1 A 24 24 LYS HA H 24 5.600 5.042 0.558 1
1 299 . 7 1 1 A 24 24 LYS C C 24 175.600 174.255 1.345 1
1 300 . 7 1 1 A 24 24 LYS CA C 24 54.200 54.182 0.018 1
1 301 . 7 1 1 A 24 24 LYS CB C 24 37.000 36.160 0.840 1
1 305 . 7 1 1 A 24 24 LYS N N 24 117.900 120.733 -2.833 1
1 306 . 7 1 1 A 25 25 SER H H 25 8.950 8.871 0.079 1
1 307 . 7 1 1 A 25 25 SER HA H 25 5.190 4.983 0.207 1
1 310 . 7 1 1 A 25 25 SER C C 25 173.800 175.089 -1.289 1
1 311 . 7 1 1 A 25 25 SER CA C 25 57.700 58.388 -0.688 1
1 312 . 7 1 1 A 25 25 SER CB C 25 65.100 64.904 0.196 1
1 313 . 7 1 1 A 25 25 SER N N 25 114.600 117.746 -3.146 1
1 314 . 7 1 1 A 26 26 ASN H H 26 9.020 9.069 -0.049 1
1 315 . 7 1 1 A 26 26 ASN HA H 26 4.370 4.534 -0.164 1
1 320 . 7 1 1 A 26 26 ASN C C 26 173.500 174.931 -1.431 1
1 321 . 7 1 1 A 26 26 ASN CA C 26 53.700 56.614 -2.914 1
1 322 . 7 1 1 A 26 26 ASN CB C 26 37.100 38.550 -1.450 1
1 323 . 7 1 1 A 26 26 ASN N N 26 118.300 122.956 -4.656 1
1 325 . 7 1 1 A 27 27 LYS H H 27 7.400 8.236 -0.836 1
1 326 . 7 1 1 A 27 27 LYS HA H 27 4.780 4.814 -0.034 1
1 335 . 7 1 1 A 27 27 LYS CA C 27 53.500 52.968 0.532 1
1 336 . 7 1 1 A 27 27 LYS CB C 27 34.100 33.827 0.273 1
1 340 . 7 1 1 A 27 27 LYS N N 27 116.600 117.376 -0.776 1
1 341 . 7 1 1 A 28 28 PRO HA H 28 4.040 4.530 -0.490 1
1 348 . 7 1 1 A 28 28 PRO C C 28 174.500 175.832 -1.332 1
1 349 . 7 1 1 A 28 28 PRO CA C 28 63.200 63.074 0.126 1
1 350 . 7 1 1 A 28 28 PRO CB C 28 32.500 32.435 0.065 1
1 353 . 7 1 1 A 29 29 VAL H H 29 8.860 8.862 -0.002 1
1 354 . 7 1 1 A 29 29 VAL HA H 29 4.420 4.535 -0.115 1
1 362 . 7 1 1 A 29 29 VAL C C 29 174.800 175.496 -0.696 1
1 363 . 7 1 1 A 29 29 VAL CA C 29 60.300 59.886 0.414 1
1 364 . 7 1 1 A 29 29 VAL CB C 29 36.400 34.563 1.837 1
1 367 . 7 1 1 A 29 29 VAL N N 29 119.800 122.828 -3.028 1
1 368 . 7 1 1 A 30 30 GLU H H 30 9.550 8.590 0.960 1
1 369 . 7 1 1 A 30 30 GLU HA H 30 4.260 4.499 -0.239 1
1 374 . 7 1 1 A 30 30 GLU C C 30 177.800 177.301 0.499 1
1 375 . 7 1 1 A 30 30 GLU CA C 30 58.000 57.018 0.982 1
1 376 . 7 1 1 A 30 30 GLU CB C 30 29.700 29.849 -0.149 1
1 378 . 7 1 1 A 30 30 GLU N N 30 128.900 125.330 3.570 1
1 379 . 7 1 1 A 31 31 ILE H H 31 7.910 8.589 -0.679 1
1 380 . 7 1 1 A 31 31 ILE HA H 31 2.120 3.992 -1.872 1
1 390 . 7 1 1 A 31 31 ILE C C 31 178.000 177.831 0.169 1
1 391 . 7 1 1 A 31 31 ILE CA C 31 63.500 63.579 -0.079 1
1 392 . 7 1 1 A 31 31 ILE CB C 31 37.200 38.133 -0.933 1
1 396 . 7 1 1 A 31 31 ILE N N 31 122.500 128.205 -5.705 1
1 397 . 7 1 1 A 32 32 SER H H 32 7.940 8.209 -0.269 1
1 398 . 7 1 1 A 32 32 SER HA H 32 4.070 4.331 -0.261 1
1 401 . 7 1 1 A 32 32 SER C C 32 175.800 175.025 0.775 1
1 402 . 7 1 1 A 32 32 SER CA C 32 60.200 61.590 -1.390 1
1 403 . 7 1 1 A 32 32 SER CB C 32 62.100 63.017 -0.917 1
1 404 . 7 1 1 A 32 32 SER N N 32 115.300 118.838 -3.538 1
1 405 . 7 1 1 A 33 33 LYS H H 33 7.640 7.921 -0.281 1
1 406 . 7 1 1 A 33 33 LYS HA H 33 4.400 4.804 -0.404 1
1 415 . 7 1 1 A 33 33 LYS C C 33 176.600 176.910 -0.310 1
1 416 . 7 1 1 A 33 33 LYS CA C 33 56.200 55.835 0.365 1
1 417 . 7 1 1 A 33 33 LYS CB C 33 32.700 32.422 0.278 1
1 421 . 7 1 1 A 33 33 LYS N N 33 119.800 117.099 2.701 1
1 422 . 7 1 1 A 34 34 TRP H H 34 7.860 7.634 0.226 1
1 423 . 7 1 1 A 34 34 TRP HA H 34 3.870 4.090 -0.220 1
1 426 . 7 1 1 A 34 34 TRP C C 34 178.600 178.441 0.159 1
1 427 . 7 1 1 A 34 34 TRP CA C 34 60.200 60.924 -0.724 1
1 428 . 7 1 1 A 34 34 TRP CB C 34 28.500 29.725 -1.225 1
1 429 . 7 1 1 A 34 34 TRP N N 34 120.000 121.879 -1.879 1
1 430 . 7 1 1 A 35 35 ILE H H 35 8.200 8.398 -0.198 1
1 431 . 7 1 1 A 35 35 ILE HA H 35 3.990 3.690 0.300 1
1 441 . 7 1 1 A 35 35 ILE C C 35 177.900 177.490 0.410 1
1 442 . 7 1 1 A 35 35 ILE CA C 35 64.300 65.460 -1.160 1
1 443 . 7 1 1 A 35 35 ILE CB C 35 37.200 38.197 -0.997 1
1 447 . 7 1 1 A 35 35 ILE N N 35 119.500 120.946 -1.446 1
1 448 . 7 1 1 A 36 36 ASP H H 36 7.680 8.314 -0.634 1
1 449 . 7 1 1 A 36 36 ASP HA H 36 4.490 4.262 0.228 1
1 452 . 7 1 1 A 36 36 ASP C C 36 179.200 178.908 0.292 1
1 453 . 7 1 1 A 36 36 ASP CA C 36 57.500 57.393 0.107 1
1 454 . 7 1 1 A 36 36 ASP CB C 36 40.400 40.489 -0.089 1
1 455 . 7 1 1 A 36 36 ASP N N 36 122.000 119.985 2.015 1
1 456 . 7 1 1 A 37 37 PHE H H 37 8.450 7.899 0.551 1
1 457 . 7 1 1 A 37 37 PHE HA H 37 4.080 4.012 0.068 1
1 465 . 7 1 1 A 37 37 PHE C C 37 178.300 178.104 0.196 1
1 466 . 7 1 1 A 37 37 PHE CA C 37 58.600 60.013 -1.413 1
1 467 . 7 1 1 A 37 37 PHE CB C 37 37.000 36.919 0.081 1
1 473 . 7 1 1 A 37 37 PHE N N 37 119.800 118.644 1.156 1
1 474 . 7 1 1 A 38 38 SER H H 38 8.580 8.048 0.532 1
1 475 . 7 1 1 A 38 38 SER HA H 38 4.250 3.924 0.326 1
1 478 . 7 1 1 A 38 38 SER C C 38 176.800 177.207 -0.407 1
1 479 . 7 1 1 A 38 38 SER CA C 38 62.700 61.442 1.258 1
1 480 . 7 1 1 A 38 38 SER CB C 38 62.700 62.477 0.223 1
1 481 . 7 1 1 A 38 38 SER N N 38 115.800 114.994 0.806 1
1 482 . 7 1 1 A 39 39 ASN H H 39 8.190 8.251 -0.061 1
1 483 . 7 1 1 A 39 39 ASN HA H 39 4.540 4.607 -0.067 1
1 488 . 7 1 1 A 39 39 ASN C C 39 178.500 177.626 0.874 1
1 489 . 7 1 1 A 39 39 ASN CA C 39 56.200 56.210 -0.010 1
1 490 . 7 1 1 A 39 39 ASN CB C 39 37.900 38.308 -0.408 1
1 491 . 7 1 1 A 39 39 ASN N N 39 121.300 120.122 1.178 1
1 493 . 7 1 1 A 40 40 VAL H H 40 7.840 7.453 0.387 1
1 494 . 7 1 1 A 40 40 VAL HA H 40 3.650 3.594 0.056 1
1 502 . 7 1 1 A 40 40 VAL C C 40 179.000 177.965 1.035 1
1 503 . 7 1 1 A 40 40 VAL CA C 40 66.600 66.110 0.490 1
1 504 . 7 1 1 A 40 40 VAL CB C 40 32.100 31.482 0.618 1
1 507 . 7 1 1 A 40 40 VAL N N 40 121.800 121.345 0.455 1
1 508 . 7 1 1 A 41 41 LEU H H 41 8.210 8.122 0.088 1
1 509 . 7 1 1 A 41 41 LEU HA H 41 3.840 3.983 -0.143 1
1 519 . 7 1 1 A 41 41 LEU C C 41 178.800 179.427 -0.627 1
1 520 . 7 1 1 A 41 41 LEU CA C 41 57.400 57.389 0.011 1
1 521 . 7 1 1 A 41 41 LEU CB C 41 41.200 41.451 -0.251 1
1 525 . 7 1 1 A 41 41 LEU N N 41 117.700 118.876 -1.176 1
1 526 . 7 1 1 A 42 42 SER H H 42 7.980 8.067 -0.087 1
1 527 . 7 1 1 A 42 42 SER HA H 42 4.260 4.127 0.133 1
1 530 . 7 1 1 A 42 42 SER C C 42 174.900 175.226 -0.326 1
1 531 . 7 1 1 A 42 42 SER CA C 42 61.200 60.847 0.353 1
1 532 . 7 1 1 A 42 42 SER CB C 42 63.100 62.803 0.297 1
1 533 . 7 1 1 A 42 42 SER N N 42 113.200 113.897 -0.697 1
1 534 . 7 1 1 A 43 43 ARG H H 43 7.100 7.490 -0.390 1
1 535 . 7 1 1 A 43 43 ARG HA H 43 4.500 4.353 0.147 1
1 542 . 7 1 1 A 43 43 ARG C C 43 175.800 174.864 0.936 1
1 543 . 7 1 1 A 43 43 ARG CA C 43 55.600 55.261 0.339 1
1 544 . 7 1 1 A 43 43 ARG CB C 43 30.800 30.540 0.260 1
1 547 . 7 1 1 A 43 43 ARG N N 43 118.400 119.457 -1.057 1
1 548 . 7 1 1 A 44 44 LEU H H 44 7.610 6.977 0.633 1
1 549 . 7 1 1 A 44 44 LEU HA H 44 4.590 4.906 -0.316 1
1 559 . 7 1 1 A 44 44 LEU C C 44 175.300 174.127 1.173 1
1 560 . 7 1 1 A 44 44 LEU CA C 44 53.900 52.927 0.973 1
1 561 . 7 1 1 A 44 44 LEU CB C 44 44.100 45.660 -1.560 1
1 565 . 7 1 1 A 44 44 LEU N N 44 120.400 122.469 -2.069 1
1 566 . 7 1 1 A 45 45 TYR H H 45 7.630 9.115 -1.485 1
1 567 . 7 1 1 A 45 45 TYR HA H 45 5.180 5.237 -0.057 1
1 574 . 7 1 1 A 45 45 TYR C C 45 174.600 174.216 0.384 1
1 575 . 7 1 1 A 45 45 TYR CA C 45 56.300 56.757 -0.457 1
1 576 . 7 1 1 A 45 45 TYR CB C 45 41.400 42.921 -1.521 1
1 581 . 7 1 1 A 45 45 TYR N N 45 115.300 124.687 -9.387 1
1 582 . 7 1 1 A 46 46 VAL H H 46 8.770 8.742 0.028 1
1 583 . 7 1 1 A 46 46 VAL HA H 46 4.540 5.039 -0.499 1
1 591 . 7 1 1 A 46 46 VAL C C 46 174.600 174.051 0.549 1
1 592 . 7 1 1 A 46 46 VAL CA C 46 59.600 59.767 -0.167 1
1 593 . 7 1 1 A 46 46 VAL CB C 46 34.700 35.193 -0.493 1
1 596 . 7 1 1 A 46 46 VAL N N 46 115.400 122.275 -6.875 1
1 597 . 7 1 1 A 47 47 GLY H H 47 8.280 8.728 -0.448 1
1 598 . 7 1 1 A 47 47 GLY HA2 H 47 3.610 4.288 -0.678 1
1 599 . 7 1 1 A 47 47 GLY HA3 H 47 4.970 4.297 0.673 1
1 600 . 7 1 1 A 47 47 GLY C C 47 173.100 173.574 -0.474 1
1 601 . 7 1 1 A 47 47 GLY CA C 47 43.600 43.970 -0.370 1
1 602 . 7 1 1 A 47 47 GLY N N 47 109.900 114.446 -4.546 1
1 603 . 7 1 1 A 48 48 VAL H H 48 7.630 8.316 -0.686 1
1 604 . 7 1 1 A 48 48 VAL HA H 48 4.320 4.214 0.106 1
1 612 . 7 1 1 A 48 48 VAL CA C 48 58.700 63.167 -4.467 1
1 613 . 7 1 1 A 48 48 VAL CB C 48 32.100 30.751 1.349 1
1 616 . 7 1 1 A 48 48 VAL N N 48 109.900 118.023 -8.123 1
1 617 . 7 1 1 A 49 49 PRO HA H 49 4.800 4.466 0.334 1
1 624 . 7 1 1 A 49 49 PRO C C 49 176.700 176.520 0.180 1
1 625 . 7 1 1 A 49 49 PRO CA C 49 62.300 63.051 -0.751 1
1 626 . 7 1 1 A 49 49 PRO CB C 49 35.400 31.655 3.745 1
1 629 . 7 1 1 A 50 50 THR H H 50 8.790 8.280 0.510 1
1 630 . 7 1 1 A 50 50 THR HA H 50 4.690 4.744 -0.054 1
1 635 . 7 1 1 A 50 50 THR C C 50 173.500 173.860 -0.360 1
1 636 . 7 1 1 A 50 50 THR CA C 50 60.800 60.346 0.454 1
1 637 . 7 1 1 A 50 50 THR CB C 50 70.800 69.880 0.920 1
1 639 . 7 1 1 A 50 50 THR N N 50 113.500 112.356 1.144 1
1 640 . 7 1 1 A 51 51 LYS H H 51 7.810 8.600 -0.790 1
1 641 . 7 1 1 A 51 51 LYS HA H 51 4.890 5.043 -0.153 1
1 650 . 7 1 1 A 51 51 LYS C C 51 175.900 175.638 0.262 1
1 651 . 7 1 1 A 51 51 LYS CA C 51 54.100 54.426 -0.326 1
1 652 . 7 1 1 A 51 51 LYS CB C 51 35.300 33.855 1.445 1
1 656 . 7 1 1 A 51 51 LYS N N 51 122.200 116.402 5.798 1
1 657 . 7 1 1 A 52 52 SER H H 52 8.410 8.404 0.006 1
1 658 . 7 1 1 A 52 52 SER HA H 52 3.630 4.694 -1.064 1
1 661 . 7 1 1 A 52 52 SER C C 52 175.800 175.288 0.512 1
1 662 . 7 1 1 A 52 52 SER CA C 52 58.800 58.355 0.445 1
1 663 . 7 1 1 A 52 52 SER CB C 52 62.600 64.715 -2.115 1
1 664 . 7 1 1 A 52 52 SER N N 52 118.900 115.619 3.281 1
1 665 . 7 1 1 A 53 53 GLY H H 53 9.070 9.278 -0.208 1
1 666 . 7 1 1 A 53 53 GLY HA2 H 53 3.390 3.968 -0.578 1
1 667 . 7 1 1 A 53 53 GLY HA3 H 53 4.460 3.970 0.490 1
1 668 . 7 1 1 A 53 53 GLY C C 53 174.100 174.709 -0.609 1
1 669 . 7 1 1 A 53 53 GLY CA C 53 44.800 45.446 -0.646 1
1 670 . 7 1 1 A 53 53 GLY N N 53 115.600 113.133 2.467 1
1 671 . 7 1 1 A 54 54 ASN H H 54 7.870 7.976 -0.106 1
1 672 . 7 1 1 A 54 54 ASN HA H 54 4.570 4.698 -0.128 1
1 677 . 7 1 1 A 54 54 ASN C C 54 175.500 174.746 0.754 1
1 678 . 7 1 1 A 54 54 ASN CA C 54 53.000 52.515 0.485 1
1 679 . 7 1 1 A 54 54 ASN CB C 54 38.600 37.832 0.768 1
1 680 . 7 1 1 A 54 54 ASN N N 54 119.600 120.014 -0.414 1
1 682 . 7 1 1 A 55 55 VAL H H 55 8.770 8.942 -0.172 1
1 683 . 7 1 1 A 55 55 VAL HA H 55 3.880 4.245 -0.365 1
1 691 . 7 1 1 A 55 55 VAL C C 55 176.200 177.035 -0.835 1
1 692 . 7 1 1 A 55 55 VAL CA C 55 63.700 62.880 0.820 1
1 693 . 7 1 1 A 55 55 VAL CB C 55 31.600 30.649 0.951 1
1 696 . 7 1 1 A 55 55 VAL N N 55 123.900 125.923 -2.023 1
1 697 . 7 1 1 A 56 56 VAL H H 56 9.050 8.173 0.877 1
1 698 . 7 1 1 A 56 56 VAL HA H 56 3.990 4.015 -0.025 1
1 706 . 7 1 1 A 56 56 VAL C C 56 175.200 175.604 -0.404 1
1 707 . 7 1 1 A 56 56 VAL CA C 56 62.700 64.127 -1.427 1
1 708 . 7 1 1 A 56 56 VAL CB C 56 32.900 32.131 0.769 1
1 711 . 7 1 1 A 56 56 VAL N N 56 127.500 124.421 3.079 1
1 712 . 7 1 1 A 57 57 CYS H H 57 7.250 7.449 -0.199 1
1 713 . 7 1 1 A 57 57 CYS HA H 57 4.370 4.784 -0.414 1
1 716 . 7 1 1 A 57 57 CYS C C 57 171.900 172.666 -0.766 1
1 717 . 7 1 1 A 57 57 CYS CA C 57 58.600 57.534 1.066 1
1 718 . 7 1 1 A 57 57 CYS CB C 57 28.600 30.628 -2.028 1
1 719 . 7 1 1 A 57 57 CYS N N 57 117.600 119.128 -1.528 1
1 720 . 7 1 1 A 58 58 LYS H H 58 8.880 8.772 0.108 1
1 721 . 7 1 1 A 58 58 LYS HA H 58 4.220 4.585 -0.365 1
1 730 . 7 1 1 A 58 58 LYS C C 58 176.000 176.749 -0.749 1
1 731 . 7 1 1 A 58 58 LYS CA C 58 54.400 54.867 -0.467 1
1 732 . 7 1 1 A 58 58 LYS CB C 58 33.600 34.946 -1.346 1
1 736 . 7 1 1 A 58 58 LYS N N 58 132.000 127.953 4.047 1
1 737 . 7 1 1 A 59 59 ASN H H 59 9.500 8.755 0.745 1
1 738 . 7 1 1 A 59 59 ASN HA H 59 4.040 4.387 -0.347 1
1 743 . 7 1 1 A 59 59 ASN C C 59 176.400 175.117 1.283 1
1 744 . 7 1 1 A 59 59 ASN CA C 59 53.200 53.913 -0.713 1
1 745 . 7 1 1 A 59 59 ASN CB C 59 35.900 36.199 -0.299 1
1 746 . 7 1 1 A 59 59 ASN N N 59 127.500 123.765 3.735 1
1 748 . 7 1 1 A 60 60 ILE H H 60 8.050 7.123 0.927 1
1 749 . 7 1 1 A 60 60 ILE HA H 60 3.680 3.619 0.061 1
1 759 . 7 1 1 A 60 60 ILE C C 60 175.700 176.613 -0.913 1
1 760 . 7 1 1 A 60 60 ILE CA C 60 61.900 62.327 -0.427 1
1 761 . 7 1 1 A 60 60 ILE CB C 60 38.300 37.246 1.054 1
1 765 . 7 1 1 A 60 60 ILE N N 60 120.200 121.778 -1.578 1
1 766 . 7 1 1 A 61 61 MET H H 61 9.590 9.301 0.289 1
1 767 . 7 1 1 A 61 61 MET HA H 61 3.920 4.119 -0.199 1
1 775 . 7 1 1 A 61 61 MET C C 61 174.300 175.321 -1.021 1
1 776 . 7 1 1 A 61 61 MET CA C 61 57.000 56.723 0.277 1
1 777 . 7 1 1 A 61 61 MET CB C 61 31.300 31.200 0.100 1
1 780 . 7 1 1 A 61 61 MET N N 61 124.400 126.507 -2.107 1
1 781 . 7 1 1 A 62 62 ASN H H 62 8.250 8.174 0.076 1
1 782 . 7 1 1 A 62 62 ASN HA H 62 4.400 4.388 0.012 1
1 787 . 7 1 1 A 62 62 ASN C C 62 176.800 175.465 1.335 1
1 788 . 7 1 1 A 62 62 ASN CA C 62 54.400 54.705 -0.305 1
1 789 . 7 1 1 A 62 62 ASN CB C 62 37.600 36.787 0.813 1
1 790 . 7 1 1 A 62 62 ASN N N 62 111.900 109.316 2.584 1
1 792 . 7 1 1 A 63 63 THR H H 63 7.480 7.946 -0.466 1
1 793 . 7 1 1 A 63 63 THR HA H 63 4.210 4.319 -0.109 1
1 798 . 7 1 1 A 63 63 THR C C 63 177.100 175.672 1.428 1
1 799 . 7 1 1 A 63 63 THR CA C 63 62.900 63.349 -0.449 1
1 800 . 7 1 1 A 63 63 THR CB C 63 72.500 70.028 2.472 1
1 802 . 7 1 1 A 63 63 THR N N 63 105.900 111.667 -5.767 1
1 803 . 7 1 1 A 64 64 GLY H H 64 9.110 7.957 1.153 1
1 804 . 7 1 1 A 64 64 GLY HA2 H 64 3.580 4.070 -0.490 1
1 805 . 7 1 1 A 64 64 GLY HA3 H 64 4.090 4.084 0.006 1
1 806 . 7 1 1 A 64 64 GLY C C 64 173.200 174.310 -1.110 1
1 807 . 7 1 1 A 64 64 GLY CA C 64 45.300 44.962 0.338 1
1 808 . 7 1 1 A 64 64 GLY N N 64 111.500 110.847 0.653 1
1 809 . 7 1 1 A 65 65 VAL H H 65 7.580 7.557 0.023 1
1 810 . 7 1 1 A 65 65 VAL HA H 65 4.060 4.081 -0.021 1
1 818 . 7 1 1 A 65 65 VAL C C 65 172.900 174.739 -1.839 1
1 819 . 7 1 1 A 65 65 VAL CA C 65 61.400 62.164 -0.764 1
1 820 . 7 1 1 A 65 65 VAL CB C 65 32.900 32.191 0.709 1
1 823 . 7 1 1 A 65 65 VAL N N 65 121.600 122.580 -0.980 1
1 824 . 7 1 1 A 66 66 ASP H H 66 8.210 8.634 -0.424 1
1 825 . 7 1 1 A 66 66 ASP HA H 66 5.320 4.952 0.368 1
1 828 . 7 1 1 A 66 66 ASP C C 66 174.800 175.156 -0.356 1
1 829 . 7 1 1 A 66 66 ASP CA C 66 51.700 53.660 -1.960 1
1 830 . 7 1 1 A 66 66 ASP CB C 66 43.200 41.798 1.402 1
1 831 . 7 1 1 A 66 66 ASP N N 66 123.100 127.522 -4.422 1
1 832 . 7 1 1 A 67 67 ILE H H 67 8.540 8.929 -0.389 1
1 833 . 7 1 1 A 67 67 ILE HA H 67 4.630 4.526 0.104 1
1 843 . 7 1 1 A 67 67 ILE C C 67 175.600 175.699 -0.099 1
1 844 . 7 1 1 A 67 67 ILE CA C 67 56.900 60.596 -3.696 1
1 845 . 7 1 1 A 67 67 ILE CB C 67 35.300 36.735 -1.435 1
1 849 . 7 1 1 A 67 67 ILE N N 67 119.200 125.590 -6.390 1
1 850 . 7 1 1 A 68 68 ILE H H 68 9.420 9.072 0.348 1
1 851 . 7 1 1 A 68 68 ILE HA H 68 4.980 5.683 -0.703 1
1 861 . 7 1 1 A 68 68 ILE C C 68 175.000 174.868 0.132 1
1 862 . 7 1 1 A 68 68 ILE CA C 68 58.600 59.114 -0.514 1
1 863 . 7 1 1 A 68 68 ILE CB C 68 40.900 40.924 -0.024 1
1 867 . 7 1 1 A 68 68 ILE N N 68 125.000 122.962 2.038 1
1 868 . 7 1 1 A 69 69 CYS H H 69 8.870 8.902 -0.032 1
1 869 . 7 1 1 A 69 69 CYS HA H 69 4.610 4.622 -0.012 1
1 872 . 7 1 1 A 69 69 CYS C C 69 176.200 175.018 1.182 1
1 873 . 7 1 1 A 69 69 CYS CA C 69 58.900 59.255 -0.355 1
1 874 . 7 1 1 A 69 69 CYS CB C 69 27.100 28.063 -0.963 1
1 875 . 7 1 1 A 69 69 CYS N N 69 122.300 124.548 -2.248 1
1 876 . 7 1 1 A 70 70 THR H H 70 8.270 8.530 -0.260 1
1 877 . 7 1 1 A 70 70 THR HA H 70 4.710 4.569 0.141 1
1 882 . 7 1 1 A 70 70 THR C C 70 173.600 173.665 -0.065 1
1 883 . 7 1 1 A 70 70 THR CA C 70 61.500 61.275 0.225 1
1 884 . 7 1 1 A 70 70 THR CB C 70 68.100 70.341 -2.241 1
1 886 . 7 1 1 A 70 70 THR N N 70 116.700 117.450 -0.750 1
1 887 . 7 1 1 A 71 71 LYS H H 71 7.370 7.440 -0.070 1
1 888 . 7 1 1 A 71 71 LYS HA H 71 4.520 4.811 -0.291 1
1 897 . 7 1 1 A 71 71 LYS CA C 71 55.100 54.578 0.522 1
1 898 . 7 1 1 A 71 71 LYS CB C 71 37.800 34.980 2.820 1
1 902 . 7 1 1 A 71 71 LYS N N 71 120.900 122.933 -2.033 1
1 903 . 7 1 1 A 72 72 ASN H H 72 8.580 8.658 -0.078 1
1 904 . 7 1 1 A 72 72 ASN HA H 72 4.620 4.869 -0.249 1
1 909 . 7 1 1 A 72 72 ASN C C 72 173.500 174.997 -1.497 1
1 910 . 7 1 1 A 72 72 ASN CA C 72 52.200 53.358 -1.158 1
1 911 . 7 1 1 A 72 72 ASN CB C 72 38.500 38.474 0.026 1
1 912 . 7 1 1 A 72 72 ASN N N 72 122.700 125.361 -2.661 1
1 914 . 7 1 1 A 73 73 LEU H H 73 8.100 8.879 -0.779 1
1 915 . 7 1 1 A 73 73 LEU HA H 73 4.680 4.749 -0.069 1
1 925 . 7 1 1 A 73 73 LEU CA C 73 51.000 51.799 -0.799 1
1 926 . 7 1 1 A 73 73 LEU CB C 73 42.500 41.883 0.617 1
1 930 . 7 1 1 A 73 73 LEU N N 73 125.100 126.602 -1.502 1
1 931 . 7 1 1 A 74 74 PRO HA H 74 4.670 4.838 -0.168 1
1 938 . 7 1 1 A 74 74 PRO C C 74 176.500 176.737 -0.237 1
1 939 . 7 1 1 A 74 74 PRO CA C 74 61.800 62.140 -0.340 1
1 940 . 7 1 1 A 74 74 PRO CB C 74 32.800 33.220 -0.420 1
1 943 . 7 1 1 A 75 75 LYS H H 75 8.280 8.983 -0.703 1
1 944 . 7 1 1 A 75 75 LYS HA H 75 4.110 4.453 -0.343 1
1 953 . 7 1 1 A 75 75 LYS CA C 75 56.500 57.284 -0.784 1
1 954 . 7 1 1 A 75 75 LYS CB C 75 33.300 34.480 -1.180 1
1 958 . 7 1 1 A 75 75 LYS N N 75 117.000 118.343 -1.343 1
1 959 . 7 1 1 A 76 76 ASP H H 76 8.570 8.011 0.559 1
1 960 . 7 1 1 A 76 76 ASP HA H 76 4.530 5.091 -0.561 1
1 963 . 7 1 1 A 76 76 ASP C C 76 176.300 175.721 0.579 1
1 964 . 7 1 1 A 76 76 ASP CA C 76 55.000 53.212 1.788 1
1 965 . 7 1 1 A 76 76 ASP CB C 76 41.100 42.933 -1.833 1
1 966 . 7 1 1 A 76 76 ASP N N 76 122.700 118.610 4.090 1
1 967 . 7 1 1 A 77 77 SER H H 77 8.330 8.841 -0.511 1
1 968 . 7 1 1 A 77 77 SER HA H 77 4.410 4.721 -0.311 1
1 971 . 7 1 1 A 77 77 SER C C 77 174.300 173.557 0.743 1
1 972 . 7 1 1 A 77 77 SER CA C 77 58.000 58.276 -0.276 1
1 973 . 7 1 1 A 77 77 SER CB C 77 63.900 62.921 0.979 1
1 974 . 7 1 1 A 77 77 SER N N 77 116.100 121.174 -5.074 1
1 975 . 7 1 1 A 78 78 LEU H H 78 8.350 8.429 -0.079 1
1 976 . 7 1 1 A 78 78 LEU HA H 78 4.280 4.141 0.139 1
1 986 . 7 1 1 A 78 78 LEU C C 78 177.200 176.572 0.628 1
1 987 . 7 1 1 A 78 78 LEU CA C 78 55.200 55.127 0.073 1
1 988 . 7 1 1 A 78 78 LEU CB C 78 42.100 41.215 0.885 1
1 992 . 7 1 1 A 78 78 LEU N N 78 124.300 126.835 -2.535 1
1 993 . 7 1 1 A 79 79 GLU H H 79 8.300 8.456 -0.156 1
1 994 . 7 1 1 A 79 79 GLU CA C 79 56.400 56.416 -0.016 1
1 995 . 7 1 1 A 79 79 GLU CB C 79 30.200 30.108 0.092 1
1 1 . 8 1 1 A 2 2 HIS HA H 2 4.640 4.545 0.095 1
1 4 . 8 1 1 A 2 2 HIS C C 2 173.600 174.287 -0.687 1
1 5 . 8 1 1 A 2 2 HIS CA C 2 56.500 55.852 0.648 1
1 6 . 8 1 1 A 2 2 HIS CB C 2 31.000 29.608 1.392 1
1 7 . 8 1 1 A 3 3 LYS H H 3 8.160 8.817 -0.657 1
1 8 . 8 1 1 A 3 3 LYS HA H 3 4.660 4.573 0.087 1
1 17 . 8 1 1 A 3 3 LYS C C 3 174.400 174.882 -0.482 1
1 18 . 8 1 1 A 3 3 LYS CA C 3 54.800 55.167 -0.367 1
1 19 . 8 1 1 A 3 3 LYS CB C 3 35.800 33.925 1.875 1
1 23 . 8 1 1 A 3 3 LYS N N 3 121.900 126.783 -4.883 1
1 24 . 8 1 1 A 4 4 ASP H H 4 8.470 8.705 -0.235 1
1 25 . 8 1 1 A 4 4 ASP HA H 4 4.900 5.361 -0.461 1
1 28 . 8 1 1 A 4 4 ASP C C 4 176.900 174.979 1.921 1
1 29 . 8 1 1 A 4 4 ASP CA C 4 52.700 52.364 0.336 1
1 30 . 8 1 1 A 4 4 ASP CB C 4 44.100 44.900 -0.800 1
1 31 . 8 1 1 A 4 4 ASP N N 4 117.900 124.396 -6.496 1
1 32 . 8 1 1 A 5 5 ILE H H 5 9.570 8.710 0.860 1
1 33 . 8 1 1 A 5 5 ILE HA H 5 3.640 4.422 -0.782 1
1 43 . 8 1 1 A 5 5 ILE C C 5 174.800 175.708 -0.908 1
1 44 . 8 1 1 A 5 5 ILE CA C 5 60.900 60.654 0.246 1
1 45 . 8 1 1 A 5 5 ILE CB C 5 37.000 37.711 -0.711 1
1 49 . 8 1 1 A 5 5 ILE N N 5 124.400 122.095 2.305 1
1 50 . 8 1 1 A 6 6 PHE H H 6 7.790 9.056 -1.266 1
1 51 . 8 1 1 A 6 6 PHE HA H 6 3.160 4.665 -1.505 1
1 58 . 8 1 1 A 6 6 PHE C C 6 173.500 174.443 -0.943 1
1 59 . 8 1 1 A 6 6 PHE CA C 6 56.900 59.468 -2.568 1
1 60 . 8 1 1 A 6 6 PHE CB C 6 40.100 39.529 0.571 1
1 65 . 8 1 1 A 6 6 PHE N N 6 130.200 129.657 0.543 1
1 66 . 8 1 1 A 7 7 THR H H 7 6.790 8.593 -1.803 1
1 67 . 8 1 1 A 7 7 THR HA H 7 4.530 5.231 -0.701 1
1 72 . 8 1 1 A 7 7 THR C C 7 172.300 173.080 -0.780 1
1 73 . 8 1 1 A 7 7 THR CA C 7 59.200 60.983 -1.783 1
1 74 . 8 1 1 A 7 7 THR CB C 7 71.000 70.693 0.307 1
1 76 . 8 1 1 A 7 7 THR N N 7 117.900 123.784 -5.884 1
1 77 . 8 1 1 A 8 8 SER H H 8 7.600 9.024 -1.424 1
1 78 . 8 1 1 A 8 8 SER HA H 8 4.180 4.683 -0.503 1
1 81 . 8 1 1 A 8 8 SER C C 8 175.300 172.005 3.295 1
1 82 . 8 1 1 A 8 8 SER CA C 8 55.800 55.789 0.011 1
1 83 . 8 1 1 A 8 8 SER CB C 8 64.000 64.766 -0.766 1
1 84 . 8 1 1 A 8 8 SER N N 8 113.400 120.579 -7.179 1
1 85 . 8 1 1 A 9 9 VAL H H 9 8.880 8.415 0.465 1
1 86 . 8 1 1 A 9 9 VAL HA H 9 5.220 4.851 0.369 1
1 94 . 8 1 1 A 9 9 VAL C C 9 174.000 175.477 -1.477 1
1 95 . 8 1 1 A 9 9 VAL CA C 9 59.100 60.971 -1.871 1
1 96 . 8 1 1 A 9 9 VAL CB C 9 36.500 34.464 2.036 1
1 99 . 8 1 1 A 9 9 VAL N N 9 114.700 121.569 -6.869 1
1 100 . 8 1 1 A 10 10 VAL H H 10 8.510 8.969 -0.459 1
1 101 . 8 1 1 A 10 10 VAL HA H 10 4.470 4.980 -0.510 1
1 109 . 8 1 1 A 10 10 VAL C C 10 173.700 175.048 -1.348 1
1 110 . 8 1 1 A 10 10 VAL CA C 10 59.400 59.141 0.259 1
1 111 . 8 1 1 A 10 10 VAL CB C 10 36.000 34.865 1.135 1
1 114 . 8 1 1 A 10 10 VAL N N 10 117.100 121.824 -4.724 1
1 115 . 8 1 1 A 11 11 ARG H H 11 8.500 8.464 0.036 1
1 116 . 8 1 1 A 11 11 ARG HA H 11 4.460 4.858 -0.398 1
1 123 . 8 1 1 A 11 11 ARG C C 11 174.500 175.537 -1.037 1
1 124 . 8 1 1 A 11 11 ARG CA C 11 57.400 55.974 1.426 1
1 125 . 8 1 1 A 11 11 ARG CB C 11 31.000 31.713 -0.713 1
1 128 . 8 1 1 A 11 11 ARG N N 11 124.800 121.722 3.078 1
1 129 . 8 1 1 A 12 12 VAL H H 12 7.650 9.335 -1.685 1
1 130 . 8 1 1 A 12 12 VAL HA H 12 4.970 5.008 -0.038 1
1 138 . 8 1 1 A 12 12 VAL C C 12 176.700 175.326 1.374 1
1 139 . 8 1 1 A 12 12 VAL CA C 12 59.400 61.672 -2.272 1
1 140 . 8 1 1 A 12 12 VAL CB C 12 34.400 33.172 1.228 1
1 143 . 8 1 1 A 12 12 VAL N N 12 120.900 124.477 -3.577 1
1 144 . 8 1 1 A 13 13 ARG H H 13 9.020 9.169 -0.149 1
1 145 . 8 1 1 A 13 13 ARG HA H 13 4.700 4.824 -0.124 1
1 152 . 8 1 1 A 13 13 ARG C C 13 176.000 175.699 0.301 1
1 153 . 8 1 1 A 13 13 ARG CA C 13 54.600 54.950 -0.350 1
1 154 . 8 1 1 A 13 13 ARG CB C 13 32.900 32.564 0.336 1
1 157 . 8 1 1 A 13 13 ARG N N 13 127.500 126.650 0.850 1
1 158 . 8 1 1 A 14 14 GLY H H 14 8.640 8.441 0.199 1
1 159 . 8 1 1 A 14 14 GLY HA2 H 14 3.680 4.180 -0.500 1
1 160 . 8 1 1 A 14 14 GLY HA3 H 14 4.190 4.188 0.002 1
1 161 . 8 1 1 A 14 14 GLY C C 14 173.700 173.555 0.145 1
1 162 . 8 1 1 A 14 14 GLY CA C 14 45.600 44.073 1.527 1
1 163 . 8 1 1 A 14 14 GLY N N 14 108.800 109.192 -0.392 1
1 164 . 8 1 1 A 15 15 SER H H 15 8.220 8.428 -0.208 1
1 165 . 8 1 1 A 15 15 SER HA H 15 5.020 4.788 0.232 1
1 168 . 8 1 1 A 15 15 SER C C 15 175.400 173.955 1.445 1
1 169 . 8 1 1 A 15 15 SER CA C 15 55.300 57.665 -2.365 1
1 170 . 8 1 1 A 15 15 SER CB C 15 64.900 62.501 2.399 1
1 171 . 8 1 1 A 15 15 SER N N 15 113.200 114.044 -0.844 1
1 172 . 8 1 1 A 16 16 LYS H H 16 9.930 7.990 1.940 1
1 173 . 8 1 1 A 16 16 LYS HA H 16 4.190 4.834 -0.644 1
1 182 . 8 1 1 A 16 16 LYS C C 16 176.500 176.805 -0.305 1
1 183 . 8 1 1 A 16 16 LYS CA C 16 57.300 54.683 2.617 1
1 184 . 8 1 1 A 16 16 LYS CB C 16 32.300 34.117 -1.817 1
1 188 . 8 1 1 A 16 16 LYS N N 16 129.200 122.780 6.420 1
1 189 . 8 1 1 A 17 17 LYS H H 17 7.960 8.590 -0.630 1
1 190 . 8 1 1 A 17 17 LYS HA H 17 4.030 4.292 -0.262 1
1 199 . 8 1 1 A 17 17 LYS C C 17 175.600 176.753 -1.153 1
1 200 . 8 1 1 A 17 17 LYS CA C 17 56.900 58.447 -1.547 1
1 201 . 8 1 1 A 17 17 LYS CB C 17 34.700 33.461 1.239 1
1 205 . 8 1 1 A 17 17 LYS N N 17 118.500 117.920 0.580 1
1 206 . 8 1 1 A 18 18 TYR H H 18 7.780 7.830 -0.050 1
1 207 . 8 1 1 A 18 18 TYR HA H 18 4.760 4.551 0.209 1
1 214 . 8 1 1 A 18 18 TYR C C 18 174.000 175.772 -1.772 1
1 215 . 8 1 1 A 18 18 TYR CA C 18 56.800 58.842 -2.042 1
1 216 . 8 1 1 A 18 18 TYR CB C 18 41.100 38.797 2.303 1
1 221 . 8 1 1 A 18 18 TYR N N 18 117.100 117.063 0.037 1
1 222 . 8 1 1 A 19 19 ASN H H 19 8.890 9.030 -0.140 1
1 223 . 8 1 1 A 19 19 ASN HA H 19 4.960 4.912 0.048 1
1 228 . 8 1 1 A 19 19 ASN C C 19 176.100 175.277 0.823 1
1 229 . 8 1 1 A 19 19 ASN CA C 19 53.600 55.024 -1.424 1
1 230 . 8 1 1 A 19 19 ASN CB C 19 40.300 40.503 -0.203 1
1 231 . 8 1 1 A 19 19 ASN N N 19 116.600 123.555 -6.955 1
1 233 . 8 1 1 A 20 20 VAL H H 20 7.730 7.565 0.165 1
1 234 . 8 1 1 A 20 20 VAL HA H 20 5.250 4.919 0.331 1
1 242 . 8 1 1 A 20 20 VAL C C 20 173.800 174.346 -0.546 1
1 243 . 8 1 1 A 20 20 VAL CA C 20 59.400 59.779 -0.379 1
1 244 . 8 1 1 A 20 20 VAL CB C 20 37.600 35.297 2.303 1
1 247 . 8 1 1 A 20 20 VAL N N 20 113.900 113.665 0.235 1
1 248 . 8 1 1 A 21 21 VAL H H 21 8.890 8.843 0.047 1
1 249 . 8 1 1 A 21 21 VAL HA H 21 4.840 4.685 0.155 1
1 257 . 8 1 1 A 21 21 VAL CA C 21 56.800 58.002 -1.202 1
1 258 . 8 1 1 A 21 21 VAL CB C 21 36.000 34.306 1.694 1
1 261 . 8 1 1 A 21 21 VAL N N 21 118.500 126.015 -7.515 1
1 262 . 8 1 1 A 22 22 PRO HA H 22 4.940 5.132 -0.192 1
1 269 . 8 1 1 A 22 22 PRO C C 22 175.600 176.442 -0.842 1
1 270 . 8 1 1 A 22 22 PRO CA C 22 62.700 62.738 -0.038 1
1 271 . 8 1 1 A 22 22 PRO CB C 22 31.800 31.841 -0.041 1
1 274 . 8 1 1 A 23 23 VAL H H 23 8.060 8.697 -0.637 1
1 275 . 8 1 1 A 23 23 VAL HA H 23 5.390 4.935 0.455 1
1 283 . 8 1 1 A 23 23 VAL C C 23 175.400 174.474 0.926 1
1 284 . 8 1 1 A 23 23 VAL CA C 23 57.800 59.125 -1.325 1
1 285 . 8 1 1 A 23 23 VAL CB C 23 36.300 34.777 1.523 1
1 288 . 8 1 1 A 23 23 VAL N N 23 110.900 116.675 -5.775 1
1 289 . 8 1 1 A 24 24 LYS H H 24 8.960 9.440 -0.480 1
1 290 . 8 1 1 A 24 24 LYS HA H 24 5.600 5.287 0.313 1
1 299 . 8 1 1 A 24 24 LYS C C 24 175.600 174.523 1.077 1
1 300 . 8 1 1 A 24 24 LYS CA C 24 54.200 54.078 0.122 1
1 301 . 8 1 1 A 24 24 LYS CB C 24 37.000 36.292 0.708 1
1 305 . 8 1 1 A 24 24 LYS N N 24 117.900 120.812 -2.912 1
1 306 . 8 1 1 A 25 25 SER H H 25 8.950 8.799 0.151 1
1 307 . 8 1 1 A 25 25 SER HA H 25 5.190 4.776 0.414 1
1 310 . 8 1 1 A 25 25 SER C C 25 173.800 174.984 -1.184 1
1 311 . 8 1 1 A 25 25 SER CA C 25 57.700 58.179 -0.479 1
1 312 . 8 1 1 A 25 25 SER CB C 25 65.100 64.675 0.425 1
1 313 . 8 1 1 A 25 25 SER N N 25 114.600 117.640 -3.040 1
1 314 . 8 1 1 A 26 26 ASN H H 26 9.020 8.553 0.467 1
1 315 . 8 1 1 A 26 26 ASN HA H 26 4.370 4.548 -0.178 1
1 320 . 8 1 1 A 26 26 ASN C C 26 173.500 175.511 -2.011 1
1 321 . 8 1 1 A 26 26 ASN CA C 26 53.700 54.868 -1.168 1
1 322 . 8 1 1 A 26 26 ASN CB C 26 37.100 37.891 -0.791 1
1 323 . 8 1 1 A 26 26 ASN N N 26 118.300 122.370 -4.070 1
1 325 . 8 1 1 A 27 27 LYS H H 27 7.400 7.946 -0.546 1
1 326 . 8 1 1 A 27 27 LYS HA H 27 4.780 4.678 0.102 1
1 335 . 8 1 1 A 27 27 LYS CA C 27 53.500 52.611 0.889 1
1 336 . 8 1 1 A 27 27 LYS CB C 27 34.100 33.763 0.337 1
1 340 . 8 1 1 A 27 27 LYS N N 27 116.600 119.659 -3.059 1
1 341 . 8 1 1 A 28 28 PRO HA H 28 4.040 4.654 -0.614 1
1 348 . 8 1 1 A 28 28 PRO C C 28 174.500 176.726 -2.226 1
1 349 . 8 1 1 A 28 28 PRO CA C 28 63.200 63.035 0.165 1
1 350 . 8 1 1 A 28 28 PRO CB C 28 32.500 31.771 0.729 1
1 353 . 8 1 1 A 29 29 VAL H H 29 8.860 8.437 0.423 1
1 354 . 8 1 1 A 29 29 VAL HA H 29 4.420 4.609 -0.189 1
1 362 . 8 1 1 A 29 29 VAL C C 29 174.800 175.825 -1.025 1
1 363 . 8 1 1 A 29 29 VAL CA C 29 60.300 59.861 0.439 1
1 364 . 8 1 1 A 29 29 VAL CB C 29 36.400 33.835 2.565 1
1 367 . 8 1 1 A 29 29 VAL N N 29 119.800 116.896 2.904 1
1 368 . 8 1 1 A 30 30 GLU H H 30 9.550 8.496 1.054 1
1 369 . 8 1 1 A 30 30 GLU HA H 30 4.260 4.489 -0.229 1
1 374 . 8 1 1 A 30 30 GLU C C 30 177.800 176.975 0.825 1
1 375 . 8 1 1 A 30 30 GLU CA C 30 58.000 56.612 1.388 1
1 376 . 8 1 1 A 30 30 GLU CB C 30 29.700 30.733 -1.033 1
1 378 . 8 1 1 A 30 30 GLU N N 30 128.900 121.121 7.779 1
1 379 . 8 1 1 A 31 31 ILE H H 31 7.910 8.680 -0.770 1
1 380 . 8 1 1 A 31 31 ILE HA H 31 2.120 4.416 -2.296 1
1 390 . 8 1 1 A 31 31 ILE C C 31 178.000 175.823 2.177 1
1 391 . 8 1 1 A 31 31 ILE CA C 31 63.500 60.628 2.872 1
1 392 . 8 1 1 A 31 31 ILE CB C 31 37.200 39.184 -1.984 1
1 396 . 8 1 1 A 31 31 ILE N N 31 122.500 121.594 0.906 1
1 397 . 8 1 1 A 32 32 SER H H 32 7.940 9.172 -1.232 1
1 398 . 8 1 1 A 32 32 SER HA H 32 4.070 4.301 -0.231 1
1 401 . 8 1 1 A 32 32 SER C C 32 175.800 173.604 2.196 1
1 402 . 8 1 1 A 32 32 SER CA C 32 60.200 60.818 -0.618 1
1 403 . 8 1 1 A 32 32 SER CB C 32 62.100 61.024 1.076 1
1 404 . 8 1 1 A 32 32 SER N N 32 115.300 115.382 -0.082 1
1 405 . 8 1 1 A 33 33 LYS H H 33 7.640 7.926 -0.286 1
1 406 . 8 1 1 A 33 33 LYS HA H 33 4.400 3.986 0.414 1
1 415 . 8 1 1 A 33 33 LYS C C 33 176.600 178.209 -1.609 1
1 416 . 8 1 1 A 33 33 LYS CA C 33 56.200 57.119 -0.919 1
1 417 . 8 1 1 A 33 33 LYS CB C 33 32.700 32.141 0.559 1
1 421 . 8 1 1 A 33 33 LYS N N 33 119.800 119.475 0.325 1
1 422 . 8 1 1 A 34 34 TRP H H 34 7.860 8.021 -0.161 1
1 423 . 8 1 1 A 34 34 TRP HA H 34 3.870 4.460 -0.590 1
1 426 . 8 1 1 A 34 34 TRP C C 34 178.600 178.121 0.479 1
1 427 . 8 1 1 A 34 34 TRP CA C 34 60.200 60.078 0.122 1
1 428 . 8 1 1 A 34 34 TRP CB C 34 28.500 28.295 0.205 1
1 429 . 8 1 1 A 34 34 TRP N N 34 120.000 119.618 0.382 1
1 430 . 8 1 1 A 35 35 ILE H H 35 8.200 7.133 1.067 1
1 431 . 8 1 1 A 35 35 ILE HA H 35 3.990 3.978 0.012 1
1 441 . 8 1 1 A 35 35 ILE C C 35 177.900 177.228 0.672 1
1 442 . 8 1 1 A 35 35 ILE CA C 35 64.300 62.291 2.009 1
1 443 . 8 1 1 A 35 35 ILE CB C 35 37.200 37.088 0.112 1
1 447 . 8 1 1 A 35 35 ILE N N 35 119.500 124.360 -4.860 1
1 448 . 8 1 1 A 36 36 ASP H H 36 7.680 7.851 -0.171 1
1 449 . 8 1 1 A 36 36 ASP HA H 36 4.490 4.126 0.364 1
1 452 . 8 1 1 A 36 36 ASP C C 36 179.200 178.296 0.904 1
1 453 . 8 1 1 A 36 36 ASP CA C 36 57.500 57.020 0.480 1
1 454 . 8 1 1 A 36 36 ASP CB C 36 40.400 40.813 -0.413 1
1 455 . 8 1 1 A 36 36 ASP N N 36 122.000 121.970 0.030 1
1 456 . 8 1 1 A 37 37 PHE H H 37 8.450 7.379 1.071 1
1 457 . 8 1 1 A 37 37 PHE HA H 37 4.080 4.082 -0.002 1
1 465 . 8 1 1 A 37 37 PHE C C 37 178.300 179.105 -0.805 1
1 466 . 8 1 1 A 37 37 PHE CA C 37 58.600 60.271 -1.671 1
1 467 . 8 1 1 A 37 37 PHE CB C 37 37.000 37.573 -0.573 1
1 473 . 8 1 1 A 37 37 PHE N N 37 119.800 118.067 1.733 1
1 474 . 8 1 1 A 38 38 SER H H 38 8.580 8.358 0.222 1
1 475 . 8 1 1 A 38 38 SER HA H 38 4.250 4.467 -0.217 1
1 478 . 8 1 1 A 38 38 SER C C 38 176.800 177.414 -0.614 1
1 479 . 8 1 1 A 38 38 SER CA C 38 62.700 61.758 0.942 1
1 480 . 8 1 1 A 38 38 SER CB C 38 62.700 62.775 -0.075 1
1 481 . 8 1 1 A 38 38 SER N N 38 115.800 116.692 -0.892 1
1 482 . 8 1 1 A 39 39 ASN H H 39 8.190 8.134 0.056 1
1 483 . 8 1 1 A 39 39 ASN HA H 39 4.540 4.407 0.133 1
1 488 . 8 1 1 A 39 39 ASN C C 39 178.500 178.295 0.205 1
1 489 . 8 1 1 A 39 39 ASN CA C 39 56.200 56.410 -0.210 1
1 490 . 8 1 1 A 39 39 ASN CB C 39 37.900 38.383 -0.483 1
1 491 . 8 1 1 A 39 39 ASN N N 39 121.300 121.245 0.055 1
1 493 . 8 1 1 A 40 40 VAL H H 40 7.840 7.846 -0.006 1
1 494 . 8 1 1 A 40 40 VAL HA H 40 3.650 3.572 0.078 1
1 502 . 8 1 1 A 40 40 VAL C C 40 179.000 178.260 0.740 1
1 503 . 8 1 1 A 40 40 VAL CA C 40 66.600 66.706 -0.106 1
1 504 . 8 1 1 A 40 40 VAL CB C 40 32.100 31.560 0.540 1
1 507 . 8 1 1 A 40 40 VAL N N 40 121.800 119.535 2.265 1
1 508 . 8 1 1 A 41 41 LEU H H 41 8.210 8.250 -0.040 1
1 509 . 8 1 1 A 41 41 LEU HA H 41 3.840 4.019 -0.179 1
1 519 . 8 1 1 A 41 41 LEU C C 41 178.800 179.174 -0.374 1
1 520 . 8 1 1 A 41 41 LEU CA C 41 57.400 57.903 -0.503 1
1 521 . 8 1 1 A 41 41 LEU CB C 41 41.200 41.376 -0.176 1
1 525 . 8 1 1 A 41 41 LEU N N 41 117.700 118.879 -1.179 1
1 526 . 8 1 1 A 42 42 SER H H 42 7.980 8.465 -0.485 1
1 527 . 8 1 1 A 42 42 SER HA H 42 4.260 4.212 0.048 1
1 530 . 8 1 1 A 42 42 SER C C 42 174.900 174.645 0.255 1
1 531 . 8 1 1 A 42 42 SER CA C 42 61.200 61.475 -0.275 1
1 532 . 8 1 1 A 42 42 SER CB C 42 63.100 63.117 -0.017 1
1 533 . 8 1 1 A 42 42 SER N N 42 113.200 114.376 -1.176 1
1 534 . 8 1 1 A 43 43 ARG H H 43 7.100 7.059 0.041 1
1 535 . 8 1 1 A 43 43 ARG HA H 43 4.500 4.328 0.172 1
1 542 . 8 1 1 A 43 43 ARG C C 43 175.800 174.869 0.931 1
1 543 . 8 1 1 A 43 43 ARG CA C 43 55.600 55.431 0.169 1
1 544 . 8 1 1 A 43 43 ARG CB C 43 30.800 30.640 0.160 1
1 547 . 8 1 1 A 43 43 ARG N N 43 118.400 117.216 1.184 1
1 548 . 8 1 1 A 44 44 LEU H H 44 7.610 7.108 0.502 1
1 549 . 8 1 1 A 44 44 LEU HA H 44 4.590 4.883 -0.293 1
1 559 . 8 1 1 A 44 44 LEU C C 44 175.300 174.189 1.111 1
1 560 . 8 1 1 A 44 44 LEU CA C 44 53.900 53.353 0.547 1
1 561 . 8 1 1 A 44 44 LEU CB C 44 44.100 45.299 -1.199 1
1 565 . 8 1 1 A 44 44 LEU N N 44 120.400 122.264 -1.864 1
1 566 . 8 1 1 A 45 45 TYR H H 45 7.630 8.881 -1.251 1
1 567 . 8 1 1 A 45 45 TYR HA H 45 5.180 5.168 0.012 1
1 574 . 8 1 1 A 45 45 TYR C C 45 174.600 174.552 0.048 1
1 575 . 8 1 1 A 45 45 TYR CA C 45 56.300 56.928 -0.628 1
1 576 . 8 1 1 A 45 45 TYR CB C 45 41.400 40.729 0.671 1
1 581 . 8 1 1 A 45 45 TYR N N 45 115.300 127.091 -11.791 1
1 582 . 8 1 1 A 46 46 VAL H H 46 8.770 8.838 -0.068 1
1 583 . 8 1 1 A 46 46 VAL HA H 46 4.540 4.982 -0.442 1
1 591 . 8 1 1 A 46 46 VAL C C 46 174.600 174.471 0.129 1
1 592 . 8 1 1 A 46 46 VAL CA C 46 59.600 59.715 -0.115 1
1 593 . 8 1 1 A 46 46 VAL CB C 46 34.700 34.697 0.003 1
1 596 . 8 1 1 A 46 46 VAL N N 46 115.400 124.118 -8.718 1
1 597 . 8 1 1 A 47 47 GLY H H 47 8.280 8.831 -0.551 1
1 598 . 8 1 1 A 47 47 GLY HA2 H 47 3.610 4.196 -0.586 1
1 599 . 8 1 1 A 47 47 GLY HA3 H 47 4.970 4.202 0.768 1
1 600 . 8 1 1 A 47 47 GLY C C 47 173.100 172.596 0.504 1
1 601 . 8 1 1 A 47 47 GLY CA C 47 43.600 46.166 -2.566 1
1 602 . 8 1 1 A 47 47 GLY N N 47 109.900 114.255 -4.355 1
1 603 . 8 1 1 A 48 48 VAL H H 48 7.630 8.283 -0.653 1
1 604 . 8 1 1 A 48 48 VAL HA H 48 4.320 4.619 -0.299 1
1 612 . 8 1 1 A 48 48 VAL CA C 48 58.700 58.588 0.112 1
1 613 . 8 1 1 A 48 48 VAL CB C 48 32.100 34.720 -2.620 1
1 616 . 8 1 1 A 48 48 VAL N N 48 109.900 122.174 -12.274 1
1 617 . 8 1 1 A 49 49 PRO HA H 49 4.800 4.789 0.011 1
1 624 . 8 1 1 A 49 49 PRO C C 49 176.700 176.500 0.200 1
1 625 . 8 1 1 A 49 49 PRO CA C 49 62.300 62.583 -0.283 1
1 626 . 8 1 1 A 49 49 PRO CB C 49 35.400 31.806 3.594 1
1 629 . 8 1 1 A 50 50 THR H H 50 8.790 8.431 0.359 1
1 630 . 8 1 1 A 50 50 THR HA H 50 4.690 5.093 -0.403 1
1 635 . 8 1 1 A 50 50 THR C C 50 173.500 173.834 -0.334 1
1 636 . 8 1 1 A 50 50 THR CA C 50 60.800 59.457 1.343 1
1 637 . 8 1 1 A 50 50 THR CB C 50 70.800 71.618 -0.818 1
1 639 . 8 1 1 A 50 50 THR N N 50 113.500 112.378 1.122 1
1 640 . 8 1 1 A 51 51 LYS H H 51 7.810 8.484 -0.674 1
1 641 . 8 1 1 A 51 51 LYS HA H 51 4.890 4.666 0.224 1
1 650 . 8 1 1 A 51 51 LYS C C 51 175.900 175.934 -0.034 1
1 651 . 8 1 1 A 51 51 LYS CA C 51 54.100 54.411 -0.311 1
1 652 . 8 1 1 A 51 51 LYS CB C 51 35.300 34.639 0.661 1
1 656 . 8 1 1 A 51 51 LYS N N 51 122.200 120.566 1.634 1
1 657 . 8 1 1 A 52 52 SER H H 52 8.410 8.547 -0.137 1
1 658 . 8 1 1 A 52 52 SER HA H 52 3.630 4.130 -0.500 1
1 661 . 8 1 1 A 52 52 SER C C 52 175.800 175.330 0.470 1
1 662 . 8 1 1 A 52 52 SER CA C 52 58.800 59.879 -1.079 1
1 663 . 8 1 1 A 52 52 SER CB C 52 62.600 62.820 -0.220 1
1 664 . 8 1 1 A 52 52 SER N N 52 118.900 117.217 1.683 1
1 665 . 8 1 1 A 53 53 GLY H H 53 9.070 8.970 0.100 1
1 666 . 8 1 1 A 53 53 GLY HA2 H 53 3.390 3.866 -0.476 1
1 667 . 8 1 1 A 53 53 GLY HA3 H 53 4.460 3.869 0.591 1
1 668 . 8 1 1 A 53 53 GLY C C 53 174.100 174.146 -0.046 1
1 669 . 8 1 1 A 53 53 GLY CA C 53 44.800 45.775 -0.975 1
1 670 . 8 1 1 A 53 53 GLY N N 53 115.600 114.806 0.794 1
1 671 . 8 1 1 A 54 54 ASN H H 54 7.870 7.742 0.128 1
1 672 . 8 1 1 A 54 54 ASN HA H 54 4.570 4.931 -0.361 1
1 677 . 8 1 1 A 54 54 ASN C C 54 175.500 174.205 1.295 1
1 678 . 8 1 1 A 54 54 ASN CA C 54 53.000 52.092 0.908 1
1 679 . 8 1 1 A 54 54 ASN CB C 54 38.600 39.601 -1.001 1
1 680 . 8 1 1 A 54 54 ASN N N 54 119.600 118.680 0.920 1
1 682 . 8 1 1 A 55 55 VAL H H 55 8.770 8.942 -0.172 1
1 683 . 8 1 1 A 55 55 VAL HA H 55 3.880 4.354 -0.474 1
1 691 . 8 1 1 A 55 55 VAL C C 55 176.200 176.734 -0.534 1
1 692 . 8 1 1 A 55 55 VAL CA C 55 63.700 62.854 0.846 1
1 693 . 8 1 1 A 55 55 VAL CB C 55 31.600 31.747 -0.147 1
1 696 . 8 1 1 A 55 55 VAL N N 55 123.900 123.420 0.480 1
1 697 . 8 1 1 A 56 56 VAL H H 56 9.050 9.098 -0.048 1
1 698 . 8 1 1 A 56 56 VAL HA H 56 3.990 4.293 -0.303 1
1 706 . 8 1 1 A 56 56 VAL C C 56 175.200 175.506 -0.306 1
1 707 . 8 1 1 A 56 56 VAL CA C 56 62.700 62.681 0.019 1
1 708 . 8 1 1 A 56 56 VAL CB C 56 32.900 32.773 0.127 1
1 711 . 8 1 1 A 56 56 VAL N N 56 127.500 121.948 5.552 1
1 712 . 8 1 1 A 57 57 CYS H H 57 7.250 7.559 -0.309 1
1 713 . 8 1 1 A 57 57 CYS HA H 57 4.370 4.885 -0.515 1
1 716 . 8 1 1 A 57 57 CYS C C 57 171.900 172.722 -0.822 1
1 717 . 8 1 1 A 57 57 CYS CA C 57 58.600 57.500 1.100 1
1 718 . 8 1 1 A 57 57 CYS CB C 57 28.600 30.868 -2.268 1
1 719 . 8 1 1 A 57 57 CYS N N 57 117.600 120.047 -2.447 1
1 720 . 8 1 1 A 58 58 LYS H H 58 8.880 8.763 0.117 1
1 721 . 8 1 1 A 58 58 LYS HA H 58 4.220 4.727 -0.507 1
1 730 . 8 1 1 A 58 58 LYS C C 58 176.000 177.105 -1.105 1
1 731 . 8 1 1 A 58 58 LYS CA C 58 54.400 55.102 -0.702 1
1 732 . 8 1 1 A 58 58 LYS CB C 58 33.600 33.802 -0.202 1
1 736 . 8 1 1 A 58 58 LYS N N 58 132.000 126.244 5.756 1
1 737 . 8 1 1 A 59 59 ASN H H 59 9.500 8.723 0.777 1
1 738 . 8 1 1 A 59 59 ASN HA H 59 4.040 4.296 -0.256 1
1 743 . 8 1 1 A 59 59 ASN C C 59 176.400 175.225 1.175 1
1 744 . 8 1 1 A 59 59 ASN CA C 59 53.200 53.840 -0.640 1
1 745 . 8 1 1 A 59 59 ASN CB C 59 35.900 37.142 -1.242 1
1 746 . 8 1 1 A 59 59 ASN N N 59 127.500 121.655 5.845 1
1 748 . 8 1 1 A 60 60 ILE H H 60 8.050 7.416 0.634 1
1 749 . 8 1 1 A 60 60 ILE HA H 60 3.680 3.849 -0.169 1
1 759 . 8 1 1 A 60 60 ILE C C 60 175.700 176.889 -1.189 1
1 760 . 8 1 1 A 60 60 ILE CA C 60 61.900 62.374 -0.474 1
1 761 . 8 1 1 A 60 60 ILE CB C 60 38.300 37.780 0.520 1
1 765 . 8 1 1 A 60 60 ILE N N 60 120.200 120.105 0.095 1
1 766 . 8 1 1 A 61 61 MET H H 61 9.590 9.379 0.211 1
1 767 . 8 1 1 A 61 61 MET HA H 61 3.920 4.192 -0.272 1
1 775 . 8 1 1 A 61 61 MET C C 61 174.300 176.000 -1.700 1
1 776 . 8 1 1 A 61 61 MET CA C 61 57.000 57.008 -0.008 1
1 777 . 8 1 1 A 61 61 MET CB C 61 31.300 31.257 0.043 1
1 780 . 8 1 1 A 61 61 MET N N 61 124.400 125.618 -1.218 1
1 781 . 8 1 1 A 62 62 ASN H H 62 8.250 8.408 -0.158 1
1 782 . 8 1 1 A 62 62 ASN HA H 62 4.400 5.409 -1.009 1
1 787 . 8 1 1 A 62 62 ASN C C 62 176.800 176.070 0.730 1
1 788 . 8 1 1 A 62 62 ASN CA C 62 54.400 53.898 0.502 1
1 789 . 8 1 1 A 62 62 ASN CB C 62 37.600 36.910 0.690 1
1 790 . 8 1 1 A 62 62 ASN N N 62 111.900 116.931 -5.031 1
1 792 . 8 1 1 A 63 63 THR H H 63 7.480 7.981 -0.501 1
1 793 . 8 1 1 A 63 63 THR HA H 63 4.210 4.641 -0.431 1
1 798 . 8 1 1 A 63 63 THR C C 63 177.100 175.540 1.560 1
1 799 . 8 1 1 A 63 63 THR CA C 63 62.900 62.397 0.503 1
1 800 . 8 1 1 A 63 63 THR CB C 63 72.500 70.743 1.757 1
1 802 . 8 1 1 A 63 63 THR N N 63 105.900 112.035 -6.135 1
1 803 . 8 1 1 A 64 64 GLY H H 64 9.110 7.966 1.144 1
1 804 . 8 1 1 A 64 64 GLY HA2 H 64 3.580 4.036 -0.456 1
1 805 . 8 1 1 A 64 64 GLY HA3 H 64 4.090 4.038 0.052 1
1 806 . 8 1 1 A 64 64 GLY C C 64 173.200 174.495 -1.295 1
1 807 . 8 1 1 A 64 64 GLY CA C 64 45.300 45.016 0.284 1
1 808 . 8 1 1 A 64 64 GLY N N 64 111.500 110.627 0.873 1
1 809 . 8 1 1 A 65 65 VAL H H 65 7.580 7.394 0.186 1
1 810 . 8 1 1 A 65 65 VAL HA H 65 4.060 3.913 0.147 1
1 818 . 8 1 1 A 65 65 VAL C C 65 172.900 174.776 -1.876 1
1 819 . 8 1 1 A 65 65 VAL CA C 65 61.400 62.322 -0.922 1
1 820 . 8 1 1 A 65 65 VAL CB C 65 32.900 31.604 1.296 1
1 823 . 8 1 1 A 65 65 VAL N N 65 121.600 122.087 -0.487 1
1 824 . 8 1 1 A 66 66 ASP H H 66 8.210 9.020 -0.810 1
1 825 . 8 1 1 A 66 66 ASP HA H 66 5.320 5.060 0.260 1
1 828 . 8 1 1 A 66 66 ASP C C 66 174.800 175.045 -0.245 1
1 829 . 8 1 1 A 66 66 ASP CA C 66 51.700 53.465 -1.765 1
1 830 . 8 1 1 A 66 66 ASP CB C 66 43.200 41.946 1.254 1
1 831 . 8 1 1 A 66 66 ASP N N 66 123.100 127.502 -4.402 1
1 832 . 8 1 1 A 67 67 ILE H H 67 8.540 8.863 -0.323 1
1 833 . 8 1 1 A 67 67 ILE HA H 67 4.630 4.477 0.153 1
1 843 . 8 1 1 A 67 67 ILE C C 67 175.600 175.892 -0.292 1
1 844 . 8 1 1 A 67 67 ILE CA C 67 56.900 60.930 -4.030 1
1 845 . 8 1 1 A 67 67 ILE CB C 67 35.300 37.212 -1.912 1
1 849 . 8 1 1 A 67 67 ILE N N 67 119.200 125.401 -6.201 1
1 850 . 8 1 1 A 68 68 ILE H H 68 9.420 9.135 0.285 1
1 851 . 8 1 1 A 68 68 ILE HA H 68 4.980 5.433 -0.453 1
1 861 . 8 1 1 A 68 68 ILE C C 68 175.000 174.509 0.491 1
1 862 . 8 1 1 A 68 68 ILE CA C 68 58.600 58.835 -0.235 1
1 863 . 8 1 1 A 68 68 ILE CB C 68 40.900 40.958 -0.058 1
1 867 . 8 1 1 A 68 68 ILE N N 68 125.000 122.991 2.009 1
1 868 . 8 1 1 A 69 69 CYS H H 69 8.870 9.088 -0.218 1
1 869 . 8 1 1 A 69 69 CYS HA H 69 4.610 4.903 -0.293 1
1 872 . 8 1 1 A 69 69 CYS C C 69 176.200 175.117 1.083 1
1 873 . 8 1 1 A 69 69 CYS CA C 69 58.900 58.090 0.810 1
1 874 . 8 1 1 A 69 69 CYS CB C 69 27.100 28.951 -1.851 1
1 875 . 8 1 1 A 69 69 CYS N N 69 122.300 123.416 -1.116 1
1 876 . 8 1 1 A 70 70 THR H H 70 8.270 8.358 -0.088 1
1 877 . 8 1 1 A 70 70 THR HA H 70 4.710 4.539 0.171 1
1 882 . 8 1 1 A 70 70 THR C C 70 173.600 174.302 -0.702 1
1 883 . 8 1 1 A 70 70 THR CA C 70 61.500 61.240 0.260 1
1 884 . 8 1 1 A 70 70 THR CB C 70 68.100 69.471 -1.371 1
1 886 . 8 1 1 A 70 70 THR N N 70 116.700 118.734 -2.034 1
1 887 . 8 1 1 A 71 71 LYS H H 71 7.370 7.439 -0.069 1
1 888 . 8 1 1 A 71 71 LYS HA H 71 4.520 4.549 -0.029 1
1 897 . 8 1 1 A 71 71 LYS CA C 71 55.100 54.376 0.724 1
1 898 . 8 1 1 A 71 71 LYS CB C 71 37.800 33.969 3.831 1
1 902 . 8 1 1 A 71 71 LYS N N 71 120.900 122.040 -1.140 1
1 903 . 8 1 1 A 72 72 ASN H H 72 8.580 8.769 -0.189 1
1 904 . 8 1 1 A 72 72 ASN HA H 72 4.620 5.220 -0.600 1
1 909 . 8 1 1 A 72 72 ASN C C 72 173.500 174.052 -0.552 1
1 910 . 8 1 1 A 72 72 ASN CA C 72 52.200 52.277 -0.077 1
1 911 . 8 1 1 A 72 72 ASN CB C 72 38.500 39.227 -0.727 1
1 912 . 8 1 1 A 72 72 ASN N N 72 122.700 120.092 2.608 1
1 914 . 8 1 1 A 73 73 LEU H H 73 8.100 9.736 -1.636 1
1 915 . 8 1 1 A 73 73 LEU HA H 73 4.680 4.784 -0.104 1
1 925 . 8 1 1 A 73 73 LEU CA C 73 51.000 52.078 -1.078 1
1 926 . 8 1 1 A 73 73 LEU CB C 73 42.500 41.626 0.874 1
1 930 . 8 1 1 A 73 73 LEU N N 73 125.100 125.902 -0.802 1
1 931 . 8 1 1 A 74 74 PRO HA H 74 4.670 4.661 0.009 1
1 938 . 8 1 1 A 74 74 PRO C C 74 176.500 177.600 -1.100 1
1 939 . 8 1 1 A 74 74 PRO CA C 74 61.800 62.830 -1.030 1
1 940 . 8 1 1 A 74 74 PRO CB C 74 32.800 31.761 1.039 1
1 943 . 8 1 1 A 75 75 LYS H H 75 8.280 8.864 -0.584 1
1 944 . 8 1 1 A 75 75 LYS HA H 75 4.110 3.979 0.131 1
1 953 . 8 1 1 A 75 75 LYS CA C 75 56.500 59.334 -2.834 1
1 954 . 8 1 1 A 75 75 LYS CB C 75 33.300 33.012 0.288 1
1 958 . 8 1 1 A 75 75 LYS N N 75 117.000 125.287 -8.287 1
1 959 . 8 1 1 A 76 76 ASP H H 76 8.570 8.291 0.279 1
1 960 . 8 1 1 A 76 76 ASP HA H 76 4.530 4.798 -0.268 1
1 963 . 8 1 1 A 76 76 ASP C C 76 176.300 176.494 -0.194 1
1 964 . 8 1 1 A 76 76 ASP CA C 76 55.000 53.149 1.851 1
1 965 . 8 1 1 A 76 76 ASP CB C 76 41.100 42.155 -1.055 1
1 966 . 8 1 1 A 76 76 ASP N N 76 122.700 117.930 4.770 1
1 967 . 8 1 1 A 77 77 SER H H 77 8.330 8.213 0.117 1
1 968 . 8 1 1 A 77 77 SER HA H 77 4.410 4.331 0.079 1
1 971 . 8 1 1 A 77 77 SER C C 77 174.300 173.297 1.003 1
1 972 . 8 1 1 A 77 77 SER CA C 77 58.000 60.517 -2.517 1
1 973 . 8 1 1 A 77 77 SER CB C 77 63.900 62.600 1.300 1
1 974 . 8 1 1 A 77 77 SER N N 77 116.100 113.883 2.217 1
1 975 . 8 1 1 A 78 78 LEU H H 78 8.350 7.960 0.390 1
1 976 . 8 1 1 A 78 78 LEU HA H 78 4.280 4.823 -0.543 1
1 986 . 8 1 1 A 78 78 LEU C C 78 177.200 174.877 2.323 1
1 987 . 8 1 1 A 78 78 LEU CA C 78 55.200 53.809 1.391 1
1 988 . 8 1 1 A 78 78 LEU CB C 78 42.100 46.630 -4.530 1
1 992 . 8 1 1 A 78 78 LEU N N 78 124.300 120.060 4.240 1
1 993 . 8 1 1 A 79 79 GLU H H 79 8.300 8.650 -0.350 1
1 994 . 8 1 1 A 79 79 GLU CA C 79 56.400 54.395 2.005 1
1 995 . 8 1 1 A 79 79 GLU CB C 79 30.200 32.928 -2.728 1
1 1 . 9 1 1 A 2 2 HIS HA H 2 4.640 4.825 -0.185 1
1 4 . 9 1 1 A 2 2 HIS C C 2 173.600 175.550 -1.950 1
1 5 . 9 1 1 A 2 2 HIS CA C 2 56.500 56.492 0.008 1
1 6 . 9 1 1 A 2 2 HIS CB C 2 31.000 30.699 0.301 1
1 7 . 9 1 1 A 3 3 LYS H H 3 8.160 8.419 -0.259 1
1 8 . 9 1 1 A 3 3 LYS HA H 3 4.660 5.152 -0.492 1
1 17 . 9 1 1 A 3 3 LYS C C 3 174.400 174.604 -0.204 1
1 18 . 9 1 1 A 3 3 LYS CA C 3 54.800 55.117 -0.317 1
1 19 . 9 1 1 A 3 3 LYS CB C 3 35.800 34.807 0.993 1
1 23 . 9 1 1 A 3 3 LYS N N 3 121.900 120.224 1.676 1
1 24 . 9 1 1 A 4 4 ASP H H 4 8.470 9.025 -0.555 1
1 25 . 9 1 1 A 4 4 ASP HA H 4 4.900 5.256 -0.356 1
1 28 . 9 1 1 A 4 4 ASP C C 4 176.900 174.901 1.999 1
1 29 . 9 1 1 A 4 4 ASP CA C 4 52.700 52.704 -0.004 1
1 30 . 9 1 1 A 4 4 ASP CB C 4 44.100 44.901 -0.801 1
1 31 . 9 1 1 A 4 4 ASP N N 4 117.900 124.669 -6.769 1
1 32 . 9 1 1 A 5 5 ILE H H 5 9.570 8.616 0.954 1
1 33 . 9 1 1 A 5 5 ILE HA H 5 3.640 4.029 -0.389 1
1 43 . 9 1 1 A 5 5 ILE C C 5 174.800 175.816 -1.016 1
1 44 . 9 1 1 A 5 5 ILE CA C 5 60.900 62.194 -1.294 1
1 45 . 9 1 1 A 5 5 ILE CB C 5 37.000 37.153 -0.153 1
1 49 . 9 1 1 A 5 5 ILE N N 5 124.400 122.795 1.605 1
1 50 . 9 1 1 A 6 6 PHE H H 6 7.790 8.810 -1.020 1
1 51 . 9 1 1 A 6 6 PHE HA H 6 3.160 4.673 -1.513 1
1 58 . 9 1 1 A 6 6 PHE C C 6 173.500 174.644 -1.144 1
1 59 . 9 1 1 A 6 6 PHE CA C 6 56.900 56.911 -0.011 1
1 60 . 9 1 1 A 6 6 PHE CB C 6 40.100 38.943 1.157 1
1 65 . 9 1 1 A 6 6 PHE N N 6 130.200 128.703 1.497 1
1 66 . 9 1 1 A 7 7 THR H H 7 6.790 8.508 -1.718 1
1 67 . 9 1 1 A 7 7 THR HA H 7 4.530 5.454 -0.924 1
1 72 . 9 1 1 A 7 7 THR C C 7 172.300 173.123 -0.823 1
1 73 . 9 1 1 A 7 7 THR CA C 7 59.200 59.844 -0.644 1
1 74 . 9 1 1 A 7 7 THR CB C 7 71.000 70.428 0.572 1
1 76 . 9 1 1 A 7 7 THR N N 7 117.900 117.151 0.749 1
1 77 . 9 1 1 A 8 8 SER H H 8 7.600 8.724 -1.124 1
1 78 . 9 1 1 A 8 8 SER HA H 8 4.180 4.694 -0.514 1
1 81 . 9 1 1 A 8 8 SER C C 8 175.300 171.591 3.709 1
1 82 . 9 1 1 A 8 8 SER CA C 8 55.800 55.852 -0.052 1
1 83 . 9 1 1 A 8 8 SER CB C 8 64.000 64.347 -0.347 1
1 84 . 9 1 1 A 8 8 SER N N 8 113.400 118.142 -4.742 1
1 85 . 9 1 1 A 9 9 VAL H H 9 8.880 8.748 0.132 1
1 86 . 9 1 1 A 9 9 VAL HA H 9 5.220 5.054 0.166 1
1 94 . 9 1 1 A 9 9 VAL C C 9 174.000 173.074 0.926 1
1 95 . 9 1 1 A 9 9 VAL CA C 9 59.100 59.770 -0.670 1
1 96 . 9 1 1 A 9 9 VAL CB C 9 36.500 34.940 1.560 1
1 99 . 9 1 1 A 9 9 VAL N N 9 114.700 120.834 -6.134 1
1 100 . 9 1 1 A 10 10 VAL H H 10 8.510 9.155 -0.645 1
1 101 . 9 1 1 A 10 10 VAL HA H 10 4.470 4.932 -0.462 1
1 109 . 9 1 1 A 10 10 VAL C C 10 173.700 173.991 -0.291 1
1 110 . 9 1 1 A 10 10 VAL CA C 10 59.400 59.693 -0.293 1
1 111 . 9 1 1 A 10 10 VAL CB C 10 36.000 34.762 1.238 1
1 114 . 9 1 1 A 10 10 VAL N N 10 117.100 127.513 -10.413 1
1 115 . 9 1 1 A 11 11 ARG H H 11 8.500 8.508 -0.008 1
1 116 . 9 1 1 A 11 11 ARG HA H 11 4.460 4.769 -0.309 1
1 123 . 9 1 1 A 11 11 ARG C C 11 174.500 175.042 -0.542 1
1 124 . 9 1 1 A 11 11 ARG CA C 11 57.400 55.958 1.442 1
1 125 . 9 1 1 A 11 11 ARG CB C 11 31.000 31.074 -0.074 1
1 128 . 9 1 1 A 11 11 ARG N N 11 124.800 126.909 -2.109 1
1 129 . 9 1 1 A 12 12 VAL H H 12 7.650 8.801 -1.151 1
1 130 . 9 1 1 A 12 12 VAL HA H 12 4.970 4.429 0.541 1
1 138 . 9 1 1 A 12 12 VAL C C 12 176.700 175.078 1.622 1
1 139 . 9 1 1 A 12 12 VAL CA C 12 59.400 62.115 -2.715 1
1 140 . 9 1 1 A 12 12 VAL CB C 12 34.400 32.442 1.958 1
1 143 . 9 1 1 A 12 12 VAL N N 12 120.900 125.442 -4.542 1
1 144 . 9 1 1 A 13 13 ARG H H 13 9.020 8.996 0.024 1
1 145 . 9 1 1 A 13 13 ARG HA H 13 4.700 5.080 -0.380 1
1 152 . 9 1 1 A 13 13 ARG C C 13 176.000 175.113 0.887 1
1 153 . 9 1 1 A 13 13 ARG CA C 13 54.600 54.611 -0.011 1
1 154 . 9 1 1 A 13 13 ARG CB C 13 32.900 32.568 0.332 1
1 157 . 9 1 1 A 13 13 ARG N N 13 127.500 127.398 0.102 1
1 158 . 9 1 1 A 14 14 GLY H H 14 8.640 8.307 0.333 1
1 159 . 9 1 1 A 14 14 GLY HA2 H 14 3.680 4.142 -0.462 1
1 160 . 9 1 1 A 14 14 GLY HA3 H 14 4.190 4.148 0.042 1
1 161 . 9 1 1 A 14 14 GLY C C 14 173.700 172.290 1.410 1
1 162 . 9 1 1 A 14 14 GLY CA C 14 45.600 43.973 1.627 1
1 163 . 9 1 1 A 14 14 GLY N N 14 108.800 112.686 -3.886 1
1 164 . 9 1 1 A 15 15 SER H H 15 8.220 8.325 -0.105 1
1 165 . 9 1 1 A 15 15 SER HA H 15 5.020 4.724 0.296 1
1 168 . 9 1 1 A 15 15 SER C C 15 175.400 173.821 1.579 1
1 169 . 9 1 1 A 15 15 SER CA C 15 55.300 57.750 -2.450 1
1 170 . 9 1 1 A 15 15 SER CB C 15 64.900 63.595 1.305 1
1 171 . 9 1 1 A 15 15 SER N N 15 113.200 115.261 -2.061 1
1 172 . 9 1 1 A 16 16 LYS H H 16 9.930 8.385 1.545 1
1 173 . 9 1 1 A 16 16 LYS HA H 16 4.190 5.019 -0.829 1
1 182 . 9 1 1 A 16 16 LYS C C 16 176.500 176.177 0.323 1
1 183 . 9 1 1 A 16 16 LYS CA C 16 57.300 54.883 2.417 1
1 184 . 9 1 1 A 16 16 LYS CB C 16 32.300 34.684 -2.384 1
1 188 . 9 1 1 A 16 16 LYS N N 16 129.200 125.928 3.272 1
1 189 . 9 1 1 A 17 17 LYS H H 17 7.960 8.050 -0.090 1
1 190 . 9 1 1 A 17 17 LYS HA H 17 4.030 4.165 -0.135 1
1 199 . 9 1 1 A 17 17 LYS C C 17 175.600 175.435 0.165 1
1 200 . 9 1 1 A 17 17 LYS CA C 17 56.900 57.799 -0.899 1
1 201 . 9 1 1 A 17 17 LYS CB C 17 34.700 33.477 1.223 1
1 205 . 9 1 1 A 17 17 LYS N N 17 118.500 119.322 -0.822 1
1 206 . 9 1 1 A 18 18 TYR H H 18 7.780 7.923 -0.143 1
1 207 . 9 1 1 A 18 18 TYR HA H 18 4.760 4.872 -0.112 1
1 214 . 9 1 1 A 18 18 TYR C C 18 174.000 175.893 -1.893 1
1 215 . 9 1 1 A 18 18 TYR CA C 18 56.800 56.516 0.284 1
1 216 . 9 1 1 A 18 18 TYR CB C 18 41.100 38.974 2.126 1
1 221 . 9 1 1 A 18 18 TYR N N 18 117.100 118.001 -0.901 1
1 222 . 9 1 1 A 19 19 ASN H H 19 8.890 8.795 0.095 1
1 223 . 9 1 1 A 19 19 ASN HA H 19 4.960 4.746 0.214 1
1 228 . 9 1 1 A 19 19 ASN C C 19 176.100 175.232 0.868 1
1 229 . 9 1 1 A 19 19 ASN CA C 19 53.600 55.322 -1.722 1
1 230 . 9 1 1 A 19 19 ASN CB C 19 40.300 39.841 0.459 1
1 231 . 9 1 1 A 19 19 ASN N N 19 116.600 122.638 -6.038 1
1 233 . 9 1 1 A 20 20 VAL H H 20 7.730 7.468 0.262 1
1 234 . 9 1 1 A 20 20 VAL HA H 20 5.250 4.961 0.289 1
1 242 . 9 1 1 A 20 20 VAL C C 20 173.800 174.385 -0.585 1
1 243 . 9 1 1 A 20 20 VAL CA C 20 59.400 59.823 -0.423 1
1 244 . 9 1 1 A 20 20 VAL CB C 20 37.600 35.351 2.249 1
1 247 . 9 1 1 A 20 20 VAL N N 20 113.900 113.268 0.632 1
1 248 . 9 1 1 A 21 21 VAL H H 21 8.890 8.651 0.239 1
1 249 . 9 1 1 A 21 21 VAL HA H 21 4.840 4.783 0.057 1
1 257 . 9 1 1 A 21 21 VAL CA C 21 56.800 56.405 0.395 1
1 258 . 9 1 1 A 21 21 VAL CB C 21 36.000 35.202 0.798 1
1 261 . 9 1 1 A 21 21 VAL N N 21 118.500 122.666 -4.166 1
1 262 . 9 1 1 A 22 22 PRO HA H 22 4.940 5.128 -0.188 1
1 269 . 9 1 1 A 22 22 PRO C C 22 175.600 176.465 -0.865 1
1 270 . 9 1 1 A 22 22 PRO CA C 22 62.700 62.648 0.052 1
1 271 . 9 1 1 A 22 22 PRO CB C 22 31.800 31.750 0.050 1
1 274 . 9 1 1 A 23 23 VAL H H 23 8.060 8.769 -0.709 1
1 275 . 9 1 1 A 23 23 VAL HA H 23 5.390 5.106 0.284 1
1 283 . 9 1 1 A 23 23 VAL C C 23 175.400 174.293 1.107 1
1 284 . 9 1 1 A 23 23 VAL CA C 23 57.800 59.225 -1.425 1
1 285 . 9 1 1 A 23 23 VAL CB C 23 36.300 35.485 0.815 1
1 288 . 9 1 1 A 23 23 VAL N N 23 110.900 116.612 -5.712 1
1 289 . 9 1 1 A 24 24 LYS H H 24 8.960 9.419 -0.459 1
1 290 . 9 1 1 A 24 24 LYS HA H 24 5.600 5.234 0.366 1
1 299 . 9 1 1 A 24 24 LYS C C 24 175.600 174.556 1.044 1
1 300 . 9 1 1 A 24 24 LYS CA C 24 54.200 54.170 0.030 1
1 301 . 9 1 1 A 24 24 LYS CB C 24 37.000 36.314 0.686 1
1 305 . 9 1 1 A 24 24 LYS N N 24 117.900 120.949 -3.049 1
1 306 . 9 1 1 A 25 25 SER H H 25 8.950 8.424 0.526 1
1 307 . 9 1 1 A 25 25 SER HA H 25 5.190 5.327 -0.137 1
1 310 . 9 1 1 A 25 25 SER C C 25 173.800 175.726 -1.926 1
1 311 . 9 1 1 A 25 25 SER CA C 25 57.700 56.475 1.225 1
1 312 . 9 1 1 A 25 25 SER CB C 25 65.100 64.625 0.475 1
1 313 . 9 1 1 A 25 25 SER N N 25 114.600 114.138 0.462 1
1 314 . 9 1 1 A 26 26 ASN H H 26 9.020 8.517 0.503 1
1 315 . 9 1 1 A 26 26 ASN HA H 26 4.370 4.608 -0.238 1
1 320 . 9 1 1 A 26 26 ASN C C 26 173.500 174.376 -0.876 1
1 321 . 9 1 1 A 26 26 ASN CA C 26 53.700 53.770 -0.070 1
1 322 . 9 1 1 A 26 26 ASN CB C 26 37.100 37.566 -0.466 1
1 323 . 9 1 1 A 26 26 ASN N N 26 118.300 120.119 -1.819 1
1 325 . 9 1 1 A 27 27 LYS H H 27 7.400 7.440 -0.040 1
1 326 . 9 1 1 A 27 27 LYS HA H 27 4.780 4.757 0.023 1
1 335 . 9 1 1 A 27 27 LYS CA C 27 53.500 52.452 1.048 1
1 336 . 9 1 1 A 27 27 LYS CB C 27 34.100 33.698 0.402 1
1 340 . 9 1 1 A 27 27 LYS N N 27 116.600 118.462 -1.862 1
1 341 . 9 1 1 A 28 28 PRO HA H 28 4.040 4.519 -0.479 1
1 348 . 9 1 1 A 28 28 PRO C C 28 174.500 175.863 -1.363 1
1 349 . 9 1 1 A 28 28 PRO CA C 28 63.200 63.075 0.125 1
1 350 . 9 1 1 A 28 28 PRO CB C 28 32.500 32.326 0.174 1
1 353 . 9 1 1 A 29 29 VAL H H 29 8.860 8.840 0.020 1
1 354 . 9 1 1 A 29 29 VAL HA H 29 4.420 4.329 0.091 1
1 362 . 9 1 1 A 29 29 VAL C C 29 174.800 175.344 -0.544 1
1 363 . 9 1 1 A 29 29 VAL CA C 29 60.300 60.623 -0.323 1
1 364 . 9 1 1 A 29 29 VAL CB C 29 36.400 33.643 2.757 1
1 367 . 9 1 1 A 29 29 VAL N N 29 119.800 123.320 -3.520 1
1 368 . 9 1 1 A 30 30 GLU H H 30 9.550 8.579 0.971 1
1 369 . 9 1 1 A 30 30 GLU HA H 30 4.260 4.365 -0.105 1
1 374 . 9 1 1 A 30 30 GLU C C 30 177.800 177.903 -0.103 1
1 375 . 9 1 1 A 30 30 GLU CA C 30 58.000 57.211 0.789 1
1 376 . 9 1 1 A 30 30 GLU CB C 30 29.700 31.100 -1.400 1
1 378 . 9 1 1 A 30 30 GLU N N 30 128.900 126.612 2.288 1
1 379 . 9 1 1 A 31 31 ILE H H 31 7.910 8.982 -1.072 1
1 380 . 9 1 1 A 31 31 ILE HA H 31 2.120 4.042 -1.922 1
1 390 . 9 1 1 A 31 31 ILE C C 31 178.000 177.641 0.359 1
1 391 . 9 1 1 A 31 31 ILE CA C 31 63.500 63.212 0.288 1
1 392 . 9 1 1 A 31 31 ILE CB C 31 37.200 38.157 -0.957 1
1 396 . 9 1 1 A 31 31 ILE N N 31 122.500 129.504 -7.004 1
1 397 . 9 1 1 A 32 32 SER H H 32 7.940 8.071 -0.131 1
1 398 . 9 1 1 A 32 32 SER HA H 32 4.070 4.367 -0.297 1
1 401 . 9 1 1 A 32 32 SER C C 32 175.800 175.346 0.454 1
1 402 . 9 1 1 A 32 32 SER CA C 32 60.200 60.584 -0.384 1
1 403 . 9 1 1 A 32 32 SER CB C 32 62.100 63.183 -1.083 1
1 404 . 9 1 1 A 32 32 SER N N 32 115.300 116.331 -1.031 1
1 405 . 9 1 1 A 33 33 LYS H H 33 7.640 8.080 -0.440 1
1 406 . 9 1 1 A 33 33 LYS HA H 33 4.400 4.525 -0.125 1
1 415 . 9 1 1 A 33 33 LYS C C 33 176.600 177.537 -0.937 1
1 416 . 9 1 1 A 33 33 LYS CA C 33 56.200 55.854 0.346 1
1 417 . 9 1 1 A 33 33 LYS CB C 33 32.700 33.315 -0.615 1
1 421 . 9 1 1 A 33 33 LYS N N 33 119.800 118.725 1.075 1
1 422 . 9 1 1 A 34 34 TRP H H 34 7.860 8.124 -0.264 1
1 423 . 9 1 1 A 34 34 TRP HA H 34 3.870 4.028 -0.158 1
1 426 . 9 1 1 A 34 34 TRP C C 34 178.600 178.181 0.419 1
1 427 . 9 1 1 A 34 34 TRP CA C 34 60.200 59.851 0.349 1
1 428 . 9 1 1 A 34 34 TRP CB C 34 28.500 28.141 0.359 1
1 429 . 9 1 1 A 34 34 TRP N N 34 120.000 121.166 -1.166 1
1 430 . 9 1 1 A 35 35 ILE H H 35 8.200 7.790 0.410 1
1 431 . 9 1 1 A 35 35 ILE HA H 35 3.990 3.295 0.695 1
1 441 . 9 1 1 A 35 35 ILE C C 35 177.900 177.088 0.812 1
1 442 . 9 1 1 A 35 35 ILE CA C 35 64.300 62.364 1.936 1
1 443 . 9 1 1 A 35 35 ILE CB C 35 37.200 37.310 -0.110 1
1 447 . 9 1 1 A 35 35 ILE N N 35 119.500 123.611 -4.111 1
1 448 . 9 1 1 A 36 36 ASP H H 36 7.680 7.811 -0.131 1
1 449 . 9 1 1 A 36 36 ASP HA H 36 4.490 4.191 0.299 1
1 452 . 9 1 1 A 36 36 ASP C C 36 179.200 178.380 0.820 1
1 453 . 9 1 1 A 36 36 ASP CA C 36 57.500 56.969 0.531 1
1 454 . 9 1 1 A 36 36 ASP CB C 36 40.400 40.773 -0.373 1
1 455 . 9 1 1 A 36 36 ASP N N 36 122.000 121.687 0.313 1
1 456 . 9 1 1 A 37 37 PHE H H 37 8.450 8.258 0.192 1
1 457 . 9 1 1 A 37 37 PHE HA H 37 4.080 4.268 -0.188 1
1 465 . 9 1 1 A 37 37 PHE C C 37 178.300 178.607 -0.307 1
1 466 . 9 1 1 A 37 37 PHE CA C 37 58.600 60.107 -1.507 1
1 467 . 9 1 1 A 37 37 PHE CB C 37 37.000 38.072 -1.072 1
1 473 . 9 1 1 A 37 37 PHE N N 37 119.800 118.909 0.891 1
1 474 . 9 1 1 A 38 38 SER H H 38 8.580 8.081 0.499 1
1 475 . 9 1 1 A 38 38 SER HA H 38 4.250 4.343 -0.093 1
1 478 . 9 1 1 A 38 38 SER C C 38 176.800 177.633 -0.833 1
1 479 . 9 1 1 A 38 38 SER CA C 38 62.700 61.677 1.023 1
1 480 . 9 1 1 A 38 38 SER CB C 38 62.700 62.505 0.195 1
1 481 . 9 1 1 A 38 38 SER N N 38 115.800 115.841 -0.041 1
1 482 . 9 1 1 A 39 39 ASN H H 39 8.190 7.942 0.248 1
1 483 . 9 1 1 A 39 39 ASN HA H 39 4.540 4.361 0.179 1
1 488 . 9 1 1 A 39 39 ASN C C 39 178.500 177.968 0.532 1
1 489 . 9 1 1 A 39 39 ASN CA C 39 56.200 56.496 -0.296 1
1 490 . 9 1 1 A 39 39 ASN CB C 39 37.900 37.952 -0.052 1
1 491 . 9 1 1 A 39 39 ASN N N 39 121.300 121.187 0.113 1
1 493 . 9 1 1 A 40 40 VAL H H 40 7.840 7.964 -0.124 1
1 494 . 9 1 1 A 40 40 VAL HA H 40 3.650 3.512 0.138 1
1 502 . 9 1 1 A 40 40 VAL C C 40 179.000 177.929 1.071 1
1 503 . 9 1 1 A 40 40 VAL CA C 40 66.600 66.562 0.038 1
1 504 . 9 1 1 A 40 40 VAL CB C 40 32.100 31.486 0.614 1
1 507 . 9 1 1 A 40 40 VAL N N 40 121.800 119.832 1.968 1
1 508 . 9 1 1 A 41 41 LEU H H 41 8.210 8.083 0.127 1
1 509 . 9 1 1 A 41 41 LEU HA H 41 3.840 4.090 -0.250 1
1 519 . 9 1 1 A 41 41 LEU C C 41 178.800 178.209 0.591 1
1 520 . 9 1 1 A 41 41 LEU CA C 41 57.400 57.008 0.392 1
1 521 . 9 1 1 A 41 41 LEU CB C 41 41.200 41.286 -0.086 1
1 525 . 9 1 1 A 41 41 LEU N N 41 117.700 119.054 -1.354 1
1 526 . 9 1 1 A 42 42 SER H H 42 7.980 7.858 0.122 1
1 527 . 9 1 1 A 42 42 SER HA H 42 4.260 4.374 -0.114 1
1 530 . 9 1 1 A 42 42 SER C C 42 174.900 174.935 -0.035 1
1 531 . 9 1 1 A 42 42 SER CA C 42 61.200 60.238 0.962 1
1 532 . 9 1 1 A 42 42 SER CB C 42 63.100 63.486 -0.386 1
1 533 . 9 1 1 A 42 42 SER N N 42 113.200 115.711 -2.511 1
1 534 . 9 1 1 A 43 43 ARG H H 43 7.100 7.564 -0.464 1
1 535 . 9 1 1 A 43 43 ARG HA H 43 4.500 4.157 0.343 1
1 542 . 9 1 1 A 43 43 ARG C C 43 175.800 176.320 -0.520 1
1 543 . 9 1 1 A 43 43 ARG CA C 43 55.600 55.975 -0.375 1
1 544 . 9 1 1 A 43 43 ARG CB C 43 30.800 31.522 -0.722 1
1 547 . 9 1 1 A 43 43 ARG N N 43 118.400 118.051 0.349 1
1 548 . 9 1 1 A 44 44 LEU H H 44 7.610 7.159 0.451 1
1 549 . 9 1 1 A 44 44 LEU HA H 44 4.590 4.314 0.276 1
1 559 . 9 1 1 A 44 44 LEU C C 44 175.300 174.341 0.959 1
1 560 . 9 1 1 A 44 44 LEU CA C 44 53.900 54.016 -0.116 1
1 561 . 9 1 1 A 44 44 LEU CB C 44 44.100 42.039 2.061 1
1 565 . 9 1 1 A 44 44 LEU N N 44 120.400 122.222 -1.822 1
1 566 . 9 1 1 A 45 45 TYR H H 45 7.630 8.512 -0.882 1
1 567 . 9 1 1 A 45 45 TYR HA H 45 5.180 4.975 0.205 1
1 574 . 9 1 1 A 45 45 TYR C C 45 174.600 175.306 -0.706 1
1 575 . 9 1 1 A 45 45 TYR CA C 45 56.300 57.196 -0.896 1
1 576 . 9 1 1 A 45 45 TYR CB C 45 41.400 37.762 3.638 1
1 581 . 9 1 1 A 45 45 TYR N N 45 115.300 127.364 -12.064 1
1 582 . 9 1 1 A 46 46 VAL H H 46 8.770 8.866 -0.096 1
1 583 . 9 1 1 A 46 46 VAL HA H 46 4.540 5.065 -0.525 1
1 591 . 9 1 1 A 46 46 VAL C C 46 174.600 174.523 0.077 1
1 592 . 9 1 1 A 46 46 VAL CA C 46 59.600 59.523 0.077 1
1 593 . 9 1 1 A 46 46 VAL CB C 46 34.700 35.853 -1.153 1
1 596 . 9 1 1 A 46 46 VAL N N 46 115.400 117.999 -2.599 1
1 597 . 9 1 1 A 47 47 GLY H H 47 8.280 8.338 -0.058 1
1 598 . 9 1 1 A 47 47 GLY HA2 H 47 3.610 4.146 -0.536 1
1 599 . 9 1 1 A 47 47 GLY HA3 H 47 4.970 4.154 0.816 1
1 600 . 9 1 1 A 47 47 GLY C C 47 173.100 171.514 1.586 1
1 601 . 9 1 1 A 47 47 GLY CA C 47 43.600 45.575 -1.975 1
1 602 . 9 1 1 A 47 47 GLY N N 47 109.900 108.522 1.378 1
1 603 . 9 1 1 A 48 48 VAL H H 48 7.630 8.404 -0.774 1
1 604 . 9 1 1 A 48 48 VAL HA H 48 4.320 4.671 -0.351 1
1 612 . 9 1 1 A 48 48 VAL CA C 48 58.700 59.382 -0.682 1
1 613 . 9 1 1 A 48 48 VAL CB C 48 32.100 34.705 -2.605 1
1 616 . 9 1 1 A 48 48 VAL N N 48 109.900 118.849 -8.949 1
1 617 . 9 1 1 A 49 49 PRO HA H 49 4.800 4.627 0.173 1
1 624 . 9 1 1 A 49 49 PRO C C 49 176.700 176.038 0.662 1
1 625 . 9 1 1 A 49 49 PRO CA C 49 62.300 63.489 -1.189 1
1 626 . 9 1 1 A 49 49 PRO CB C 49 35.400 31.932 3.468 1
1 629 . 9 1 1 A 50 50 THR H H 50 8.790 8.398 0.392 1
1 630 . 9 1 1 A 50 50 THR HA H 50 4.690 5.161 -0.471 1
1 635 . 9 1 1 A 50 50 THR C C 50 173.500 173.375 0.125 1
1 636 . 9 1 1 A 50 50 THR CA C 50 60.800 59.598 1.202 1
1 637 . 9 1 1 A 50 50 THR CB C 50 70.800 72.355 -1.555 1
1 639 . 9 1 1 A 50 50 THR N N 50 113.500 112.042 1.458 1
1 640 . 9 1 1 A 51 51 LYS H H 51 7.810 8.701 -0.891 1
1 641 . 9 1 1 A 51 51 LYS HA H 51 4.890 4.718 0.172 1
1 650 . 9 1 1 A 51 51 LYS C C 51 175.900 175.892 0.008 1
1 651 . 9 1 1 A 51 51 LYS CA C 51 54.100 55.090 -0.990 1
1 652 . 9 1 1 A 51 51 LYS CB C 51 35.300 33.232 2.068 1
1 656 . 9 1 1 A 51 51 LYS N N 51 122.200 120.965 1.235 1
1 657 . 9 1 1 A 52 52 SER H H 52 8.410 8.889 -0.479 1
1 658 . 9 1 1 A 52 52 SER HA H 52 3.630 4.424 -0.794 1
1 661 . 9 1 1 A 52 52 SER C C 52 175.800 174.367 1.433 1
1 662 . 9 1 1 A 52 52 SER CA C 52 58.800 58.461 0.339 1
1 663 . 9 1 1 A 52 52 SER CB C 52 62.600 62.789 -0.189 1
1 664 . 9 1 1 A 52 52 SER N N 52 118.900 115.733 3.167 1
1 665 . 9 1 1 A 53 53 GLY H H 53 9.070 8.512 0.558 1
1 666 . 9 1 1 A 53 53 GLY HA2 H 53 3.390 3.858 -0.468 1
1 667 . 9 1 1 A 53 53 GLY HA3 H 53 4.460 3.859 0.601 1
1 668 . 9 1 1 A 53 53 GLY C C 53 174.100 174.184 -0.084 1
1 669 . 9 1 1 A 53 53 GLY CA C 53 44.800 46.090 -1.290 1
1 670 . 9 1 1 A 53 53 GLY N N 53 115.600 113.723 1.877 1
1 671 . 9 1 1 A 54 54 ASN H H 54 7.870 7.804 0.066 1
1 672 . 9 1 1 A 54 54 ASN HA H 54 4.570 4.890 -0.320 1
1 677 . 9 1 1 A 54 54 ASN C C 54 175.500 174.493 1.007 1
1 678 . 9 1 1 A 54 54 ASN CA C 54 53.000 52.118 0.882 1
1 679 . 9 1 1 A 54 54 ASN CB C 54 38.600 39.503 -0.903 1
1 680 . 9 1 1 A 54 54 ASN N N 54 119.600 118.720 0.880 1
1 682 . 9 1 1 A 55 55 VAL H H 55 8.770 8.942 -0.172 1
1 683 . 9 1 1 A 55 55 VAL HA H 55 3.880 4.013 -0.133 1
1 691 . 9 1 1 A 55 55 VAL C C 55 176.200 175.277 0.923 1
1 692 . 9 1 1 A 55 55 VAL CA C 55 63.700 63.314 0.386 1
1 693 . 9 1 1 A 55 55 VAL CB C 55 31.600 31.096 0.504 1
1 696 . 9 1 1 A 55 55 VAL N N 55 123.900 123.450 0.450 1
1 697 . 9 1 1 A 56 56 VAL H H 56 9.050 9.228 -0.178 1
1 698 . 9 1 1 A 56 56 VAL HA H 56 3.990 4.013 -0.023 1
1 706 . 9 1 1 A 56 56 VAL C C 56 175.200 176.339 -1.139 1
1 707 . 9 1 1 A 56 56 VAL CA C 56 62.700 64.146 -1.446 1
1 708 . 9 1 1 A 56 56 VAL CB C 56 32.900 32.499 0.401 1
1 711 . 9 1 1 A 56 56 VAL N N 56 127.500 128.951 -1.451 1
1 712 . 9 1 1 A 57 57 CYS H H 57 7.250 7.601 -0.351 1
1 713 . 9 1 1 A 57 57 CYS HA H 57 4.370 4.868 -0.498 1
1 716 . 9 1 1 A 57 57 CYS C C 57 171.900 172.744 -0.844 1
1 717 . 9 1 1 A 57 57 CYS CA C 57 58.600 57.714 0.886 1
1 718 . 9 1 1 A 57 57 CYS CB C 57 28.600 30.884 -2.284 1
1 719 . 9 1 1 A 57 57 CYS N N 57 117.600 117.491 0.109 1
1 720 . 9 1 1 A 58 58 LYS H H 58 8.880 8.834 0.046 1
1 721 . 9 1 1 A 58 58 LYS HA H 58 4.220 4.748 -0.528 1
1 730 . 9 1 1 A 58 58 LYS C C 58 176.000 176.242 -0.242 1
1 731 . 9 1 1 A 58 58 LYS CA C 58 54.400 55.029 -0.629 1
1 732 . 9 1 1 A 58 58 LYS CB C 58 33.600 34.816 -1.216 1
1 736 . 9 1 1 A 58 58 LYS N N 58 132.000 127.885 4.115 1
1 737 . 9 1 1 A 59 59 ASN H H 59 9.500 9.115 0.385 1
1 738 . 9 1 1 A 59 59 ASN HA H 59 4.040 4.320 -0.280 1
1 743 . 9 1 1 A 59 59 ASN C C 59 176.400 175.301 1.099 1
1 744 . 9 1 1 A 59 59 ASN CA C 59 53.200 54.240 -1.040 1
1 745 . 9 1 1 A 59 59 ASN CB C 59 35.900 37.922 -2.022 1
1 746 . 9 1 1 A 59 59 ASN N N 59 127.500 123.775 3.725 1
1 748 . 9 1 1 A 60 60 ILE H H 60 8.050 7.501 0.549 1
1 749 . 9 1 1 A 60 60 ILE HA H 60 3.680 3.693 -0.013 1
1 759 . 9 1 1 A 60 60 ILE C C 60 175.700 176.726 -1.026 1
1 760 . 9 1 1 A 60 60 ILE CA C 60 61.900 62.229 -0.329 1
1 761 . 9 1 1 A 60 60 ILE CB C 60 38.300 37.773 0.527 1
1 765 . 9 1 1 A 60 60 ILE N N 60 120.200 120.623 -0.423 1
1 766 . 9 1 1 A 61 61 MET H H 61 9.590 9.321 0.269 1
1 767 . 9 1 1 A 61 61 MET HA H 61 3.920 4.047 -0.127 1
1 775 . 9 1 1 A 61 61 MET C C 61 174.300 175.459 -1.159 1
1 776 . 9 1 1 A 61 61 MET CA C 61 57.000 56.762 0.238 1
1 777 . 9 1 1 A 61 61 MET CB C 61 31.300 30.843 0.457 1
1 780 . 9 1 1 A 61 61 MET N N 61 124.400 126.586 -2.186 1
1 781 . 9 1 1 A 62 62 ASN H H 62 8.250 8.267 -0.017 1
1 782 . 9 1 1 A 62 62 ASN HA H 62 4.400 4.615 -0.215 1
1 787 . 9 1 1 A 62 62 ASN C C 62 176.800 175.001 1.799 1
1 788 . 9 1 1 A 62 62 ASN CA C 62 54.400 54.905 -0.505 1
1 789 . 9 1 1 A 62 62 ASN CB C 62 37.600 36.940 0.660 1
1 790 . 9 1 1 A 62 62 ASN N N 62 111.900 109.245 2.655 1
1 792 . 9 1 1 A 63 63 THR H H 63 7.480 7.617 -0.137 1
1 793 . 9 1 1 A 63 63 THR HA H 63 4.210 4.407 -0.197 1
1 798 . 9 1 1 A 63 63 THR C C 63 177.100 174.926 2.174 1
1 799 . 9 1 1 A 63 63 THR CA C 63 62.900 62.855 0.045 1
1 800 . 9 1 1 A 63 63 THR CB C 63 72.500 69.419 3.081 1
1 802 . 9 1 1 A 63 63 THR N N 63 105.900 112.622 -6.722 1
1 803 . 9 1 1 A 64 64 GLY H H 64 9.110 7.942 1.168 1
1 804 . 9 1 1 A 64 64 GLY HA2 H 64 3.580 3.985 -0.405 1
1 805 . 9 1 1 A 64 64 GLY HA3 H 64 4.090 3.988 0.102 1
1 806 . 9 1 1 A 64 64 GLY C C 64 173.200 174.495 -1.295 1
1 807 . 9 1 1 A 64 64 GLY CA C 64 45.300 45.656 -0.356 1
1 808 . 9 1 1 A 64 64 GLY N N 64 111.500 110.641 0.859 1
1 809 . 9 1 1 A 65 65 VAL H H 65 7.580 7.699 -0.119 1
1 810 . 9 1 1 A 65 65 VAL HA H 65 4.060 3.922 0.138 1
1 818 . 9 1 1 A 65 65 VAL C C 65 172.900 174.919 -2.019 1
1 819 . 9 1 1 A 65 65 VAL CA C 65 61.400 62.549 -1.149 1
1 820 . 9 1 1 A 65 65 VAL CB C 65 32.900 32.042 0.858 1
1 823 . 9 1 1 A 65 65 VAL N N 65 121.600 122.349 -0.749 1
1 824 . 9 1 1 A 66 66 ASP H H 66 8.210 8.668 -0.458 1
1 825 . 9 1 1 A 66 66 ASP HA H 66 5.320 5.156 0.164 1
1 828 . 9 1 1 A 66 66 ASP C C 66 174.800 175.202 -0.402 1
1 829 . 9 1 1 A 66 66 ASP CA C 66 51.700 53.715 -2.015 1
1 830 . 9 1 1 A 66 66 ASP CB C 66 43.200 41.912 1.288 1
1 831 . 9 1 1 A 66 66 ASP N N 66 123.100 127.754 -4.654 1
1 832 . 9 1 1 A 67 67 ILE H H 67 8.540 9.120 -0.580 1
1 833 . 9 1 1 A 67 67 ILE HA H 67 4.630 4.476 0.154 1
1 843 . 9 1 1 A 67 67 ILE C C 67 175.600 175.668 -0.068 1
1 844 . 9 1 1 A 67 67 ILE CA C 67 56.900 60.503 -3.603 1
1 845 . 9 1 1 A 67 67 ILE CB C 67 35.300 36.885 -1.585 1
1 849 . 9 1 1 A 67 67 ILE N N 67 119.200 125.435 -6.235 1
1 850 . 9 1 1 A 68 68 ILE H H 68 9.420 9.175 0.245 1
1 851 . 9 1 1 A 68 68 ILE HA H 68 4.980 5.457 -0.477 1
1 861 . 9 1 1 A 68 68 ILE C C 68 175.000 174.734 0.266 1
1 862 . 9 1 1 A 68 68 ILE CA C 68 58.600 59.422 -0.822 1
1 863 . 9 1 1 A 68 68 ILE CB C 68 40.900 40.400 0.500 1
1 867 . 9 1 1 A 68 68 ILE N N 68 125.000 123.598 1.402 1
1 868 . 9 1 1 A 69 69 CYS H H 69 8.870 9.018 -0.148 1
1 869 . 9 1 1 A 69 69 CYS HA H 69 4.610 4.513 0.097 1
1 872 . 9 1 1 A 69 69 CYS C C 69 176.200 175.431 0.769 1
1 873 . 9 1 1 A 69 69 CYS CA C 69 58.900 59.145 -0.245 1
1 874 . 9 1 1 A 69 69 CYS CB C 69 27.100 28.328 -1.228 1
1 875 . 9 1 1 A 69 69 CYS N N 69 122.300 124.640 -2.340 1
1 876 . 9 1 1 A 70 70 THR H H 70 8.270 8.329 -0.059 1
1 877 . 9 1 1 A 70 70 THR HA H 70 4.710 4.484 0.226 1
1 882 . 9 1 1 A 70 70 THR C C 70 173.600 173.856 -0.256 1
1 883 . 9 1 1 A 70 70 THR CA C 70 61.500 62.375 -0.875 1
1 884 . 9 1 1 A 70 70 THR CB C 70 68.100 70.252 -2.152 1
1 886 . 9 1 1 A 70 70 THR N N 70 116.700 119.981 -3.281 1
1 887 . 9 1 1 A 71 71 LYS H H 71 7.370 7.054 0.316 1
1 888 . 9 1 1 A 71 71 LYS HA H 71 4.520 4.702 -0.182 1
1 897 . 9 1 1 A 71 71 LYS CA C 71 55.100 54.998 0.102 1
1 898 . 9 1 1 A 71 71 LYS CB C 71 37.800 34.158 3.642 1
1 902 . 9 1 1 A 71 71 LYS N N 71 120.900 122.478 -1.578 1
1 903 . 9 1 1 A 72 72 ASN H H 72 8.580 8.618 -0.038 1
1 904 . 9 1 1 A 72 72 ASN HA H 72 4.620 5.372 -0.752 1
1 909 . 9 1 1 A 72 72 ASN C C 72 173.500 174.598 -1.098 1
1 910 . 9 1 1 A 72 72 ASN CA C 72 52.200 53.040 -0.840 1
1 911 . 9 1 1 A 72 72 ASN CB C 72 38.500 39.453 -0.953 1
1 912 . 9 1 1 A 72 72 ASN N N 72 122.700 124.187 -1.487 1
1 914 . 9 1 1 A 73 73 LEU H H 73 8.100 9.117 -1.017 1
1 915 . 9 1 1 A 73 73 LEU HA H 73 4.680 4.985 -0.305 1
1 925 . 9 1 1 A 73 73 LEU CA C 73 51.000 51.490 -0.490 1
1 926 . 9 1 1 A 73 73 LEU CB C 73 42.500 42.579 -0.079 1
1 930 . 9 1 1 A 73 73 LEU N N 73 125.100 126.001 -0.901 1
1 931 . 9 1 1 A 74 74 PRO HA H 74 4.670 4.768 -0.098 1
1 938 . 9 1 1 A 74 74 PRO C C 74 176.500 175.409 1.091 1
1 939 . 9 1 1 A 74 74 PRO CA C 74 61.800 62.324 -0.524 1
1 940 . 9 1 1 A 74 74 PRO CB C 74 32.800 32.918 -0.118 1
1 943 . 9 1 1 A 75 75 LYS H H 75 8.280 8.521 -0.241 1
1 944 . 9 1 1 A 75 75 LYS HA H 75 4.110 4.762 -0.652 1
1 953 . 9 1 1 A 75 75 LYS CA C 75 56.500 54.658 1.842 1
1 954 . 9 1 1 A 75 75 LYS CB C 75 33.300 35.921 -2.621 1
1 958 . 9 1 1 A 75 75 LYS N N 75 117.000 120.375 -3.375 1
1 959 . 9 1 1 A 76 76 ASP H H 76 8.570 8.795 -0.225 1
1 960 . 9 1 1 A 76 76 ASP HA H 76 4.530 4.854 -0.324 1
1 963 . 9 1 1 A 76 76 ASP C C 76 176.300 175.438 0.862 1
1 964 . 9 1 1 A 76 76 ASP CA C 76 55.000 51.908 3.092 1
1 965 . 9 1 1 A 76 76 ASP CB C 76 41.100 43.315 -2.215 1
1 966 . 9 1 1 A 76 76 ASP N N 76 122.700 122.269 0.431 1
1 967 . 9 1 1 A 77 77 SER H H 77 8.330 8.586 -0.256 1
1 968 . 9 1 1 A 77 77 SER HA H 77 4.410 4.040 0.370 1
1 971 . 9 1 1 A 77 77 SER C C 77 174.300 173.852 0.448 1
1 972 . 9 1 1 A 77 77 SER CA C 77 58.000 59.681 -1.681 1
1 973 . 9 1 1 A 77 77 SER CB C 77 63.900 61.225 2.675 1
1 974 . 9 1 1 A 77 77 SER N N 77 116.100 113.650 2.450 1
1 975 . 9 1 1 A 78 78 LEU H H 78 8.350 7.827 0.523 1
1 976 . 9 1 1 A 78 78 LEU HA H 78 4.280 4.243 0.037 1
1 986 . 9 1 1 A 78 78 LEU C C 78 177.200 177.389 -0.189 1
1 987 . 9 1 1 A 78 78 LEU CA C 78 55.200 54.411 0.789 1
1 988 . 9 1 1 A 78 78 LEU CB C 78 42.100 41.978 0.122 1
1 992 . 9 1 1 A 78 78 LEU N N 78 124.300 122.041 2.259 1
1 993 . 9 1 1 A 79 79 GLU H H 79 8.300 8.706 -0.406 1
1 994 . 9 1 1 A 79 79 GLU CA C 79 56.400 56.502 -0.102 1
1 995 . 9 1 1 A 79 79 GLU CB C 79 30.200 29.205 0.995 1
1 1 . 10 1 1 A 2 2 HIS HA H 2 4.640 4.236 0.404 1
1 4 . 10 1 1 A 2 2 HIS C C 2 173.600 174.252 -0.652 1
1 5 . 10 1 1 A 2 2 HIS CA C 2 56.500 56.109 0.391 1
1 6 . 10 1 1 A 2 2 HIS CB C 2 31.000 28.076 2.924 1
1 7 . 10 1 1 A 3 3 LYS H H 3 8.160 8.527 -0.367 1
1 8 . 10 1 1 A 3 3 LYS HA H 3 4.660 4.729 -0.069 1
1 17 . 10 1 1 A 3 3 LYS C C 3 174.400 174.538 -0.138 1
1 18 . 10 1 1 A 3 3 LYS CA C 3 54.800 55.213 -0.413 1
1 19 . 10 1 1 A 3 3 LYS CB C 3 35.800 34.246 1.554 1
1 23 . 10 1 1 A 3 3 LYS N N 3 121.900 121.692 0.208 1
1 24 . 10 1 1 A 4 4 ASP H H 4 8.470 9.599 -1.129 1
1 25 . 10 1 1 A 4 4 ASP HA H 4 4.900 5.393 -0.493 1
1 28 . 10 1 1 A 4 4 ASP C C 4 176.900 175.405 1.495 1
1 29 . 10 1 1 A 4 4 ASP CA C 4 52.700 52.632 0.068 1
1 30 . 10 1 1 A 4 4 ASP CB C 4 44.100 44.637 -0.537 1
1 31 . 10 1 1 A 4 4 ASP N N 4 117.900 124.089 -6.189 1
1 32 . 10 1 1 A 5 5 ILE H H 5 9.570 8.767 0.803 1
1 33 . 10 1 1 A 5 5 ILE HA H 5 3.640 4.135 -0.495 1
1 43 . 10 1 1 A 5 5 ILE C C 5 174.800 175.578 -0.778 1
1 44 . 10 1 1 A 5 5 ILE CA C 5 60.900 62.305 -1.405 1
1 45 . 10 1 1 A 5 5 ILE CB C 5 37.000 37.969 -0.969 1
1 49 . 10 1 1 A 5 5 ILE N N 5 124.400 125.576 -1.176 1
1 50 . 10 1 1 A 6 6 PHE H H 6 7.790 9.022 -1.232 1
1 51 . 10 1 1 A 6 6 PHE HA H 6 3.160 5.095 -1.935 1
1 58 . 10 1 1 A 6 6 PHE C C 6 173.500 173.909 -0.409 1
1 59 . 10 1 1 A 6 6 PHE CA C 6 56.900 56.055 0.845 1
1 60 . 10 1 1 A 6 6 PHE CB C 6 40.100 40.765 -0.665 1
1 65 . 10 1 1 A 6 6 PHE N N 6 130.200 128.217 1.983 1
1 66 . 10 1 1 A 7 7 THR H H 7 6.790 8.739 -1.949 1
1 67 . 10 1 1 A 7 7 THR HA H 7 4.530 5.024 -0.494 1
1 72 . 10 1 1 A 7 7 THR C C 7 172.300 172.855 -0.555 1
1 73 . 10 1 1 A 7 7 THR CA C 7 59.200 60.862 -1.662 1
1 74 . 10 1 1 A 7 7 THR CB C 7 71.000 71.253 -0.253 1
1 76 . 10 1 1 A 7 7 THR N N 7 117.900 123.048 -5.148 1
1 77 . 10 1 1 A 8 8 SER H H 8 7.600 8.562 -0.962 1
1 78 . 10 1 1 A 8 8 SER HA H 8 4.180 4.734 -0.554 1
1 81 . 10 1 1 A 8 8 SER C C 8 175.300 172.124 3.176 1
1 82 . 10 1 1 A 8 8 SER CA C 8 55.800 57.332 -1.532 1
1 83 . 10 1 1 A 8 8 SER CB C 8 64.000 67.066 -3.066 1
1 84 . 10 1 1 A 8 8 SER N N 8 113.400 116.871 -3.471 1
1 85 . 10 1 1 A 9 9 VAL H H 9 8.880 8.566 0.314 1
1 86 . 10 1 1 A 9 9 VAL HA H 9 5.220 4.989 0.231 1
1 94 . 10 1 1 A 9 9 VAL C C 9 174.000 174.031 -0.031 1
1 95 . 10 1 1 A 9 9 VAL CA C 9 59.100 59.826 -0.726 1
1 96 . 10 1 1 A 9 9 VAL CB C 9 36.500 34.296 2.204 1
1 99 . 10 1 1 A 9 9 VAL N N 9 114.700 117.665 -2.965 1
1 100 . 10 1 1 A 10 10 VAL H H 10 8.510 9.107 -0.597 1
1 101 . 10 1 1 A 10 10 VAL HA H 10 4.470 4.761 -0.291 1
1 109 . 10 1 1 A 10 10 VAL C C 10 173.700 175.133 -1.433 1
1 110 . 10 1 1 A 10 10 VAL CA C 10 59.400 59.489 -0.089 1
1 111 . 10 1 1 A 10 10 VAL CB C 10 36.000 34.336 1.664 1
1 114 . 10 1 1 A 10 10 VAL N N 10 117.100 126.059 -8.959 1
1 115 . 10 1 1 A 11 11 ARG H H 11 8.500 8.189 0.311 1
1 116 . 10 1 1 A 11 11 ARG HA H 11 4.460 4.429 0.031 1
1 123 . 10 1 1 A 11 11 ARG C C 11 174.500 175.111 -0.611 1
1 124 . 10 1 1 A 11 11 ARG CA C 11 57.400 56.081 1.319 1
1 125 . 10 1 1 A 11 11 ARG CB C 11 31.000 30.357 0.643 1
1 128 . 10 1 1 A 11 11 ARG N N 11 124.800 125.903 -1.103 1
1 129 . 10 1 1 A 12 12 VAL H H 12 7.650 8.366 -0.716 1
1 130 . 10 1 1 A 12 12 VAL HA H 12 4.970 4.950 0.020 1
1 138 . 10 1 1 A 12 12 VAL C C 12 176.700 174.196 2.504 1
1 139 . 10 1 1 A 12 12 VAL CA C 12 59.400 59.923 -0.523 1
1 140 . 10 1 1 A 12 12 VAL CB C 12 34.400 34.188 0.212 1
1 143 . 10 1 1 A 12 12 VAL N N 12 120.900 123.786 -2.886 1
1 144 . 10 1 1 A 13 13 ARG H H 13 9.020 8.851 0.169 1
1 145 . 10 1 1 A 13 13 ARG HA H 13 4.700 4.904 -0.204 1
1 152 . 10 1 1 A 13 13 ARG C C 13 176.000 175.445 0.555 1
1 153 . 10 1 1 A 13 13 ARG CA C 13 54.600 54.875 -0.275 1
1 154 . 10 1 1 A 13 13 ARG CB C 13 32.900 33.215 -0.315 1
1 157 . 10 1 1 A 13 13 ARG N N 13 127.500 126.715 0.785 1
1 158 . 10 1 1 A 14 14 GLY H H 14 8.640 8.478 0.162 1
1 159 . 10 1 1 A 14 14 GLY HA2 H 14 3.680 4.150 -0.470 1
1 160 . 10 1 1 A 14 14 GLY HA3 H 14 4.190 4.155 0.035 1
1 161 . 10 1 1 A 14 14 GLY C C 14 173.700 174.917 -1.217 1
1 162 . 10 1 1 A 14 14 GLY CA C 14 45.600 43.984 1.616 1
1 163 . 10 1 1 A 14 14 GLY N N 14 108.800 108.967 -0.167 1
1 164 . 10 1 1 A 15 15 SER H H 15 8.220 8.532 -0.312 1
1 165 . 10 1 1 A 15 15 SER HA H 15 5.020 4.589 0.431 1
1 168 . 10 1 1 A 15 15 SER C C 15 175.400 174.036 1.364 1
1 169 . 10 1 1 A 15 15 SER CA C 15 55.300 58.383 -3.083 1
1 170 . 10 1 1 A 15 15 SER CB C 15 64.900 63.450 1.450 1
1 171 . 10 1 1 A 15 15 SER N N 15 113.200 119.621 -6.421 1
1 172 . 10 1 1 A 16 16 LYS H H 16 9.930 7.530 2.400 1
1 173 . 10 1 1 A 16 16 LYS HA H 16 4.190 4.590 -0.400 1
1 182 . 10 1 1 A 16 16 LYS C C 16 176.500 175.620 0.880 1
1 183 . 10 1 1 A 16 16 LYS CA C 16 57.300 55.686 1.614 1
1 184 . 10 1 1 A 16 16 LYS CB C 16 32.300 33.676 -1.376 1
1 188 . 10 1 1 A 16 16 LYS N N 16 129.200 120.018 9.182 1
1 189 . 10 1 1 A 17 17 LYS H H 17 7.960 8.566 -0.606 1
1 190 . 10 1 1 A 17 17 LYS HA H 17 4.030 4.672 -0.642 1
1 199 . 10 1 1 A 17 17 LYS C C 17 175.600 174.544 1.056 1
1 200 . 10 1 1 A 17 17 LYS CA C 17 56.900 55.153 1.747 1
1 201 . 10 1 1 A 17 17 LYS CB C 17 34.700 32.962 1.738 1
1 205 . 10 1 1 A 17 17 LYS N N 17 118.500 119.646 -1.146 1
1 206 . 10 1 1 A 18 18 TYR H H 18 7.780 8.545 -0.765 1
1 207 . 10 1 1 A 18 18 TYR HA H 18 4.760 5.063 -0.303 1
1 214 . 10 1 1 A 18 18 TYR C C 18 174.000 175.386 -1.386 1
1 215 . 10 1 1 A 18 18 TYR CA C 18 56.800 56.648 0.152 1
1 216 . 10 1 1 A 18 18 TYR CB C 18 41.100 43.678 -2.578 1
1 221 . 10 1 1 A 18 18 TYR N N 18 117.100 121.549 -4.449 1
1 222 . 10 1 1 A 19 19 ASN H H 19 8.890 9.388 -0.498 1
1 223 . 10 1 1 A 19 19 ASN HA H 19 4.960 4.969 -0.009 1
1 228 . 10 1 1 A 19 19 ASN C C 19 176.100 174.792 1.308 1
1 229 . 10 1 1 A 19 19 ASN CA C 19 53.600 54.120 -0.520 1
1 230 . 10 1 1 A 19 19 ASN CB C 19 40.300 41.398 -1.098 1
1 231 . 10 1 1 A 19 19 ASN N N 19 116.600 120.146 -3.546 1
1 233 . 10 1 1 A 20 20 VAL H H 20 7.730 7.718 0.012 1
1 234 . 10 1 1 A 20 20 VAL HA H 20 5.250 4.874 0.376 1
1 242 . 10 1 1 A 20 20 VAL C C 20 173.800 173.777 0.023 1
1 243 . 10 1 1 A 20 20 VAL CA C 20 59.400 59.288 0.112 1
1 244 . 10 1 1 A 20 20 VAL CB C 20 37.600 35.638 1.962 1
1 247 . 10 1 1 A 20 20 VAL N N 20 113.900 116.490 -2.590 1
1 248 . 10 1 1 A 21 21 VAL H H 21 8.890 8.990 -0.100 1
1 249 . 10 1 1 A 21 21 VAL HA H 21 4.840 4.643 0.197 1
1 257 . 10 1 1 A 21 21 VAL CA C 21 56.800 57.476 -0.676 1
1 258 . 10 1 1 A 21 21 VAL CB C 21 36.000 35.164 0.836 1
1 261 . 10 1 1 A 21 21 VAL N N 21 118.500 121.830 -3.330 1
1 262 . 10 1 1 A 22 22 PRO HA H 22 4.940 4.823 0.117 1
1 269 . 10 1 1 A 22 22 PRO C C 22 175.600 176.434 -0.834 1
1 270 . 10 1 1 A 22 22 PRO CA C 22 62.700 62.688 0.012 1
1 271 . 10 1 1 A 22 22 PRO CB C 22 31.800 31.771 0.029 1
1 274 . 10 1 1 A 23 23 VAL H H 23 8.060 8.733 -0.673 1
1 275 . 10 1 1 A 23 23 VAL HA H 23 5.390 5.023 0.367 1
1 283 . 10 1 1 A 23 23 VAL C C 23 175.400 174.181 1.219 1
1 284 . 10 1 1 A 23 23 VAL CA C 23 57.800 59.177 -1.377 1
1 285 . 10 1 1 A 23 23 VAL CB C 23 36.300 35.754 0.546 1
1 288 . 10 1 1 A 23 23 VAL N N 23 110.900 116.657 -5.757 1
1 289 . 10 1 1 A 24 24 LYS H H 24 8.960 9.289 -0.329 1
1 290 . 10 1 1 A 24 24 LYS HA H 24 5.600 5.006 0.594 1
1 299 . 10 1 1 A 24 24 LYS C C 24 175.600 174.594 1.006 1
1 300 . 10 1 1 A 24 24 LYS CA C 24 54.200 54.081 0.119 1
1 301 . 10 1 1 A 24 24 LYS CB C 24 37.000 36.342 0.658 1
1 305 . 10 1 1 A 24 24 LYS N N 24 117.900 121.549 -3.649 1
1 306 . 10 1 1 A 25 25 SER H H 25 8.950 8.355 0.595 1
1 307 . 10 1 1 A 25 25 SER HA H 25 5.190 5.135 0.055 1
1 310 . 10 1 1 A 25 25 SER C C 25 173.800 175.845 -2.045 1
1 311 . 10 1 1 A 25 25 SER CA C 25 57.700 56.315 1.385 1
1 312 . 10 1 1 A 25 25 SER CB C 25 65.100 64.968 0.132 1
1 313 . 10 1 1 A 25 25 SER N N 25 114.600 113.644 0.956 1
1 314 . 10 1 1 A 26 26 ASN H H 26 9.020 8.606 0.414 1
1 315 . 10 1 1 A 26 26 ASN HA H 26 4.370 4.623 -0.253 1
1 320 . 10 1 1 A 26 26 ASN C C 26 173.500 175.160 -1.660 1
1 321 . 10 1 1 A 26 26 ASN CA C 26 53.700 54.596 -0.896 1
1 322 . 10 1 1 A 26 26 ASN CB C 26 37.100 38.434 -1.334 1
1 323 . 10 1 1 A 26 26 ASN N N 26 118.300 120.096 -1.796 1
1 325 . 10 1 1 A 27 27 LYS H H 27 7.400 7.860 -0.460 1
1 326 . 10 1 1 A 27 27 LYS HA H 27 4.780 4.747 0.033 1
1 335 . 10 1 1 A 27 27 LYS CA C 27 53.500 52.709 0.791 1
1 336 . 10 1 1 A 27 27 LYS CB C 27 34.100 34.012 0.088 1
1 340 . 10 1 1 A 27 27 LYS N N 27 116.600 119.560 -2.960 1
1 341 . 10 1 1 A 28 28 PRO HA H 28 4.040 4.519 -0.479 1
1 348 . 10 1 1 A 28 28 PRO C C 28 174.500 176.596 -2.096 1
1 349 . 10 1 1 A 28 28 PRO CA C 28 63.200 63.307 -0.107 1
1 350 . 10 1 1 A 28 28 PRO CB C 28 32.500 32.048 0.452 1
1 353 . 10 1 1 A 29 29 VAL H H 29 8.860 8.767 0.093 1
1 354 . 10 1 1 A 29 29 VAL HA H 29 4.420 4.286 0.134 1
1 362 . 10 1 1 A 29 29 VAL C C 29 174.800 175.845 -1.045 1
1 363 . 10 1 1 A 29 29 VAL CA C 29 60.300 61.595 -1.295 1
1 364 . 10 1 1 A 29 29 VAL CB C 29 36.400 32.676 3.724 1
1 367 . 10 1 1 A 29 29 VAL N N 29 119.800 123.899 -4.099 1
1 368 . 10 1 1 A 30 30 GLU H H 30 9.550 8.586 0.964 1
1 369 . 10 1 1 A 30 30 GLU HA H 30 4.260 4.637 -0.377 1
1 374 . 10 1 1 A 30 30 GLU C C 30 177.800 177.249 0.551 1
1 375 . 10 1 1 A 30 30 GLU CA C 30 58.000 56.721 1.279 1
1 376 . 10 1 1 A 30 30 GLU CB C 30 29.700 30.249 -0.549 1
1 378 . 10 1 1 A 30 30 GLU N N 30 128.900 126.985 1.915 1
1 379 . 10 1 1 A 31 31 ILE H H 31 7.910 8.571 -0.661 1
1 380 . 10 1 1 A 31 31 ILE HA H 31 2.120 4.142 -2.022 1
1 390 . 10 1 1 A 31 31 ILE C C 31 178.000 176.436 1.564 1
1 391 . 10 1 1 A 31 31 ILE CA C 31 63.500 61.444 2.056 1
1 392 . 10 1 1 A 31 31 ILE CB C 31 37.200 36.965 0.235 1
1 396 . 10 1 1 A 31 31 ILE N N 31 122.500 122.686 -0.186 1
1 397 . 10 1 1 A 32 32 SER H H 32 7.940 8.699 -0.759 1
1 398 . 10 1 1 A 32 32 SER HA H 32 4.070 4.728 -0.658 1
1 401 . 10 1 1 A 32 32 SER C C 32 175.800 175.330 0.470 1
1 402 . 10 1 1 A 32 32 SER CA C 32 60.200 58.017 2.183 1
1 403 . 10 1 1 A 32 32 SER CB C 32 62.100 65.107 -3.007 1
1 404 . 10 1 1 A 32 32 SER N N 32 115.300 116.766 -1.466 1
1 405 . 10 1 1 A 33 33 LYS H H 33 7.640 7.744 -0.104 1
1 406 . 10 1 1 A 33 33 LYS HA H 33 4.400 4.275 0.125 1
1 415 . 10 1 1 A 33 33 LYS C C 33 176.600 176.747 -0.147 1
1 416 . 10 1 1 A 33 33 LYS CA C 33 56.200 56.008 0.192 1
1 417 . 10 1 1 A 33 33 LYS CB C 33 32.700 32.291 0.409 1
1 421 . 10 1 1 A 33 33 LYS N N 33 119.800 118.724 1.076 1
1 422 . 10 1 1 A 34 34 TRP H H 34 7.860 7.638 0.222 1
1 423 . 10 1 1 A 34 34 TRP HA H 34 3.870 3.746 0.124 1
1 426 . 10 1 1 A 34 34 TRP C C 34 178.600 178.278 0.322 1
1 427 . 10 1 1 A 34 34 TRP CA C 34 60.200 60.589 -0.389 1
1 428 . 10 1 1 A 34 34 TRP CB C 34 28.500 29.426 -0.926 1
1 429 . 10 1 1 A 34 34 TRP N N 34 120.000 121.744 -1.744 1
1 430 . 10 1 1 A 35 35 ILE H H 35 8.200 8.261 -0.061 1
1 431 . 10 1 1 A 35 35 ILE HA H 35 3.990 3.844 0.146 1
1 441 . 10 1 1 A 35 35 ILE C C 35 177.900 177.756 0.144 1
1 442 . 10 1 1 A 35 35 ILE CA C 35 64.300 64.677 -0.377 1
1 443 . 10 1 1 A 35 35 ILE CB C 35 37.200 36.906 0.294 1
1 447 . 10 1 1 A 35 35 ILE N N 35 119.500 119.852 -0.352 1
1 448 . 10 1 1 A 36 36 ASP H H 36 7.680 8.163 -0.483 1
1 449 . 10 1 1 A 36 36 ASP HA H 36 4.490 4.364 0.126 1
1 452 . 10 1 1 A 36 36 ASP C C 36 179.200 178.879 0.321 1
1 453 . 10 1 1 A 36 36 ASP CA C 36 57.500 57.264 0.236 1
1 454 . 10 1 1 A 36 36 ASP CB C 36 40.400 40.669 -0.269 1
1 455 . 10 1 1 A 36 36 ASP N N 36 122.000 120.976 1.024 1
1 456 . 10 1 1 A 37 37 PHE H H 37 8.450 8.542 -0.092 1
1 457 . 10 1 1 A 37 37 PHE HA H 37 4.080 4.176 -0.096 1
1 465 . 10 1 1 A 37 37 PHE C C 37 178.300 178.711 -0.411 1
1 466 . 10 1 1 A 37 37 PHE CA C 37 58.600 60.170 -1.570 1
1 467 . 10 1 1 A 37 37 PHE CB C 37 37.000 37.978 -0.978 1
1 473 . 10 1 1 A 37 37 PHE N N 37 119.800 118.973 0.827 1
1 474 . 10 1 1 A 38 38 SER H H 38 8.580 8.035 0.545 1
1 475 . 10 1 1 A 38 38 SER HA H 38 4.250 4.387 -0.137 1
1 478 . 10 1 1 A 38 38 SER C C 38 176.800 177.366 -0.566 1
1 479 . 10 1 1 A 38 38 SER CA C 38 62.700 61.347 1.353 1
1 480 . 10 1 1 A 38 38 SER CB C 38 62.700 62.748 -0.048 1
1 481 . 10 1 1 A 38 38 SER N N 38 115.800 115.435 0.365 1
1 482 . 10 1 1 A 39 39 ASN H H 39 8.190 8.066 0.124 1
1 483 . 10 1 1 A 39 39 ASN HA H 39 4.540 4.464 0.076 1
1 488 . 10 1 1 A 39 39 ASN C C 39 178.500 177.940 0.560 1
1 489 . 10 1 1 A 39 39 ASN CA C 39 56.200 56.342 -0.142 1
1 490 . 10 1 1 A 39 39 ASN CB C 39 37.900 38.675 -0.775 1
1 491 . 10 1 1 A 39 39 ASN N N 39 121.300 120.936 0.364 1
1 493 . 10 1 1 A 40 40 VAL H H 40 7.840 7.962 -0.122 1
1 494 . 10 1 1 A 40 40 VAL HA H 40 3.650 3.575 0.075 1
1 502 . 10 1 1 A 40 40 VAL C C 40 179.000 178.086 0.914 1
1 503 . 10 1 1 A 40 40 VAL CA C 40 66.600 66.626 -0.026 1
1 504 . 10 1 1 A 40 40 VAL CB C 40 32.100 31.483 0.617 1
1 507 . 10 1 1 A 40 40 VAL N N 40 121.800 119.642 2.158 1
1 508 . 10 1 1 A 41 41 LEU H H 41 8.210 8.341 -0.131 1
1 509 . 10 1 1 A 41 41 LEU HA H 41 3.840 4.010 -0.170 1
1 519 . 10 1 1 A 41 41 LEU C C 41 178.800 178.658 0.142 1
1 520 . 10 1 1 A 41 41 LEU CA C 41 57.400 57.509 -0.109 1
1 521 . 10 1 1 A 41 41 LEU CB C 41 41.200 40.875 0.325 1
1 525 . 10 1 1 A 41 41 LEU N N 41 117.700 119.190 -1.490 1
1 526 . 10 1 1 A 42 42 SER H H 42 7.980 7.847 0.133 1
1 527 . 10 1 1 A 42 42 SER HA H 42 4.260 4.275 -0.015 1
1 530 . 10 1 1 A 42 42 SER C C 42 174.900 174.898 0.002 1
1 531 . 10 1 1 A 42 42 SER CA C 42 61.200 60.409 0.791 1
1 532 . 10 1 1 A 42 42 SER CB C 42 63.100 63.094 0.006 1
1 533 . 10 1 1 A 42 42 SER N N 42 113.200 115.266 -2.066 1
1 534 . 10 1 1 A 43 43 ARG H H 43 7.100 7.617 -0.517 1
1 535 . 10 1 1 A 43 43 ARG HA H 43 4.500 4.531 -0.031 1
1 542 . 10 1 1 A 43 43 ARG C C 43 175.800 174.990 0.810 1
1 543 . 10 1 1 A 43 43 ARG CA C 43 55.600 55.642 -0.042 1
1 544 . 10 1 1 A 43 43 ARG CB C 43 30.800 31.206 -0.406 1
1 547 . 10 1 1 A 43 43 ARG N N 43 118.400 117.893 0.507 1
1 548 . 10 1 1 A 44 44 LEU H H 44 7.610 7.411 0.199 1
1 549 . 10 1 1 A 44 44 LEU HA H 44 4.590 4.569 0.021 1
1 559 . 10 1 1 A 44 44 LEU C C 44 175.300 175.163 0.137 1
1 560 . 10 1 1 A 44 44 LEU CA C 44 53.900 53.523 0.377 1
1 561 . 10 1 1 A 44 44 LEU CB C 44 44.100 42.846 1.254 1
1 565 . 10 1 1 A 44 44 LEU N N 44 120.400 121.585 -1.185 1
1 566 . 10 1 1 A 45 45 TYR H H 45 7.630 9.147 -1.517 1
1 567 . 10 1 1 A 45 45 TYR HA H 45 5.180 5.081 0.099 1
1 574 . 10 1 1 A 45 45 TYR C C 45 174.600 175.752 -1.152 1
1 575 . 10 1 1 A 45 45 TYR CA C 45 56.300 56.474 -0.174 1
1 576 . 10 1 1 A 45 45 TYR CB C 45 41.400 39.632 1.768 1
1 581 . 10 1 1 A 45 45 TYR N N 45 115.300 124.164 -8.864 1
1 582 . 10 1 1 A 46 46 VAL H H 46 8.770 8.626 0.144 1
1 583 . 10 1 1 A 46 46 VAL HA H 46 4.540 4.781 -0.241 1
1 591 . 10 1 1 A 46 46 VAL C C 46 174.600 175.611 -1.011 1
1 592 . 10 1 1 A 46 46 VAL CA C 46 59.600 60.620 -1.020 1
1 593 . 10 1 1 A 46 46 VAL CB C 46 34.700 33.870 0.830 1
1 596 . 10 1 1 A 46 46 VAL N N 46 115.400 119.590 -4.190 1
1 597 . 10 1 1 A 47 47 GLY H H 47 8.280 8.454 -0.174 1
1 598 . 10 1 1 A 47 47 GLY HA2 H 47 3.610 4.303 -0.693 1
1 599 . 10 1 1 A 47 47 GLY HA3 H 47 4.970 4.304 0.666 1
1 600 . 10 1 1 A 47 47 GLY C C 47 173.100 172.962 0.138 1
1 601 . 10 1 1 A 47 47 GLY CA C 47 43.600 45.969 -2.369 1
1 602 . 10 1 1 A 47 47 GLY N N 47 109.900 109.287 0.613 1
1 603 . 10 1 1 A 48 48 VAL H H 48 7.630 8.589 -0.959 1
1 604 . 10 1 1 A 48 48 VAL HA H 48 4.320 3.831 0.489 1
1 612 . 10 1 1 A 48 48 VAL CA C 48 58.700 62.674 -3.974 1
1 613 . 10 1 1 A 48 48 VAL CB C 48 32.100 30.724 1.376 1
1 616 . 10 1 1 A 48 48 VAL N N 48 109.900 118.126 -8.226 1
1 617 . 10 1 1 A 49 49 PRO HA H 49 4.800 4.481 0.319 1
1 624 . 10 1 1 A 49 49 PRO C C 49 176.700 176.400 0.300 1
1 625 . 10 1 1 A 49 49 PRO CA C 49 62.300 62.937 -0.637 1
1 626 . 10 1 1 A 49 49 PRO CB C 49 35.400 31.800 3.600 1
1 629 . 10 1 1 A 50 50 THR H H 50 8.790 8.353 0.437 1
1 630 . 10 1 1 A 50 50 THR HA H 50 4.690 4.934 -0.244 1
1 635 . 10 1 1 A 50 50 THR C C 50 173.500 173.704 -0.204 1
1 636 . 10 1 1 A 50 50 THR CA C 50 60.800 60.026 0.774 1
1 637 . 10 1 1 A 50 50 THR CB C 50 70.800 70.284 0.516 1
1 639 . 10 1 1 A 50 50 THR N N 50 113.500 112.609 0.891 1
1 640 . 10 1 1 A 51 51 LYS H H 51 7.810 8.487 -0.677 1
1 641 . 10 1 1 A 51 51 LYS HA H 51 4.890 4.985 -0.095 1
1 650 . 10 1 1 A 51 51 LYS C C 51 175.900 176.237 -0.337 1
1 651 . 10 1 1 A 51 51 LYS CA C 51 54.100 54.245 -0.145 1
1 652 . 10 1 1 A 51 51 LYS CB C 51 35.300 36.613 -1.313 1
1 656 . 10 1 1 A 51 51 LYS N N 51 122.200 119.983 2.217 1
1 657 . 10 1 1 A 52 52 SER H H 52 8.410 8.663 -0.253 1
1 658 . 10 1 1 A 52 52 SER HA H 52 3.630 4.243 -0.613 1
1 661 . 10 1 1 A 52 52 SER C C 52 175.800 175.000 0.800 1
1 662 . 10 1 1 A 52 52 SER CA C 52 58.800 59.616 -0.816 1
1 663 . 10 1 1 A 52 52 SER CB C 52 62.600 62.735 -0.135 1
1 664 . 10 1 1 A 52 52 SER N N 52 118.900 115.267 3.633 1
1 665 . 10 1 1 A 53 53 GLY H H 53 9.070 8.859 0.211 1
1 666 . 10 1 1 A 53 53 GLY HA2 H 53 3.390 3.872 -0.482 1
1 667 . 10 1 1 A 53 53 GLY HA3 H 53 4.460 3.874 0.586 1
1 668 . 10 1 1 A 53 53 GLY C C 53 174.100 174.136 -0.036 1
1 669 . 10 1 1 A 53 53 GLY CA C 53 44.800 45.641 -0.841 1
1 670 . 10 1 1 A 53 53 GLY N N 53 115.600 113.240 2.360 1
1 671 . 10 1 1 A 54 54 ASN H H 54 7.870 7.693 0.177 1
1 672 . 10 1 1 A 54 54 ASN HA H 54 4.570 4.894 -0.324 1
1 677 . 10 1 1 A 54 54 ASN C C 54 175.500 174.307 1.193 1
1 678 . 10 1 1 A 54 54 ASN CA C 54 53.000 52.087 0.913 1
1 679 . 10 1 1 A 54 54 ASN CB C 54 38.600 39.401 -0.801 1
1 680 . 10 1 1 A 54 54 ASN N N 54 119.600 118.734 0.866 1
1 682 . 10 1 1 A 55 55 VAL H H 55 8.770 8.917 -0.147 1
1 683 . 10 1 1 A 55 55 VAL HA H 55 3.880 4.025 -0.145 1
1 691 . 10 1 1 A 55 55 VAL C C 55 176.200 175.216 0.984 1
1 692 . 10 1 1 A 55 55 VAL CA C 55 63.700 63.136 0.564 1
1 693 . 10 1 1 A 55 55 VAL CB C 55 31.600 31.100 0.500 1
1 696 . 10 1 1 A 55 55 VAL N N 55 123.900 123.445 0.455 1
1 697 . 10 1 1 A 56 56 VAL H H 56 9.050 8.779 0.271 1
1 698 . 10 1 1 A 56 56 VAL HA H 56 3.990 3.964 0.026 1
1 706 . 10 1 1 A 56 56 VAL C C 56 175.200 176.019 -0.819 1
1 707 . 10 1 1 A 56 56 VAL CA C 56 62.700 64.531 -1.831 1
1 708 . 10 1 1 A 56 56 VAL CB C 56 32.900 32.415 0.485 1
1 711 . 10 1 1 A 56 56 VAL N N 56 127.500 128.720 -1.220 1
1 712 . 10 1 1 A 57 57 CYS H H 57 7.250 7.666 -0.416 1
1 713 . 10 1 1 A 57 57 CYS HA H 57 4.370 4.728 -0.358 1
1 716 . 10 1 1 A 57 57 CYS C C 57 171.900 174.001 -2.101 1
1 717 . 10 1 1 A 57 57 CYS CA C 57 58.600 57.456 1.144 1
1 718 . 10 1 1 A 57 57 CYS CB C 57 28.600 28.481 0.119 1
1 719 . 10 1 1 A 57 57 CYS N N 57 117.600 118.064 -0.464 1
1 720 . 10 1 1 A 58 58 LYS H H 58 8.880 8.468 0.412 1
1 721 . 10 1 1 A 58 58 LYS HA H 58 4.220 4.250 -0.030 1
1 730 . 10 1 1 A 58 58 LYS C C 58 176.000 176.297 -0.297 1
1 731 . 10 1 1 A 58 58 LYS CA C 58 54.400 56.266 -1.866 1
1 732 . 10 1 1 A 58 58 LYS CB C 58 33.600 32.354 1.246 1
1 736 . 10 1 1 A 58 58 LYS N N 58 132.000 124.479 7.521 1
1 737 . 10 1 1 A 59 59 ASN H H 59 9.500 8.713 0.787 1
1 738 . 10 1 1 A 59 59 ASN HA H 59 4.040 4.305 -0.265 1
1 743 . 10 1 1 A 59 59 ASN C C 59 176.400 175.177 1.223 1
1 744 . 10 1 1 A 59 59 ASN CA C 59 53.200 53.847 -0.647 1
1 745 . 10 1 1 A 59 59 ASN CB C 59 35.900 36.931 -1.031 1
1 746 . 10 1 1 A 59 59 ASN N N 59 127.500 117.973 9.527 1
1 748 . 10 1 1 A 60 60 ILE H H 60 8.050 7.789 0.261 1
1 749 . 10 1 1 A 60 60 ILE HA H 60 3.680 3.852 -0.172 1
1 759 . 10 1 1 A 60 60 ILE C C 60 175.700 176.130 -0.430 1
1 760 . 10 1 1 A 60 60 ILE CA C 60 61.900 61.894 0.006 1
1 761 . 10 1 1 A 60 60 ILE CB C 60 38.300 37.687 0.613 1
1 765 . 10 1 1 A 60 60 ILE N N 60 120.200 122.784 -2.584 1
1 766 . 10 1 1 A 61 61 MET H H 61 9.590 8.813 0.777 1
1 767 . 10 1 1 A 61 61 MET HA H 61 3.920 4.257 -0.337 1
1 775 . 10 1 1 A 61 61 MET C C 61 174.300 174.715 -0.415 1
1 776 . 10 1 1 A 61 61 MET CA C 61 57.000 57.442 -0.442 1
1 777 . 10 1 1 A 61 61 MET CB C 61 31.300 32.444 -1.144 1
1 780 . 10 1 1 A 61 61 MET N N 61 124.400 128.891 -4.491 1
1 781 . 10 1 1 A 62 62 ASN H H 62 8.250 8.171 0.079 1
1 782 . 10 1 1 A 62 62 ASN HA H 62 4.400 4.917 -0.517 1
1 787 . 10 1 1 A 62 62 ASN C C 62 176.800 174.955 1.845 1
1 788 . 10 1 1 A 62 62 ASN CA C 62 54.400 53.208 1.192 1
1 789 . 10 1 1 A 62 62 ASN CB C 62 37.600 38.696 -1.096 1
1 790 . 10 1 1 A 62 62 ASN N N 62 111.900 117.112 -5.212 1
1 792 . 10 1 1 A 63 63 THR H H 63 7.480 9.249 -1.769 1
1 793 . 10 1 1 A 63 63 THR HA H 63 4.210 4.667 -0.457 1
1 798 . 10 1 1 A 63 63 THR C C 63 177.100 176.004 1.096 1
1 799 . 10 1 1 A 63 63 THR CA C 63 62.900 62.092 0.808 1
1 800 . 10 1 1 A 63 63 THR CB C 63 72.500 71.110 1.390 1
1 802 . 10 1 1 A 63 63 THR N N 63 105.900 115.770 -9.870 1
1 803 . 10 1 1 A 64 64 GLY H H 64 9.110 8.348 0.762 1
1 804 . 10 1 1 A 64 64 GLY HA2 H 64 3.580 3.955 -0.375 1
1 805 . 10 1 1 A 64 64 GLY HA3 H 64 4.090 3.965 0.125 1
1 806 . 10 1 1 A 64 64 GLY C C 64 173.200 174.341 -1.141 1
1 807 . 10 1 1 A 64 64 GLY CA C 64 45.300 45.363 -0.063 1
1 808 . 10 1 1 A 64 64 GLY N N 64 111.500 111.539 -0.039 1
1 809 . 10 1 1 A 65 65 VAL H H 65 7.580 7.759 -0.179 1
1 810 . 10 1 1 A 65 65 VAL HA H 65 4.060 4.172 -0.112 1
1 818 . 10 1 1 A 65 65 VAL C C 65 172.900 174.605 -1.705 1
1 819 . 10 1 1 A 65 65 VAL CA C 65 61.400 62.191 -0.791 1
1 820 . 10 1 1 A 65 65 VAL CB C 65 32.900 32.715 0.185 1
1 823 . 10 1 1 A 65 65 VAL N N 65 121.600 122.766 -1.166 1
1 824 . 10 1 1 A 66 66 ASP H H 66 8.210 9.050 -0.840 1
1 825 . 10 1 1 A 66 66 ASP HA H 66 5.320 4.970 0.350 1
1 828 . 10 1 1 A 66 66 ASP C C 66 174.800 175.199 -0.399 1
1 829 . 10 1 1 A 66 66 ASP CA C 66 51.700 53.654 -1.954 1
1 830 . 10 1 1 A 66 66 ASP CB C 66 43.200 41.793 1.407 1
1 831 . 10 1 1 A 66 66 ASP N N 66 123.100 127.856 -4.756 1
1 832 . 10 1 1 A 67 67 ILE H H 67 8.540 9.294 -0.754 1
1 833 . 10 1 1 A 67 67 ILE HA H 67 4.630 4.611 0.019 1
1 843 . 10 1 1 A 67 67 ILE C C 67 175.600 175.932 -0.332 1
1 844 . 10 1 1 A 67 67 ILE CA C 67 56.900 60.865 -3.965 1
1 845 . 10 1 1 A 67 67 ILE CB C 67 35.300 36.925 -1.625 1
1 849 . 10 1 1 A 67 67 ILE N N 67 119.200 125.223 -6.023 1
1 850 . 10 1 1 A 68 68 ILE H H 68 9.420 8.469 0.951 1
1 851 . 10 1 1 A 68 68 ILE HA H 68 4.980 5.224 -0.244 1
1 861 . 10 1 1 A 68 68 ILE C C 68 175.000 174.277 0.723 1
1 862 . 10 1 1 A 68 68 ILE CA C 68 58.600 59.239 -0.639 1
1 863 . 10 1 1 A 68 68 ILE CB C 68 40.900 39.529 1.371 1
1 867 . 10 1 1 A 68 68 ILE N N 68 125.000 124.203 0.797 1
1 868 . 10 1 1 A 69 69 CYS H H 69 8.870 9.044 -0.174 1
1 869 . 10 1 1 A 69 69 CYS HA H 69 4.610 5.035 -0.425 1
1 872 . 10 1 1 A 69 69 CYS C C 69 176.200 174.876 1.324 1
1 873 . 10 1 1 A 69 69 CYS CA C 69 58.900 57.390 1.510 1
1 874 . 10 1 1 A 69 69 CYS CB C 69 27.100 30.560 -3.460 1
1 875 . 10 1 1 A 69 69 CYS N N 69 122.300 123.274 -0.974 1
1 876 . 10 1 1 A 70 70 THR H H 70 8.270 8.746 -0.476 1
1 877 . 10 1 1 A 70 70 THR HA H 70 4.710 4.525 0.185 1
1 882 . 10 1 1 A 70 70 THR C C 70 173.600 173.829 -0.229 1
1 883 . 10 1 1 A 70 70 THR CA C 70 61.500 61.576 -0.076 1
1 884 . 10 1 1 A 70 70 THR CB C 70 68.100 69.488 -1.388 1
1 886 . 10 1 1 A 70 70 THR N N 70 116.700 119.146 -2.446 1
1 887 . 10 1 1 A 71 71 LYS H H 71 7.370 7.127 0.243 1
1 888 . 10 1 1 A 71 71 LYS HA H 71 4.520 4.700 -0.180 1
1 897 . 10 1 1 A 71 71 LYS CA C 71 55.100 55.090 0.010 1
1 898 . 10 1 1 A 71 71 LYS CB C 71 37.800 34.144 3.656 1
1 902 . 10 1 1 A 71 71 LYS N N 71 120.900 122.771 -1.871 1
1 903 . 10 1 1 A 72 72 ASN H H 72 8.580 8.739 -0.159 1
1 904 . 10 1 1 A 72 72 ASN HA H 72 4.620 5.000 -0.380 1
1 909 . 10 1 1 A 72 72 ASN C C 72 173.500 174.307 -0.807 1
1 910 . 10 1 1 A 72 72 ASN CA C 72 52.200 52.681 -0.481 1
1 911 . 10 1 1 A 72 72 ASN CB C 72 38.500 39.539 -1.039 1
1 912 . 10 1 1 A 72 72 ASN N N 72 122.700 123.619 -0.919 1
1 914 . 10 1 1 A 73 73 LEU H H 73 8.100 9.427 -1.327 1
1 915 . 10 1 1 A 73 73 LEU HA H 73 4.680 4.980 -0.300 1
1 925 . 10 1 1 A 73 73 LEU CA C 73 51.000 51.117 -0.117 1
1 926 . 10 1 1 A 73 73 LEU CB C 73 42.500 42.555 -0.055 1
1 930 . 10 1 1 A 73 73 LEU N N 73 125.100 126.499 -1.399 1
1 931 . 10 1 1 A 74 74 PRO HA H 74 4.670 4.807 -0.137 1
1 938 . 10 1 1 A 74 74 PRO C C 74 176.500 176.356 0.144 1
1 939 . 10 1 1 A 74 74 PRO CA C 74 61.800 61.995 -0.195 1
1 940 . 10 1 1 A 74 74 PRO CB C 74 32.800 32.864 -0.064 1
1 943 . 10 1 1 A 75 75 LYS H H 75 8.280 9.068 -0.788 1
1 944 . 10 1 1 A 75 75 LYS HA H 75 4.110 4.387 -0.277 1
1 953 . 10 1 1 A 75 75 LYS CA C 75 56.500 57.493 -0.993 1
1 954 . 10 1 1 A 75 75 LYS CB C 75 33.300 33.090 0.210 1
1 958 . 10 1 1 A 75 75 LYS N N 75 117.000 119.323 -2.323 1
1 959 . 10 1 1 A 76 76 ASP H H 76 8.570 7.782 0.788 1
1 960 . 10 1 1 A 76 76 ASP HA H 76 4.530 4.976 -0.446 1
1 963 . 10 1 1 A 76 76 ASP C C 76 176.300 176.086 0.214 1
1 964 . 10 1 1 A 76 76 ASP CA C 76 55.000 52.673 2.327 1
1 965 . 10 1 1 A 76 76 ASP CB C 76 41.100 44.354 -3.254 1
1 966 . 10 1 1 A 76 76 ASP N N 76 122.700 115.910 6.790 1
1 967 . 10 1 1 A 77 77 SER H H 77 8.330 8.926 -0.596 1
1 968 . 10 1 1 A 77 77 SER HA H 77 4.410 4.313 0.097 1
1 971 . 10 1 1 A 77 77 SER C C 77 174.300 173.530 0.770 1
1 972 . 10 1 1 A 77 77 SER CA C 77 58.000 60.705 -2.705 1
1 973 . 10 1 1 A 77 77 SER CB C 77 63.900 63.883 0.017 1
1 974 . 10 1 1 A 77 77 SER N N 77 116.100 116.678 -0.578 1
1 975 . 10 1 1 A 78 78 LEU H H 78 8.350 7.798 0.552 1
1 976 . 10 1 1 A 78 78 LEU HA H 78 4.280 4.800 -0.520 1
1 986 . 10 1 1 A 78 78 LEU C C 78 177.200 175.022 2.178 1
1 987 . 10 1 1 A 78 78 LEU CA C 78 55.200 54.032 1.168 1
1 988 . 10 1 1 A 78 78 LEU CB C 78 42.100 45.924 -3.824 1
1 992 . 10 1 1 A 78 78 LEU N N 78 124.300 120.379 3.921 1
1 993 . 10 1 1 A 79 79 GLU H H 79 8.300 8.607 -0.307 1
1 994 . 10 1 1 A 79 79 GLU CA C 79 56.400 55.655 0.745 1
1 995 . 10 1 1 A 79 79 GLU CB C 79 30.200 30.685 -0.485 1
1 1 . 11 1 1 A 2 2 HIS HA H 2 4.640 4.691 -0.051 1
1 4 . 11 1 1 A 2 2 HIS C C 2 173.600 174.295 -0.695 1
1 5 . 11 1 1 A 2 2 HIS CA C 2 56.500 57.082 -0.582 1
1 6 . 11 1 1 A 2 2 HIS CB C 2 31.000 32.229 -1.229 1
1 7 . 11 1 1 A 3 3 LYS H H 3 8.160 7.866 0.294 1
1 8 . 11 1 1 A 3 3 LYS HA H 3 4.660 4.964 -0.304 1
1 17 . 11 1 1 A 3 3 LYS C C 3 174.400 174.498 -0.098 1
1 18 . 11 1 1 A 3 3 LYS CA C 3 54.800 54.824 -0.024 1
1 19 . 11 1 1 A 3 3 LYS CB C 3 35.800 36.089 -0.289 1
1 23 . 11 1 1 A 3 3 LYS N N 3 121.900 116.442 5.458 1
1 24 . 11 1 1 A 4 4 ASP H H 4 8.470 8.899 -0.429 1
1 25 . 11 1 1 A 4 4 ASP HA H 4 4.900 5.211 -0.311 1
1 28 . 11 1 1 A 4 4 ASP C C 4 176.900 174.544 2.356 1
1 29 . 11 1 1 A 4 4 ASP CA C 4 52.700 52.885 -0.185 1
1 30 . 11 1 1 A 4 4 ASP CB C 4 44.100 44.733 -0.633 1
1 31 . 11 1 1 A 4 4 ASP N N 4 117.900 123.028 -5.128 1
1 32 . 11 1 1 A 5 5 ILE H H 5 9.570 8.673 0.897 1
1 33 . 11 1 1 A 5 5 ILE HA H 5 3.640 4.059 -0.419 1
1 43 . 11 1 1 A 5 5 ILE C C 5 174.800 175.965 -1.165 1
1 44 . 11 1 1 A 5 5 ILE CA C 5 60.900 62.265 -1.365 1
1 45 . 11 1 1 A 5 5 ILE CB C 5 37.000 37.166 -0.166 1
1 49 . 11 1 1 A 5 5 ILE N N 5 124.400 123.174 1.226 1
1 50 . 11 1 1 A 6 6 PHE H H 6 7.790 8.953 -1.163 1
1 51 . 11 1 1 A 6 6 PHE HA H 6 3.160 4.753 -1.593 1
1 58 . 11 1 1 A 6 6 PHE C C 6 173.500 174.537 -1.037 1
1 59 . 11 1 1 A 6 6 PHE CA C 6 56.900 58.954 -2.054 1
1 60 . 11 1 1 A 6 6 PHE CB C 6 40.100 40.191 -0.091 1
1 65 . 11 1 1 A 6 6 PHE N N 6 130.200 128.992 1.208 1
1 66 . 11 1 1 A 7 7 THR H H 7 6.790 7.997 -1.207 1
1 67 . 11 1 1 A 7 7 THR HA H 7 4.530 4.864 -0.334 1
1 72 . 11 1 1 A 7 7 THR C C 7 172.300 172.831 -0.531 1
1 73 . 11 1 1 A 7 7 THR CA C 7 59.200 60.922 -1.722 1
1 74 . 11 1 1 A 7 7 THR CB C 7 71.000 71.767 -0.767 1
1 76 . 11 1 1 A 7 7 THR N N 7 117.900 122.450 -4.550 1
1 77 . 11 1 1 A 8 8 SER H H 8 7.600 8.761 -1.161 1
1 78 . 11 1 1 A 8 8 SER HA H 8 4.180 4.659 -0.479 1
1 81 . 11 1 1 A 8 8 SER C C 8 175.300 172.222 3.078 1
1 82 . 11 1 1 A 8 8 SER CA C 8 55.800 55.763 0.037 1
1 83 . 11 1 1 A 8 8 SER CB C 8 64.000 64.678 -0.678 1
1 84 . 11 1 1 A 8 8 SER N N 8 113.400 119.712 -6.312 1
1 85 . 11 1 1 A 9 9 VAL H H 9 8.880 8.633 0.247 1
1 86 . 11 1 1 A 9 9 VAL HA H 9 5.220 4.948 0.272 1
1 94 . 11 1 1 A 9 9 VAL C C 9 174.000 173.728 0.272 1
1 95 . 11 1 1 A 9 9 VAL CA C 9 59.100 59.309 -0.209 1
1 96 . 11 1 1 A 9 9 VAL CB C 9 36.500 34.562 1.938 1
1 99 . 11 1 1 A 9 9 VAL N N 9 114.700 119.070 -4.370 1
1 100 . 11 1 1 A 10 10 VAL H H 10 8.510 9.022 -0.512 1
1 101 . 11 1 1 A 10 10 VAL HA H 10 4.470 4.784 -0.314 1
1 109 . 11 1 1 A 10 10 VAL C C 10 173.700 174.171 -0.471 1
1 110 . 11 1 1 A 10 10 VAL CA C 10 59.400 59.328 0.072 1
1 111 . 11 1 1 A 10 10 VAL CB C 10 36.000 35.116 0.884 1
1 114 . 11 1 1 A 10 10 VAL N N 10 117.100 124.450 -7.350 1
1 115 . 11 1 1 A 11 11 ARG H H 11 8.500 8.222 0.278 1
1 116 . 11 1 1 A 11 11 ARG HA H 11 4.460 4.586 -0.126 1
1 123 . 11 1 1 A 11 11 ARG C C 11 174.500 174.786 -0.286 1
1 124 . 11 1 1 A 11 11 ARG CA C 11 57.400 55.778 1.622 1
1 125 . 11 1 1 A 11 11 ARG CB C 11 31.000 30.633 0.367 1
1 128 . 11 1 1 A 11 11 ARG N N 11 124.800 126.431 -1.631 1
1 129 . 11 1 1 A 12 12 VAL H H 12 7.650 8.741 -1.091 1
1 130 . 11 1 1 A 12 12 VAL HA H 12 4.970 4.227 0.743 1
1 138 . 11 1 1 A 12 12 VAL C C 12 176.700 175.095 1.605 1
1 139 . 11 1 1 A 12 12 VAL CA C 12 59.400 61.868 -2.468 1
1 140 . 11 1 1 A 12 12 VAL CB C 12 34.400 32.707 1.693 1
1 143 . 11 1 1 A 12 12 VAL N N 12 120.900 125.285 -4.385 1
1 144 . 11 1 1 A 13 13 ARG H H 13 9.020 9.234 -0.214 1
1 145 . 11 1 1 A 13 13 ARG HA H 13 4.700 5.113 -0.413 1
1 152 . 11 1 1 A 13 13 ARG C C 13 176.000 175.244 0.756 1
1 153 . 11 1 1 A 13 13 ARG CA C 13 54.600 54.806 -0.206 1
1 154 . 11 1 1 A 13 13 ARG CB C 13 32.900 32.670 0.230 1
1 157 . 11 1 1 A 13 13 ARG N N 13 127.500 127.720 -0.220 1
1 158 . 11 1 1 A 14 14 GLY H H 14 8.640 8.444 0.196 1
1 159 . 11 1 1 A 14 14 GLY HA2 H 14 3.680 4.219 -0.539 1
1 160 . 11 1 1 A 14 14 GLY HA3 H 14 4.190 4.221 -0.031 1
1 161 . 11 1 1 A 14 14 GLY C C 14 173.700 174.026 -0.326 1
1 162 . 11 1 1 A 14 14 GLY CA C 14 45.600 44.116 1.484 1
1 163 . 11 1 1 A 14 14 GLY N N 14 108.800 112.340 -3.540 1
1 164 . 11 1 1 A 15 15 SER H H 15 8.220 8.715 -0.495 1
1 165 . 11 1 1 A 15 15 SER HA H 15 5.020 4.596 0.424 1
1 168 . 11 1 1 A 15 15 SER C C 15 175.400 174.733 0.667 1
1 169 . 11 1 1 A 15 15 SER CA C 15 55.300 58.233 -2.933 1
1 170 . 11 1 1 A 15 15 SER CB C 15 64.900 63.309 1.591 1
1 171 . 11 1 1 A 15 15 SER N N 15 113.200 114.293 -1.093 1
1 172 . 11 1 1 A 16 16 LYS H H 16 9.930 7.383 2.547 1
1 173 . 11 1 1 A 16 16 LYS HA H 16 4.190 4.474 -0.284 1
1 182 . 11 1 1 A 16 16 LYS C C 16 176.500 177.210 -0.710 1
1 183 . 11 1 1 A 16 16 LYS CA C 16 57.300 55.952 1.348 1
1 184 . 11 1 1 A 16 16 LYS CB C 16 32.300 33.256 -0.956 1
1 188 . 11 1 1 A 16 16 LYS N N 16 129.200 119.100 10.100 1
1 189 . 11 1 1 A 17 17 LYS H H 17 7.960 8.198 -0.238 1
1 190 . 11 1 1 A 17 17 LYS HA H 17 4.030 4.405 -0.375 1
1 199 . 11 1 1 A 17 17 LYS C C 17 175.600 174.838 0.762 1
1 200 . 11 1 1 A 17 17 LYS CA C 17 56.900 56.577 0.323 1
1 201 . 11 1 1 A 17 17 LYS CB C 17 34.700 32.710 1.990 1
1 205 . 11 1 1 A 17 17 LYS N N 17 118.500 117.839 0.661 1
1 206 . 11 1 1 A 18 18 TYR H H 18 7.780 7.809 -0.029 1
1 207 . 11 1 1 A 18 18 TYR HA H 18 4.760 5.058 -0.298 1
1 214 . 11 1 1 A 18 18 TYR C C 18 174.000 174.645 -0.645 1
1 215 . 11 1 1 A 18 18 TYR CA C 18 56.800 56.556 0.244 1
1 216 . 11 1 1 A 18 18 TYR CB C 18 41.100 43.701 -2.601 1
1 221 . 11 1 1 A 18 18 TYR N N 18 117.100 119.005 -1.905 1
1 222 . 11 1 1 A 19 19 ASN H H 19 8.890 8.835 0.055 1
1 223 . 11 1 1 A 19 19 ASN HA H 19 4.960 5.049 -0.089 1
1 228 . 11 1 1 A 19 19 ASN C C 19 176.100 174.696 1.404 1
1 229 . 11 1 1 A 19 19 ASN CA C 19 53.600 53.216 0.384 1
1 230 . 11 1 1 A 19 19 ASN CB C 19 40.300 41.009 -0.709 1
1 231 . 11 1 1 A 19 19 ASN N N 19 116.600 116.468 0.132 1
1 233 . 11 1 1 A 20 20 VAL H H 20 7.730 7.700 0.030 1
1 234 . 11 1 1 A 20 20 VAL HA H 20 5.250 5.011 0.239 1
1 242 . 11 1 1 A 20 20 VAL C C 20 173.800 173.901 -0.101 1
1 243 . 11 1 1 A 20 20 VAL CA C 20 59.400 59.242 0.158 1
1 244 . 11 1 1 A 20 20 VAL CB C 20 37.600 35.482 2.118 1
1 247 . 11 1 1 A 20 20 VAL N N 20 113.900 115.075 -1.175 1
1 248 . 11 1 1 A 21 21 VAL H H 21 8.890 8.855 0.035 1
1 249 . 11 1 1 A 21 21 VAL HA H 21 4.840 4.624 0.216 1
1 257 . 11 1 1 A 21 21 VAL CA C 21 56.800 57.347 -0.547 1
1 258 . 11 1 1 A 21 21 VAL CB C 21 36.000 35.193 0.807 1
1 261 . 11 1 1 A 21 21 VAL N N 21 118.500 122.067 -3.567 1
1 262 . 11 1 1 A 22 22 PRO HA H 22 4.940 5.035 -0.095 1
1 269 . 11 1 1 A 22 22 PRO C C 22 175.600 176.446 -0.846 1
1 270 . 11 1 1 A 22 22 PRO CA C 22 62.700 62.404 0.296 1
1 271 . 11 1 1 A 22 22 PRO CB C 22 31.800 31.851 -0.051 1
1 274 . 11 1 1 A 23 23 VAL H H 23 8.060 8.553 -0.493 1
1 275 . 11 1 1 A 23 23 VAL HA H 23 5.390 4.821 0.569 1
1 283 . 11 1 1 A 23 23 VAL C C 23 175.400 175.299 0.101 1
1 284 . 11 1 1 A 23 23 VAL CA C 23 57.800 59.336 -1.536 1
1 285 . 11 1 1 A 23 23 VAL CB C 23 36.300 33.776 2.524 1
1 288 . 11 1 1 A 23 23 VAL N N 23 110.900 116.812 -5.912 1
1 289 . 11 1 1 A 24 24 LYS H H 24 8.960 9.323 -0.363 1
1 290 . 11 1 1 A 24 24 LYS HA H 24 5.600 5.149 0.451 1
1 299 . 11 1 1 A 24 24 LYS C C 24 175.600 174.974 0.626 1
1 300 . 11 1 1 A 24 24 LYS CA C 24 54.200 53.876 0.324 1
1 301 . 11 1 1 A 24 24 LYS CB C 24 37.000 36.313 0.687 1
1 305 . 11 1 1 A 24 24 LYS N N 24 117.900 123.034 -5.134 1
1 306 . 11 1 1 A 25 25 SER H H 25 8.950 8.650 0.300 1
1 307 . 11 1 1 A 25 25 SER HA H 25 5.190 4.902 0.288 1
1 310 . 11 1 1 A 25 25 SER C C 25 173.800 175.177 -1.377 1
1 311 . 11 1 1 A 25 25 SER CA C 25 57.700 58.019 -0.319 1
1 312 . 11 1 1 A 25 25 SER CB C 25 65.100 64.777 0.323 1
1 313 . 11 1 1 A 25 25 SER N N 25 114.600 117.916 -3.316 1
1 314 . 11 1 1 A 26 26 ASN H H 26 9.020 8.459 0.561 1
1 315 . 11 1 1 A 26 26 ASN HA H 26 4.370 4.615 -0.245 1
1 320 . 11 1 1 A 26 26 ASN C C 26 173.500 174.518 -1.018 1
1 321 . 11 1 1 A 26 26 ASN CA C 26 53.700 53.854 -0.154 1
1 322 . 11 1 1 A 26 26 ASN CB C 26 37.100 38.389 -1.289 1
1 323 . 11 1 1 A 26 26 ASN N N 26 118.300 121.628 -3.328 1
1 325 . 11 1 1 A 27 27 LYS H H 27 7.400 7.542 -0.142 1
1 326 . 11 1 1 A 27 27 LYS HA H 27 4.780 4.751 0.029 1
1 335 . 11 1 1 A 27 27 LYS CA C 27 53.500 52.574 0.926 1
1 336 . 11 1 1 A 27 27 LYS CB C 27 34.100 33.704 0.396 1
1 340 . 11 1 1 A 27 27 LYS N N 27 116.600 119.373 -2.773 1
1 341 . 11 1 1 A 28 28 PRO HA H 28 4.040 4.478 -0.438 1
1 348 . 11 1 1 A 28 28 PRO C C 28 174.500 175.840 -1.340 1
1 349 . 11 1 1 A 28 28 PRO CA C 28 63.200 63.213 -0.013 1
1 350 . 11 1 1 A 28 28 PRO CB C 28 32.500 32.146 0.354 1
1 353 . 11 1 1 A 29 29 VAL H H 29 8.860 8.916 -0.056 1
1 354 . 11 1 1 A 29 29 VAL HA H 29 4.420 4.658 -0.238 1
1 362 . 11 1 1 A 29 29 VAL C C 29 174.800 175.531 -0.731 1
1 363 . 11 1 1 A 29 29 VAL CA C 29 60.300 60.528 -0.228 1
1 364 . 11 1 1 A 29 29 VAL CB C 29 36.400 34.528 1.872 1
1 367 . 11 1 1 A 29 29 VAL N N 29 119.800 123.049 -3.249 1
1 368 . 11 1 1 A 30 30 GLU H H 30 9.550 8.752 0.798 1
1 369 . 11 1 1 A 30 30 GLU HA H 30 4.260 4.416 -0.156 1
1 374 . 11 1 1 A 30 30 GLU C C 30 177.800 178.342 -0.542 1
1 375 . 11 1 1 A 30 30 GLU CA C 30 58.000 56.620 1.380 1
1 376 . 11 1 1 A 30 30 GLU CB C 30 29.700 30.995 -1.295 1
1 378 . 11 1 1 A 30 30 GLU N N 30 128.900 126.620 2.280 1
1 379 . 11 1 1 A 31 31 ILE H H 31 7.910 8.159 -0.249 1
1 380 . 11 1 1 A 31 31 ILE HA H 31 2.120 4.339 -2.219 1
1 390 . 11 1 1 A 31 31 ILE C C 31 178.000 176.809 1.191 1
1 391 . 11 1 1 A 31 31 ILE CA C 31 63.500 62.869 0.631 1
1 392 . 11 1 1 A 31 31 ILE CB C 31 37.200 37.198 0.002 1
1 396 . 11 1 1 A 31 31 ILE N N 31 122.500 123.552 -1.052 1
1 397 . 11 1 1 A 32 32 SER H H 32 7.940 8.056 -0.116 1
1 398 . 11 1 1 A 32 32 SER HA H 32 4.070 4.537 -0.467 1
1 401 . 11 1 1 A 32 32 SER C C 32 175.800 175.221 0.579 1
1 402 . 11 1 1 A 32 32 SER CA C 32 60.200 57.544 2.656 1
1 403 . 11 1 1 A 32 32 SER CB C 32 62.100 64.806 -2.706 1
1 404 . 11 1 1 A 32 32 SER N N 32 115.300 115.448 -0.148 1
1 405 . 11 1 1 A 33 33 LYS H H 33 7.640 8.060 -0.420 1
1 406 . 11 1 1 A 33 33 LYS HA H 33 4.400 3.973 0.427 1
1 415 . 11 1 1 A 33 33 LYS C C 33 176.600 177.838 -1.238 1
1 416 . 11 1 1 A 33 33 LYS CA C 33 56.200 57.955 -1.755 1
1 417 . 11 1 1 A 33 33 LYS CB C 33 32.700 32.633 0.067 1
1 421 . 11 1 1 A 33 33 LYS N N 33 119.800 120.642 -0.842 1
1 422 . 11 1 1 A 34 34 TRP H H 34 7.860 7.530 0.330 1
1 423 . 11 1 1 A 34 34 TRP HA H 34 3.870 4.346 -0.476 1
1 426 . 11 1 1 A 34 34 TRP C C 34 178.600 178.916 -0.316 1
1 427 . 11 1 1 A 34 34 TRP CA C 34 60.200 59.436 0.764 1
1 428 . 11 1 1 A 34 34 TRP CB C 34 28.500 27.579 0.921 1
1 429 . 11 1 1 A 34 34 TRP N N 34 120.000 119.564 0.436 1
1 430 . 11 1 1 A 35 35 ILE H H 35 8.200 7.238 0.962 1
1 431 . 11 1 1 A 35 35 ILE HA H 35 3.990 3.085 0.905 1
1 441 . 11 1 1 A 35 35 ILE C C 35 177.900 177.403 0.497 1
1 442 . 11 1 1 A 35 35 ILE CA C 35 64.300 64.940 -0.640 1
1 443 . 11 1 1 A 35 35 ILE CB C 35 37.200 37.424 -0.224 1
1 447 . 11 1 1 A 35 35 ILE N N 35 119.500 121.989 -2.489 1
1 448 . 11 1 1 A 36 36 ASP H H 36 7.680 7.769 -0.089 1
1 449 . 11 1 1 A 36 36 ASP HA H 36 4.490 4.061 0.429 1
1 452 . 11 1 1 A 36 36 ASP C C 36 179.200 178.783 0.417 1
1 453 . 11 1 1 A 36 36 ASP CA C 36 57.500 57.289 0.211 1
1 454 . 11 1 1 A 36 36 ASP CB C 36 40.400 40.121 0.279 1
1 455 . 11 1 1 A 36 36 ASP N N 36 122.000 119.589 2.411 1
1 456 . 11 1 1 A 37 37 PHE H H 37 8.450 7.318 1.132 1
1 457 . 11 1 1 A 37 37 PHE HA H 37 4.080 4.285 -0.205 1
1 465 . 11 1 1 A 37 37 PHE C C 37 178.300 178.976 -0.676 1
1 466 . 11 1 1 A 37 37 PHE CA C 37 58.600 60.447 -1.847 1
1 467 . 11 1 1 A 37 37 PHE CB C 37 37.000 37.880 -0.880 1
1 473 . 11 1 1 A 37 37 PHE N N 37 119.800 119.174 0.626 1
1 474 . 11 1 1 A 38 38 SER H H 38 8.580 8.679 -0.099 1
1 475 . 11 1 1 A 38 38 SER HA H 38 4.250 4.478 -0.228 1
1 478 . 11 1 1 A 38 38 SER C C 38 176.800 177.556 -0.756 1
1 479 . 11 1 1 A 38 38 SER CA C 38 62.700 61.778 0.922 1
1 480 . 11 1 1 A 38 38 SER CB C 38 62.700 62.589 0.111 1
1 481 . 11 1 1 A 38 38 SER N N 38 115.800 116.848 -1.048 1
1 482 . 11 1 1 A 39 39 ASN H H 39 8.190 7.986 0.204 1
1 483 . 11 1 1 A 39 39 ASN HA H 39 4.540 4.559 -0.019 1
1 488 . 11 1 1 A 39 39 ASN C C 39 178.500 178.177 0.323 1
1 489 . 11 1 1 A 39 39 ASN CA C 39 56.200 56.379 -0.179 1
1 490 . 11 1 1 A 39 39 ASN CB C 39 37.900 37.963 -0.063 1
1 491 . 11 1 1 A 39 39 ASN N N 39 121.300 121.068 0.232 1
1 493 . 11 1 1 A 40 40 VAL H H 40 7.840 7.800 0.040 1
1 494 . 11 1 1 A 40 40 VAL HA H 40 3.650 3.639 0.011 1
1 502 . 11 1 1 A 40 40 VAL C C 40 179.000 178.061 0.939 1
1 503 . 11 1 1 A 40 40 VAL CA C 40 66.600 66.482 0.118 1
1 504 . 11 1 1 A 40 40 VAL CB C 40 32.100 31.530 0.570 1
1 507 . 11 1 1 A 40 40 VAL N N 40 121.800 120.972 0.828 1
1 508 . 11 1 1 A 41 41 LEU H H 41 8.210 8.690 -0.480 1
1 509 . 11 1 1 A 41 41 LEU HA H 41 3.840 4.146 -0.306 1
1 519 . 11 1 1 A 41 41 LEU C C 41 178.800 179.780 -0.980 1
1 520 . 11 1 1 A 41 41 LEU CA C 41 57.400 57.478 -0.078 1
1 521 . 11 1 1 A 41 41 LEU CB C 41 41.200 41.113 0.087 1
1 525 . 11 1 1 A 41 41 LEU N N 41 117.700 119.413 -1.713 1
1 526 . 11 1 1 A 42 42 SER H H 42 7.980 7.903 0.077 1
1 527 . 11 1 1 A 42 42 SER HA H 42 4.260 4.379 -0.119 1
1 530 . 11 1 1 A 42 42 SER C C 42 174.900 175.117 -0.217 1
1 531 . 11 1 1 A 42 42 SER CA C 42 61.200 61.628 -0.428 1
1 532 . 11 1 1 A 42 42 SER CB C 42 63.100 63.100 0.000 1
1 533 . 11 1 1 A 42 42 SER N N 42 113.200 115.646 -2.446 1
1 534 . 11 1 1 A 43 43 ARG H H 43 7.100 7.823 -0.723 1
1 535 . 11 1 1 A 43 43 ARG HA H 43 4.500 4.556 -0.056 1
1 542 . 11 1 1 A 43 43 ARG C C 43 175.800 176.794 -0.994 1
1 543 . 11 1 1 A 43 43 ARG CA C 43 55.600 55.865 -0.265 1
1 544 . 11 1 1 A 43 43 ARG CB C 43 30.800 30.939 -0.139 1
1 547 . 11 1 1 A 43 43 ARG N N 43 118.400 117.833 0.567 1
1 548 . 11 1 1 A 44 44 LEU H H 44 7.610 7.584 0.026 1
1 549 . 11 1 1 A 44 44 LEU HA H 44 4.590 4.427 0.163 1
1 559 . 11 1 1 A 44 44 LEU C C 44 175.300 174.601 0.699 1
1 560 . 11 1 1 A 44 44 LEU CA C 44 53.900 53.555 0.345 1
1 561 . 11 1 1 A 44 44 LEU CB C 44 44.100 40.390 3.710 1
1 565 . 11 1 1 A 44 44 LEU N N 44 120.400 122.385 -1.985 1
1 566 . 11 1 1 A 45 45 TYR H H 45 7.630 8.792 -1.162 1
1 567 . 11 1 1 A 45 45 TYR HA H 45 5.180 4.751 0.429 1
1 574 . 11 1 1 A 45 45 TYR C C 45 174.600 175.059 -0.459 1
1 575 . 11 1 1 A 45 45 TYR CA C 45 56.300 56.851 -0.551 1
1 576 . 11 1 1 A 45 45 TYR CB C 45 41.400 36.326 5.074 1
1 581 . 11 1 1 A 45 45 TYR N N 45 115.300 123.719 -8.419 1
1 582 . 11 1 1 A 46 46 VAL H H 46 8.770 8.067 0.703 1
1 583 . 11 1 1 A 46 46 VAL HA H 46 4.540 4.769 -0.229 1
1 591 . 11 1 1 A 46 46 VAL C C 46 174.600 176.465 -1.865 1
1 592 . 11 1 1 A 46 46 VAL CA C 46 59.600 60.920 -1.320 1
1 593 . 11 1 1 A 46 46 VAL CB C 46 34.700 32.930 1.770 1
1 596 . 11 1 1 A 46 46 VAL N N 46 115.400 120.196 -4.796 1
1 597 . 11 1 1 A 47 47 GLY H H 47 8.280 8.622 -0.342 1
1 598 . 11 1 1 A 47 47 GLY HA2 H 47 3.610 4.098 -0.488 1
1 599 . 11 1 1 A 47 47 GLY HA3 H 47 4.970 4.101 0.869 1
1 600 . 11 1 1 A 47 47 GLY C C 47 173.100 173.182 -0.082 1
1 601 . 11 1 1 A 47 47 GLY CA C 47 43.600 46.508 -2.908 1
1 602 . 11 1 1 A 47 47 GLY N N 47 109.900 110.107 -0.207 1
1 603 . 11 1 1 A 48 48 VAL H H 48 7.630 7.488 0.142 1
1 604 . 11 1 1 A 48 48 VAL HA H 48 4.320 4.579 -0.259 1
1 612 . 11 1 1 A 48 48 VAL CA C 48 58.700 59.016 -0.316 1
1 613 . 11 1 1 A 48 48 VAL CB C 48 32.100 34.912 -2.812 1
1 616 . 11 1 1 A 48 48 VAL N N 48 109.900 119.756 -9.856 1
1 617 . 11 1 1 A 49 49 PRO HA H 49 4.800 4.610 0.190 1
1 624 . 11 1 1 A 49 49 PRO C C 49 176.700 176.670 0.030 1
1 625 . 11 1 1 A 49 49 PRO CA C 49 62.300 62.808 -0.508 1
1 626 . 11 1 1 A 49 49 PRO CB C 49 35.400 31.626 3.774 1
1 629 . 11 1 1 A 50 50 THR H H 50 8.790 8.215 0.575 1
1 630 . 11 1 1 A 50 50 THR HA H 50 4.690 4.651 0.039 1
1 635 . 11 1 1 A 50 50 THR C C 50 173.500 174.457 -0.957 1
1 636 . 11 1 1 A 50 50 THR CA C 50 60.800 60.316 0.484 1
1 637 . 11 1 1 A 50 50 THR CB C 50 70.800 71.534 -0.734 1
1 639 . 11 1 1 A 50 50 THR N N 50 113.500 112.170 1.330 1
1 640 . 11 1 1 A 51 51 LYS H H 51 7.810 8.532 -0.722 1
1 641 . 11 1 1 A 51 51 LYS HA H 51 4.890 4.658 0.232 1
1 650 . 11 1 1 A 51 51 LYS C C 51 175.900 175.001 0.899 1
1 651 . 11 1 1 A 51 51 LYS CA C 51 54.100 54.995 -0.895 1
1 652 . 11 1 1 A 51 51 LYS CB C 51 35.300 33.626 1.674 1
1 656 . 11 1 1 A 51 51 LYS N N 51 122.200 120.803 1.397 1
1 657 . 11 1 1 A 52 52 SER H H 52 8.410 8.596 -0.186 1
1 658 . 11 1 1 A 52 52 SER HA H 52 3.630 4.844 -1.214 1
1 661 . 11 1 1 A 52 52 SER C C 52 175.800 175.241 0.559 1
1 662 . 11 1 1 A 52 52 SER CA C 52 58.800 57.522 1.278 1
1 663 . 11 1 1 A 52 52 SER CB C 52 62.600 64.868 -2.268 1
1 664 . 11 1 1 A 52 52 SER N N 52 118.900 117.097 1.803 1
1 665 . 11 1 1 A 53 53 GLY H H 53 9.070 9.052 0.018 1
1 666 . 11 1 1 A 53 53 GLY HA2 H 53 3.390 3.889 -0.499 1
1 667 . 11 1 1 A 53 53 GLY HA3 H 53 4.460 3.893 0.567 1
1 668 . 11 1 1 A 53 53 GLY C C 53 174.100 174.588 -0.488 1
1 669 . 11 1 1 A 53 53 GLY CA C 53 44.800 45.766 -0.966 1
1 670 . 11 1 1 A 53 53 GLY N N 53 115.600 114.873 0.727 1
1 671 . 11 1 1 A 54 54 ASN H H 54 7.870 7.951 -0.081 1
1 672 . 11 1 1 A 54 54 ASN HA H 54 4.570 4.730 -0.160 1
1 677 . 11 1 1 A 54 54 ASN C C 54 175.500 174.668 0.832 1
1 678 . 11 1 1 A 54 54 ASN CA C 54 53.000 52.644 0.356 1
1 679 . 11 1 1 A 54 54 ASN CB C 54 38.600 38.105 0.495 1
1 680 . 11 1 1 A 54 54 ASN N N 54 119.600 119.709 -0.109 1
1 682 . 11 1 1 A 55 55 VAL H H 55 8.770 8.897 -0.127 1
1 683 . 11 1 1 A 55 55 VAL HA H 55 3.880 3.996 -0.116 1
1 691 . 11 1 1 A 55 55 VAL C C 55 176.200 175.266 0.934 1
1 692 . 11 1 1 A 55 55 VAL CA C 55 63.700 63.394 0.306 1
1 693 . 11 1 1 A 55 55 VAL CB C 55 31.600 30.816 0.784 1
1 696 . 11 1 1 A 55 55 VAL N N 55 123.900 125.378 -1.478 1
1 697 . 11 1 1 A 56 56 VAL H H 56 9.050 8.879 0.171 1
1 698 . 11 1 1 A 56 56 VAL HA H 56 3.990 3.988 0.002 1
1 706 . 11 1 1 A 56 56 VAL C C 56 175.200 176.310 -1.110 1
1 707 . 11 1 1 A 56 56 VAL CA C 56 62.700 64.143 -1.443 1
1 708 . 11 1 1 A 56 56 VAL CB C 56 32.900 32.410 0.490 1
1 711 . 11 1 1 A 56 56 VAL N N 56 127.500 129.121 -1.621 1
1 712 . 11 1 1 A 57 57 CYS H H 57 7.250 7.481 -0.231 1
1 713 . 11 1 1 A 57 57 CYS HA H 57 4.370 5.026 -0.656 1
1 716 . 11 1 1 A 57 57 CYS C C 57 171.900 173.032 -1.132 1
1 717 . 11 1 1 A 57 57 CYS CA C 57 58.600 57.666 0.934 1
1 718 . 11 1 1 A 57 57 CYS CB C 57 28.600 29.594 -0.994 1
1 719 . 11 1 1 A 57 57 CYS N N 57 117.600 118.370 -0.770 1
1 720 . 11 1 1 A 58 58 LYS H H 58 8.880 8.689 0.191 1
1 721 . 11 1 1 A 58 58 LYS HA H 58 4.220 4.440 -0.220 1
1 730 . 11 1 1 A 58 58 LYS C C 58 176.000 176.500 -0.500 1
1 731 . 11 1 1 A 58 58 LYS CA C 58 54.400 55.759 -1.359 1
1 732 . 11 1 1 A 58 58 LYS CB C 58 33.600 33.432 0.168 1
1 736 . 11 1 1 A 58 58 LYS N N 58 132.000 126.880 5.120 1
1 737 . 11 1 1 A 59 59 ASN H H 59 9.500 9.115 0.385 1
1 738 . 11 1 1 A 59 59 ASN HA H 59 4.040 4.494 -0.454 1
1 743 . 11 1 1 A 59 59 ASN C C 59 176.400 175.283 1.117 1
1 744 . 11 1 1 A 59 59 ASN CA C 59 53.200 53.874 -0.674 1
1 745 . 11 1 1 A 59 59 ASN CB C 59 35.900 37.055 -1.155 1
1 746 . 11 1 1 A 59 59 ASN N N 59 127.500 124.062 3.438 1
1 748 . 11 1 1 A 60 60 ILE H H 60 8.050 7.962 0.088 1
1 749 . 11 1 1 A 60 60 ILE HA H 60 3.680 4.149 -0.469 1
1 759 . 11 1 1 A 60 60 ILE C C 60 175.700 176.796 -1.096 1
1 760 . 11 1 1 A 60 60 ILE CA C 60 61.900 61.866 0.034 1
1 761 . 11 1 1 A 60 60 ILE CB C 60 38.300 38.108 0.192 1
1 765 . 11 1 1 A 60 60 ILE N N 60 120.200 121.265 -1.065 1
1 766 . 11 1 1 A 61 61 MET H H 61 9.590 9.566 0.024 1
1 767 . 11 1 1 A 61 61 MET HA H 61 3.920 4.217 -0.297 1
1 775 . 11 1 1 A 61 61 MET C C 61 174.300 176.111 -1.811 1
1 776 . 11 1 1 A 61 61 MET CA C 61 57.000 57.083 -0.083 1
1 777 . 11 1 1 A 61 61 MET CB C 61 31.300 31.238 0.062 1
1 780 . 11 1 1 A 61 61 MET N N 61 124.400 125.852 -1.452 1
1 781 . 11 1 1 A 62 62 ASN H H 62 8.250 8.187 0.063 1
1 782 . 11 1 1 A 62 62 ASN HA H 62 4.400 4.474 -0.074 1
1 787 . 11 1 1 A 62 62 ASN C C 62 176.800 174.542 2.258 1
1 788 . 11 1 1 A 62 62 ASN CA C 62 54.400 53.935 0.465 1
1 789 . 11 1 1 A 62 62 ASN CB C 62 37.600 37.151 0.449 1
1 790 . 11 1 1 A 62 62 ASN N N 62 111.900 116.880 -4.980 1
1 792 . 11 1 1 A 63 63 THR H H 63 7.480 8.493 -1.013 1
1 793 . 11 1 1 A 63 63 THR HA H 63 4.210 4.627 -0.417 1
1 798 . 11 1 1 A 63 63 THR C C 63 177.100 174.959 2.141 1
1 799 . 11 1 1 A 63 63 THR CA C 63 62.900 62.587 0.313 1
1 800 . 11 1 1 A 63 63 THR CB C 63 72.500 71.981 0.519 1
1 802 . 11 1 1 A 63 63 THR N N 63 105.900 119.378 -13.478 1
1 803 . 11 1 1 A 64 64 GLY H H 64 9.110 8.065 1.045 1
1 804 . 11 1 1 A 64 64 GLY HA2 H 64 3.580 4.057 -0.477 1
1 805 . 11 1 1 A 64 64 GLY HA3 H 64 4.090 4.060 0.030 1
1 806 . 11 1 1 A 64 64 GLY C C 64 173.200 174.616 -1.416 1
1 807 . 11 1 1 A 64 64 GLY CA C 64 45.300 45.251 0.049 1
1 808 . 11 1 1 A 64 64 GLY N N 64 111.500 109.578 1.922 1
1 809 . 11 1 1 A 65 65 VAL H H 65 7.580 7.829 -0.249 1
1 810 . 11 1 1 A 65 65 VAL HA H 65 4.060 4.157 -0.097 1
1 818 . 11 1 1 A 65 65 VAL C C 65 172.900 174.661 -1.761 1
1 819 . 11 1 1 A 65 65 VAL CA C 65 61.400 61.428 -0.028 1
1 820 . 11 1 1 A 65 65 VAL CB C 65 32.900 32.914 -0.014 1
1 823 . 11 1 1 A 65 65 VAL N N 65 121.600 119.084 2.516 1
1 824 . 11 1 1 A 66 66 ASP H H 66 8.210 8.630 -0.420 1
1 825 . 11 1 1 A 66 66 ASP HA H 66 5.320 5.375 -0.055 1
1 828 . 11 1 1 A 66 66 ASP C C 66 174.800 175.154 -0.354 1
1 829 . 11 1 1 A 66 66 ASP CA C 66 51.700 52.995 -1.295 1
1 830 . 11 1 1 A 66 66 ASP CB C 66 43.200 43.610 -0.410 1
1 831 . 11 1 1 A 66 66 ASP N N 66 123.100 123.807 -0.707 1
1 832 . 11 1 1 A 67 67 ILE H H 67 8.540 9.151 -0.611 1
1 833 . 11 1 1 A 67 67 ILE HA H 67 4.630 4.458 0.172 1
1 843 . 11 1 1 A 67 67 ILE C C 67 175.600 175.710 -0.110 1
1 844 . 11 1 1 A 67 67 ILE CA C 67 56.900 60.222 -3.322 1
1 845 . 11 1 1 A 67 67 ILE CB C 67 35.300 37.618 -2.318 1
1 849 . 11 1 1 A 67 67 ILE N N 67 119.200 124.452 -5.252 1
1 850 . 11 1 1 A 68 68 ILE H H 68 9.420 9.137 0.283 1
1 851 . 11 1 1 A 68 68 ILE HA H 68 4.980 5.331 -0.351 1
1 861 . 11 1 1 A 68 68 ILE C C 68 175.000 175.020 -0.020 1
1 862 . 11 1 1 A 68 68 ILE CA C 68 58.600 59.051 -0.451 1
1 863 . 11 1 1 A 68 68 ILE CB C 68 40.900 40.802 0.098 1
1 867 . 11 1 1 A 68 68 ILE N N 68 125.000 123.500 1.500 1
1 868 . 11 1 1 A 69 69 CYS H H 69 8.870 8.831 0.039 1
1 869 . 11 1 1 A 69 69 CYS HA H 69 4.610 4.918 -0.308 1
1 872 . 11 1 1 A 69 69 CYS C C 69 176.200 174.276 1.924 1
1 873 . 11 1 1 A 69 69 CYS CA C 69 58.900 58.051 0.849 1
1 874 . 11 1 1 A 69 69 CYS CB C 69 27.100 28.832 -1.732 1
1 875 . 11 1 1 A 69 69 CYS N N 69 122.300 122.570 -0.270 1
1 876 . 11 1 1 A 70 70 THR H H 70 8.270 8.551 -0.281 1
1 877 . 11 1 1 A 70 70 THR HA H 70 4.710 4.526 0.184 1
1 882 . 11 1 1 A 70 70 THR C C 70 173.600 173.854 -0.254 1
1 883 . 11 1 1 A 70 70 THR CA C 70 61.500 61.283 0.217 1
1 884 . 11 1 1 A 70 70 THR CB C 70 68.100 69.373 -1.273 1
1 886 . 11 1 1 A 70 70 THR N N 70 116.700 119.919 -3.219 1
1 887 . 11 1 1 A 71 71 LYS H H 71 7.370 7.362 0.008 1
1 888 . 11 1 1 A 71 71 LYS HA H 71 4.520 4.916 -0.396 1
1 897 . 11 1 1 A 71 71 LYS CA C 71 55.100 54.395 0.705 1
1 898 . 11 1 1 A 71 71 LYS CB C 71 37.800 35.752 2.048 1
1 902 . 11 1 1 A 71 71 LYS N N 71 120.900 122.815 -1.915 1
1 903 . 11 1 1 A 72 72 ASN H H 72 8.580 8.783 -0.203 1
1 904 . 11 1 1 A 72 72 ASN HA H 72 4.620 5.208 -0.588 1
1 909 . 11 1 1 A 72 72 ASN C C 72 173.500 174.657 -1.157 1
1 910 . 11 1 1 A 72 72 ASN CA C 72 52.200 53.056 -0.856 1
1 911 . 11 1 1 A 72 72 ASN CB C 72 38.500 39.144 -0.644 1
1 912 . 11 1 1 A 72 72 ASN N N 72 122.700 124.818 -2.118 1
1 914 . 11 1 1 A 73 73 LEU H H 73 8.100 9.576 -1.476 1
1 915 . 11 1 1 A 73 73 LEU HA H 73 4.680 4.986 -0.306 1
1 925 . 11 1 1 A 73 73 LEU CA C 73 51.000 51.961 -0.961 1
1 926 . 11 1 1 A 73 73 LEU CB C 73 42.500 41.623 0.877 1
1 930 . 11 1 1 A 73 73 LEU N N 73 125.100 126.354 -1.254 1
1 931 . 11 1 1 A 74 74 PRO HA H 74 4.670 4.494 0.176 1
1 938 . 11 1 1 A 74 74 PRO C C 74 176.500 177.093 -0.593 1
1 939 . 11 1 1 A 74 74 PRO CA C 74 61.800 63.022 -1.222 1
1 940 . 11 1 1 A 74 74 PRO CB C 74 32.800 31.970 0.830 1
1 943 . 11 1 1 A 75 75 LYS H H 75 8.280 8.235 0.045 1
1 944 . 11 1 1 A 75 75 LYS HA H 75 4.110 4.384 -0.274 1
1 953 . 11 1 1 A 75 75 LYS CA C 75 56.500 56.599 -0.099 1
1 954 . 11 1 1 A 75 75 LYS CB C 75 33.300 33.283 0.017 1
1 958 . 11 1 1 A 75 75 LYS N N 75 117.000 122.351 -5.351 1
1 959 . 11 1 1 A 76 76 ASP H H 76 8.570 8.522 0.048 1
1 960 . 11 1 1 A 76 76 ASP HA H 76 4.530 4.744 -0.214 1
1 963 . 11 1 1 A 76 76 ASP C C 76 176.300 175.658 0.642 1
1 964 . 11 1 1 A 76 76 ASP CA C 76 55.000 52.747 2.253 1
1 965 . 11 1 1 A 76 76 ASP CB C 76 41.100 41.835 -0.735 1
1 966 . 11 1 1 A 76 76 ASP N N 76 122.700 121.722 0.978 1
1 967 . 11 1 1 A 77 77 SER H H 77 8.330 8.572 -0.242 1
1 968 . 11 1 1 A 77 77 SER HA H 77 4.410 5.458 -1.048 1
1 971 . 11 1 1 A 77 77 SER C C 77 174.300 172.752 1.548 1
1 972 . 11 1 1 A 77 77 SER CA C 77 58.000 56.437 1.563 1
1 973 . 11 1 1 A 77 77 SER CB C 77 63.900 65.576 -1.676 1
1 974 . 11 1 1 A 77 77 SER N N 77 116.100 112.403 3.697 1
1 975 . 11 1 1 A 78 78 LEU H H 78 8.350 8.763 -0.413 1
1 976 . 11 1 1 A 78 78 LEU HA H 78 4.280 4.379 -0.099 1
1 986 . 11 1 1 A 78 78 LEU C C 78 177.200 175.869 1.331 1
1 987 . 11 1 1 A 78 78 LEU CA C 78 55.200 54.387 0.813 1
1 988 . 11 1 1 A 78 78 LEU CB C 78 42.100 41.256 0.844 1
1 992 . 11 1 1 A 78 78 LEU N N 78 124.300 126.895 -2.595 1
1 993 . 11 1 1 A 79 79 GLU H H 79 8.300 8.427 -0.127 1
1 994 . 11 1 1 A 79 79 GLU CA C 79 56.400 56.805 -0.405 1
1 995 . 11 1 1 A 79 79 GLU CB C 79 30.200 31.143 -0.943 1
1 1 . 12 1 1 A 2 2 HIS HA H 2 4.640 4.981 -0.341 1
1 4 . 12 1 1 A 2 2 HIS C C 2 173.600 173.700 -0.100 1
1 5 . 12 1 1 A 2 2 HIS CA C 2 56.500 55.973 0.527 1
1 6 . 12 1 1 A 2 2 HIS CB C 2 31.000 33.571 -2.571 1
1 7 . 12 1 1 A 3 3 LYS H H 3 8.160 8.131 0.029 1
1 8 . 12 1 1 A 3 3 LYS HA H 3 4.660 4.365 0.295 1
1 17 . 12 1 1 A 3 3 LYS C C 3 174.400 175.840 -1.440 1
1 18 . 12 1 1 A 3 3 LYS CA C 3 54.800 56.442 -1.642 1
1 19 . 12 1 1 A 3 3 LYS CB C 3 35.800 32.750 3.050 1
1 23 . 12 1 1 A 3 3 LYS N N 3 121.900 124.562 -2.662 1
1 24 . 12 1 1 A 4 4 ASP H H 4 8.470 8.933 -0.463 1
1 25 . 12 1 1 A 4 4 ASP HA H 4 4.900 5.231 -0.331 1
1 28 . 12 1 1 A 4 4 ASP C C 4 176.900 175.345 1.555 1
1 29 . 12 1 1 A 4 4 ASP CA C 4 52.700 52.524 0.176 1
1 30 . 12 1 1 A 4 4 ASP CB C 4 44.100 44.513 -0.413 1
1 31 . 12 1 1 A 4 4 ASP N N 4 117.900 124.577 -6.677 1
1 32 . 12 1 1 A 5 5 ILE H H 5 9.570 8.720 0.850 1
1 33 . 12 1 1 A 5 5 ILE HA H 5 3.640 4.162 -0.522 1
1 43 . 12 1 1 A 5 5 ILE C C 5 174.800 176.020 -1.220 1
1 44 . 12 1 1 A 5 5 ILE CA C 5 60.900 60.687 0.213 1
1 45 . 12 1 1 A 5 5 ILE CB C 5 37.000 38.018 -1.018 1
1 49 . 12 1 1 A 5 5 ILE N N 5 124.400 121.218 3.182 1
1 50 . 12 1 1 A 6 6 PHE H H 6 7.790 8.952 -1.162 1
1 51 . 12 1 1 A 6 6 PHE HA H 6 3.160 4.668 -1.508 1
1 58 . 12 1 1 A 6 6 PHE C C 6 173.500 174.814 -1.314 1
1 59 . 12 1 1 A 6 6 PHE CA C 6 56.900 59.637 -2.737 1
1 60 . 12 1 1 A 6 6 PHE CB C 6 40.100 39.604 0.496 1
1 65 . 12 1 1 A 6 6 PHE N N 6 130.200 129.146 1.054 1
1 66 . 12 1 1 A 7 7 THR H H 7 6.790 8.223 -1.433 1
1 67 . 12 1 1 A 7 7 THR HA H 7 4.530 5.042 -0.512 1
1 72 . 12 1 1 A 7 7 THR C C 7 172.300 171.750 0.550 1
1 73 . 12 1 1 A 7 7 THR CA C 7 59.200 60.373 -1.173 1
1 74 . 12 1 1 A 7 7 THR CB C 7 71.000 71.380 -0.380 1
1 76 . 12 1 1 A 7 7 THR N N 7 117.900 120.203 -2.303 1
1 77 . 12 1 1 A 8 8 SER H H 8 7.600 8.439 -0.839 1
1 78 . 12 1 1 A 8 8 SER HA H 8 4.180 4.946 -0.766 1
1 81 . 12 1 1 A 8 8 SER C C 8 175.300 172.356 2.944 1
1 82 . 12 1 1 A 8 8 SER CA C 8 55.800 57.502 -1.702 1
1 83 . 12 1 1 A 8 8 SER CB C 8 64.000 67.323 -3.323 1
1 84 . 12 1 1 A 8 8 SER N N 8 113.400 121.769 -8.369 1
1 85 . 12 1 1 A 9 9 VAL H H 9 8.880 8.530 0.350 1
1 86 . 12 1 1 A 9 9 VAL HA H 9 5.220 4.825 0.395 1
1 94 . 12 1 1 A 9 9 VAL C C 9 174.000 175.147 -1.147 1
1 95 . 12 1 1 A 9 9 VAL CA C 9 59.100 61.187 -2.087 1
1 96 . 12 1 1 A 9 9 VAL CB C 9 36.500 33.279 3.221 1
1 99 . 12 1 1 A 9 9 VAL N N 9 114.700 121.417 -6.717 1
1 100 . 12 1 1 A 10 10 VAL H H 10 8.510 9.125 -0.615 1
1 101 . 12 1 1 A 10 10 VAL HA H 10 4.470 4.879 -0.409 1
1 109 . 12 1 1 A 10 10 VAL C C 10 173.700 175.149 -1.449 1
1 110 . 12 1 1 A 10 10 VAL CA C 10 59.400 59.319 0.081 1
1 111 . 12 1 1 A 10 10 VAL CB C 10 36.000 34.983 1.017 1
1 114 . 12 1 1 A 10 10 VAL N N 10 117.100 121.061 -3.961 1
1 115 . 12 1 1 A 11 11 ARG H H 11 8.500 8.116 0.384 1
1 116 . 12 1 1 A 11 11 ARG HA H 11 4.460 4.493 -0.033 1
1 123 . 12 1 1 A 11 11 ARG C C 11 174.500 175.023 -0.523 1
1 124 . 12 1 1 A 11 11 ARG CA C 11 57.400 55.987 1.413 1
1 125 . 12 1 1 A 11 11 ARG CB C 11 31.000 30.453 0.547 1
1 128 . 12 1 1 A 11 11 ARG N N 11 124.800 121.724 3.076 1
1 129 . 12 1 1 A 12 12 VAL H H 12 7.650 8.375 -0.725 1
1 130 . 12 1 1 A 12 12 VAL HA H 12 4.970 5.265 -0.295 1
1 138 . 12 1 1 A 12 12 VAL C C 12 176.700 173.860 2.840 1
1 139 . 12 1 1 A 12 12 VAL CA C 12 59.400 60.167 -0.767 1
1 140 . 12 1 1 A 12 12 VAL CB C 12 34.400 34.028 0.372 1
1 143 . 12 1 1 A 12 12 VAL N N 12 120.900 124.380 -3.480 1
1 144 . 12 1 1 A 13 13 ARG H H 13 9.020 9.354 -0.334 1
1 145 . 12 1 1 A 13 13 ARG HA H 13 4.700 5.202 -0.502 1
1 152 . 12 1 1 A 13 13 ARG C C 13 176.000 175.048 0.952 1
1 153 . 12 1 1 A 13 13 ARG CA C 13 54.600 54.642 -0.042 1
1 154 . 12 1 1 A 13 13 ARG CB C 13 32.900 32.848 0.052 1
1 157 . 12 1 1 A 13 13 ARG N N 13 127.500 130.382 -2.882 1
1 158 . 12 1 1 A 14 14 GLY H H 14 8.640 8.402 0.238 1
1 159 . 12 1 1 A 14 14 GLY HA2 H 14 3.680 4.175 -0.495 1
1 160 . 12 1 1 A 14 14 GLY HA3 H 14 4.190 4.188 0.002 1
1 161 . 12 1 1 A 14 14 GLY C C 14 173.700 172.761 0.939 1
1 162 . 12 1 1 A 14 14 GLY CA C 14 45.600 44.103 1.497 1
1 163 . 12 1 1 A 14 14 GLY N N 14 108.800 112.553 -3.753 1
1 164 . 12 1 1 A 15 15 SER H H 15 8.220 8.440 -0.220 1
1 165 . 12 1 1 A 15 15 SER HA H 15 5.020 4.851 0.169 1
1 168 . 12 1 1 A 15 15 SER C C 15 175.400 173.667 1.733 1
1 169 . 12 1 1 A 15 15 SER CA C 15 55.300 58.608 -3.308 1
1 170 . 12 1 1 A 15 15 SER CB C 15 64.900 63.445 1.455 1
1 171 . 12 1 1 A 15 15 SER N N 15 113.200 117.208 -4.008 1
1 172 . 12 1 1 A 16 16 LYS H H 16 9.930 8.402 1.528 1
1 173 . 12 1 1 A 16 16 LYS HA H 16 4.190 4.895 -0.705 1
1 182 . 12 1 1 A 16 16 LYS C C 16 176.500 175.706 0.794 1
1 183 . 12 1 1 A 16 16 LYS CA C 16 57.300 54.917 2.383 1
1 184 . 12 1 1 A 16 16 LYS CB C 16 32.300 33.865 -1.565 1
1 188 . 12 1 1 A 16 16 LYS N N 16 129.200 123.629 5.571 1
1 189 . 12 1 1 A 17 17 LYS H H 17 7.960 8.529 -0.569 1
1 190 . 12 1 1 A 17 17 LYS HA H 17 4.030 4.356 -0.326 1
1 199 . 12 1 1 A 17 17 LYS C C 17 175.600 175.304 0.296 1
1 200 . 12 1 1 A 17 17 LYS CA C 17 56.900 56.356 0.544 1
1 201 . 12 1 1 A 17 17 LYS CB C 17 34.700 32.708 1.992 1
1 205 . 12 1 1 A 17 17 LYS N N 17 118.500 117.088 1.412 1
1 206 . 12 1 1 A 18 18 TYR H H 18 7.780 7.764 0.016 1
1 207 . 12 1 1 A 18 18 TYR HA H 18 4.760 4.975 -0.215 1
1 214 . 12 1 1 A 18 18 TYR C C 18 174.000 175.788 -1.788 1
1 215 . 12 1 1 A 18 18 TYR CA C 18 56.800 56.941 -0.141 1
1 216 . 12 1 1 A 18 18 TYR CB C 18 41.100 40.926 0.174 1
1 221 . 12 1 1 A 18 18 TYR N N 18 117.100 119.665 -2.565 1
1 222 . 12 1 1 A 19 19 ASN H H 19 8.890 9.312 -0.422 1
1 223 . 12 1 1 A 19 19 ASN HA H 19 4.960 4.891 0.069 1
1 228 . 12 1 1 A 19 19 ASN C C 19 176.100 175.040 1.060 1
1 229 . 12 1 1 A 19 19 ASN CA C 19 53.600 53.415 0.185 1
1 230 . 12 1 1 A 19 19 ASN CB C 19 40.300 39.926 0.374 1
1 231 . 12 1 1 A 19 19 ASN N N 19 116.600 122.767 -6.167 1
1 233 . 12 1 1 A 20 20 VAL H H 20 7.730 7.618 0.112 1
1 234 . 12 1 1 A 20 20 VAL HA H 20 5.250 5.006 0.244 1
1 242 . 12 1 1 A 20 20 VAL C C 20 173.800 173.837 -0.037 1
1 243 . 12 1 1 A 20 20 VAL CA C 20 59.400 59.129 0.271 1
1 244 . 12 1 1 A 20 20 VAL CB C 20 37.600 35.696 1.904 1
1 247 . 12 1 1 A 20 20 VAL N N 20 113.900 117.122 -3.222 1
1 248 . 12 1 1 A 21 21 VAL H H 21 8.890 9.167 -0.277 1
1 249 . 12 1 1 A 21 21 VAL HA H 21 4.840 4.700 0.140 1
1 257 . 12 1 1 A 21 21 VAL CA C 21 56.800 57.919 -1.119 1
1 258 . 12 1 1 A 21 21 VAL CB C 21 36.000 35.152 0.848 1
1 261 . 12 1 1 A 21 21 VAL N N 21 118.500 121.930 -3.430 1
1 262 . 12 1 1 A 22 22 PRO HA H 22 4.940 5.103 -0.163 1
1 269 . 12 1 1 A 22 22 PRO C C 22 175.600 176.681 -1.081 1
1 270 . 12 1 1 A 22 22 PRO CA C 22 62.700 62.169 0.531 1
1 271 . 12 1 1 A 22 22 PRO CB C 22 31.800 31.785 0.015 1
1 274 . 12 1 1 A 23 23 VAL H H 23 8.060 8.748 -0.688 1
1 275 . 12 1 1 A 23 23 VAL HA H 23 5.390 4.765 0.625 1
1 283 . 12 1 1 A 23 23 VAL C C 23 175.400 174.922 0.478 1
1 284 . 12 1 1 A 23 23 VAL CA C 23 57.800 59.399 -1.599 1
1 285 . 12 1 1 A 23 23 VAL CB C 23 36.300 33.942 2.358 1
1 288 . 12 1 1 A 23 23 VAL N N 23 110.900 116.807 -5.907 1
1 289 . 12 1 1 A 24 24 LYS H H 24 8.960 9.364 -0.404 1
1 290 . 12 1 1 A 24 24 LYS HA H 24 5.600 5.334 0.266 1
1 299 . 12 1 1 A 24 24 LYS C C 24 175.600 174.037 1.563 1
1 300 . 12 1 1 A 24 24 LYS CA C 24 54.200 54.571 -0.371 1
1 301 . 12 1 1 A 24 24 LYS CB C 24 37.000 36.002 0.998 1
1 305 . 12 1 1 A 24 24 LYS N N 24 117.900 120.497 -2.597 1
1 306 . 12 1 1 A 25 25 SER H H 25 8.950 8.883 0.067 1
1 307 . 12 1 1 A 25 25 SER HA H 25 5.190 4.921 0.269 1
1 310 . 12 1 1 A 25 25 SER C C 25 173.800 175.221 -1.421 1
1 311 . 12 1 1 A 25 25 SER CA C 25 57.700 57.548 0.152 1
1 312 . 12 1 1 A 25 25 SER CB C 25 65.100 65.096 0.004 1
1 313 . 12 1 1 A 25 25 SER N N 25 114.600 116.932 -2.332 1
1 314 . 12 1 1 A 26 26 ASN H H 26 9.020 8.356 0.664 1
1 315 . 12 1 1 A 26 26 ASN HA H 26 4.370 4.753 -0.383 1
1 320 . 12 1 1 A 26 26 ASN C C 26 173.500 174.639 -1.139 1
1 321 . 12 1 1 A 26 26 ASN CA C 26 53.700 53.215 0.485 1
1 322 . 12 1 1 A 26 26 ASN CB C 26 37.100 38.558 -1.458 1
1 323 . 12 1 1 A 26 26 ASN N N 26 118.300 119.365 -1.065 1
1 325 . 12 1 1 A 27 27 LYS H H 27 7.400 7.565 -0.165 1
1 326 . 12 1 1 A 27 27 LYS HA H 27 4.780 4.809 -0.029 1
1 335 . 12 1 1 A 27 27 LYS CA C 27 53.500 52.762 0.738 1
1 336 . 12 1 1 A 27 27 LYS CB C 27 34.100 35.626 -1.526 1
1 340 . 12 1 1 A 27 27 LYS N N 27 116.600 120.536 -3.936 1
1 341 . 12 1 1 A 28 28 PRO HA H 28 4.040 4.581 -0.541 1
1 348 . 12 1 1 A 28 28 PRO C C 28 174.500 176.353 -1.853 1
1 349 . 12 1 1 A 28 28 PRO CA C 28 63.200 63.308 -0.108 1
1 350 . 12 1 1 A 28 28 PRO CB C 28 32.500 32.127 0.373 1
1 353 . 12 1 1 A 29 29 VAL H H 29 8.860 8.386 0.474 1
1 354 . 12 1 1 A 29 29 VAL HA H 29 4.420 4.931 -0.511 1
1 362 . 12 1 1 A 29 29 VAL C C 29 174.800 174.208 0.592 1
1 363 . 12 1 1 A 29 29 VAL CA C 29 60.300 59.317 0.983 1
1 364 . 12 1 1 A 29 29 VAL CB C 29 36.400 35.029 1.371 1
1 367 . 12 1 1 A 29 29 VAL N N 29 119.800 116.443 3.357 1
1 368 . 12 1 1 A 30 30 GLU H H 30 9.550 8.678 0.872 1
1 369 . 12 1 1 A 30 30 GLU HA H 30 4.260 4.665 -0.405 1
1 374 . 12 1 1 A 30 30 GLU C C 30 177.800 177.846 -0.046 1
1 375 . 12 1 1 A 30 30 GLU CA C 30 58.000 55.855 2.145 1
1 376 . 12 1 1 A 30 30 GLU CB C 30 29.700 31.441 -1.741 1
1 378 . 12 1 1 A 30 30 GLU N N 30 128.900 122.525 6.375 1
1 379 . 12 1 1 A 31 31 ILE H H 31 7.910 8.625 -0.715 1
1 380 . 12 1 1 A 31 31 ILE HA H 31 2.120 4.045 -1.925 1
1 390 . 12 1 1 A 31 31 ILE C C 31 178.000 178.279 -0.279 1
1 391 . 12 1 1 A 31 31 ILE CA C 31 63.500 63.889 -0.389 1
1 392 . 12 1 1 A 31 31 ILE CB C 31 37.200 37.842 -0.642 1
1 396 . 12 1 1 A 31 31 ILE N N 31 122.500 123.987 -1.487 1
1 397 . 12 1 1 A 32 32 SER H H 32 7.940 7.978 -0.038 1
1 398 . 12 1 1 A 32 32 SER HA H 32 4.070 4.329 -0.259 1
1 401 . 12 1 1 A 32 32 SER C C 32 175.800 175.353 0.447 1
1 402 . 12 1 1 A 32 32 SER CA C 32 60.200 60.907 -0.707 1
1 403 . 12 1 1 A 32 32 SER CB C 32 62.100 62.916 -0.816 1
1 404 . 12 1 1 A 32 32 SER N N 32 115.300 117.640 -2.340 1
1 405 . 12 1 1 A 33 33 LYS H H 33 7.640 7.515 0.125 1
1 406 . 12 1 1 A 33 33 LYS HA H 33 4.400 4.486 -0.086 1
1 415 . 12 1 1 A 33 33 LYS C C 33 176.600 177.537 -0.937 1
1 416 . 12 1 1 A 33 33 LYS CA C 33 56.200 56.324 -0.124 1
1 417 . 12 1 1 A 33 33 LYS CB C 33 32.700 32.759 -0.059 1
1 421 . 12 1 1 A 33 33 LYS N N 33 119.800 118.562 1.238 1
1 422 . 12 1 1 A 34 34 TRP H H 34 7.860 7.902 -0.042 1
1 423 . 12 1 1 A 34 34 TRP HA H 34 3.870 4.498 -0.628 1
1 426 . 12 1 1 A 34 34 TRP C C 34 178.600 178.688 -0.088 1
1 427 . 12 1 1 A 34 34 TRP CA C 34 60.200 61.141 -0.941 1
1 428 . 12 1 1 A 34 34 TRP CB C 34 28.500 29.525 -1.025 1
1 429 . 12 1 1 A 34 34 TRP N N 34 120.000 122.275 -2.275 1
1 430 . 12 1 1 A 35 35 ILE H H 35 8.200 8.487 -0.287 1
1 431 . 12 1 1 A 35 35 ILE HA H 35 3.990 3.602 0.388 1
1 441 . 12 1 1 A 35 35 ILE C C 35 177.900 177.997 -0.097 1
1 442 . 12 1 1 A 35 35 ILE CA C 35 64.300 65.522 -1.222 1
1 443 . 12 1 1 A 35 35 ILE CB C 35 37.200 38.257 -1.057 1
1 447 . 12 1 1 A 35 35 ILE N N 35 119.500 120.787 -1.287 1
1 448 . 12 1 1 A 36 36 ASP H H 36 7.680 8.172 -0.492 1
1 449 . 12 1 1 A 36 36 ASP HA H 36 4.490 4.243 0.247 1
1 452 . 12 1 1 A 36 36 ASP C C 36 179.200 178.419 0.781 1
1 453 . 12 1 1 A 36 36 ASP CA C 36 57.500 57.186 0.314 1
1 454 . 12 1 1 A 36 36 ASP CB C 36 40.400 40.820 -0.420 1
1 455 . 12 1 1 A 36 36 ASP N N 36 122.000 120.629 1.371 1
1 456 . 12 1 1 A 37 37 PHE H H 37 8.450 8.107 0.343 1
1 457 . 12 1 1 A 37 37 PHE HA H 37 4.080 4.144 -0.064 1
1 465 . 12 1 1 A 37 37 PHE C C 37 178.300 178.216 0.084 1
1 466 . 12 1 1 A 37 37 PHE CA C 37 58.600 60.108 -1.508 1
1 467 . 12 1 1 A 37 37 PHE CB C 37 37.000 37.453 -0.453 1
1 473 . 12 1 1 A 37 37 PHE N N 37 119.800 118.934 0.866 1
1 474 . 12 1 1 A 38 38 SER H H 38 8.580 8.091 0.489 1
1 475 . 12 1 1 A 38 38 SER HA H 38 4.250 4.138 0.112 1
1 478 . 12 1 1 A 38 38 SER C C 38 176.800 176.584 0.216 1
1 479 . 12 1 1 A 38 38 SER CA C 38 62.700 61.116 1.584 1
1 480 . 12 1 1 A 38 38 SER CB C 38 62.700 62.216 0.484 1
1 481 . 12 1 1 A 38 38 SER N N 38 115.800 114.768 1.032 1
1 482 . 12 1 1 A 39 39 ASN H H 39 8.190 8.028 0.162 1
1 483 . 12 1 1 A 39 39 ASN HA H 39 4.540 4.483 0.057 1
1 488 . 12 1 1 A 39 39 ASN C C 39 178.500 178.094 0.406 1
1 489 . 12 1 1 A 39 39 ASN CA C 39 56.200 56.260 -0.060 1
1 490 . 12 1 1 A 39 39 ASN CB C 39 37.900 38.015 -0.115 1
1 491 . 12 1 1 A 39 39 ASN N N 39 121.300 120.710 0.590 1
1 493 . 12 1 1 A 40 40 VAL H H 40 7.840 7.567 0.273 1
1 494 . 12 1 1 A 40 40 VAL HA H 40 3.650 3.582 0.068 1
1 502 . 12 1 1 A 40 40 VAL C C 40 179.000 178.297 0.703 1
1 503 . 12 1 1 A 40 40 VAL CA C 40 66.600 66.438 0.162 1
1 504 . 12 1 1 A 40 40 VAL CB C 40 32.100 31.332 0.768 1
1 507 . 12 1 1 A 40 40 VAL N N 40 121.800 120.738 1.062 1
1 508 . 12 1 1 A 41 41 LEU H H 41 8.210 8.156 0.054 1
1 509 . 12 1 1 A 41 41 LEU HA H 41 3.840 3.927 -0.087 1
1 519 . 12 1 1 A 41 41 LEU C C 41 178.800 178.733 0.067 1
1 520 . 12 1 1 A 41 41 LEU CA C 41 57.400 57.962 -0.562 1
1 521 . 12 1 1 A 41 41 LEU CB C 41 41.200 41.416 -0.216 1
1 525 . 12 1 1 A 41 41 LEU N N 41 117.700 119.950 -2.250 1
1 526 . 12 1 1 A 42 42 SER H H 42 7.980 8.072 -0.092 1
1 527 . 12 1 1 A 42 42 SER HA H 42 4.260 4.179 0.081 1
1 530 . 12 1 1 A 42 42 SER C C 42 174.900 176.709 -1.809 1
1 531 . 12 1 1 A 42 42 SER CA C 42 61.200 60.671 0.529 1
1 532 . 12 1 1 A 42 42 SER CB C 42 63.100 62.673 0.427 1
1 533 . 12 1 1 A 42 42 SER N N 42 113.200 114.175 -0.975 1
1 534 . 12 1 1 A 43 43 ARG H H 43 7.100 7.740 -0.640 1
1 535 . 12 1 1 A 43 43 ARG HA H 43 4.500 4.244 0.256 1
1 542 . 12 1 1 A 43 43 ARG C C 43 175.800 175.957 -0.157 1
1 543 . 12 1 1 A 43 43 ARG CA C 43 55.600 57.476 -1.876 1
1 544 . 12 1 1 A 43 43 ARG CB C 43 30.800 30.790 0.010 1
1 547 . 12 1 1 A 43 43 ARG N N 43 118.400 121.112 -2.712 1
1 548 . 12 1 1 A 44 44 LEU H H 44 7.610 7.735 -0.125 1
1 549 . 12 1 1 A 44 44 LEU HA H 44 4.590 4.837 -0.247 1
1 559 . 12 1 1 A 44 44 LEU C C 44 175.300 175.374 -0.074 1
1 560 . 12 1 1 A 44 44 LEU CA C 44 53.900 53.212 0.688 1
1 561 . 12 1 1 A 44 44 LEU CB C 44 44.100 43.819 0.281 1
1 565 . 12 1 1 A 44 44 LEU N N 44 120.400 121.190 -0.790 1
1 566 . 12 1 1 A 45 45 TYR H H 45 7.630 8.846 -1.216 1
1 567 . 12 1 1 A 45 45 TYR HA H 45 5.180 5.102 0.078 1
1 574 . 12 1 1 A 45 45 TYR C C 45 174.600 176.221 -1.621 1
1 575 . 12 1 1 A 45 45 TYR CA C 45 56.300 56.670 -0.370 1
1 576 . 12 1 1 A 45 45 TYR CB C 45 41.400 39.019 2.381 1
1 581 . 12 1 1 A 45 45 TYR N N 45 115.300 123.894 -8.594 1
1 582 . 12 1 1 A 46 46 VAL H H 46 8.770 8.721 0.049 1
1 583 . 12 1 1 A 46 46 VAL HA H 46 4.540 4.993 -0.453 1
1 591 . 12 1 1 A 46 46 VAL C C 46 174.600 175.422 -0.822 1
1 592 . 12 1 1 A 46 46 VAL CA C 46 59.600 60.099 -0.499 1
1 593 . 12 1 1 A 46 46 VAL CB C 46 34.700 33.886 0.814 1
1 596 . 12 1 1 A 46 46 VAL N N 46 115.400 119.581 -4.181 1
1 597 . 12 1 1 A 47 47 GLY H H 47 8.280 8.357 -0.077 1
1 598 . 12 1 1 A 47 47 GLY HA2 H 47 3.610 4.261 -0.651 1
1 599 . 12 1 1 A 47 47 GLY HA3 H 47 4.970 4.277 0.693 1
1 600 . 12 1 1 A 47 47 GLY C C 47 173.100 172.951 0.149 1
1 601 . 12 1 1 A 47 47 GLY CA C 47 43.600 45.989 -2.389 1
1 602 . 12 1 1 A 47 47 GLY N N 47 109.900 108.966 0.934 1
1 603 . 12 1 1 A 48 48 VAL H H 48 7.630 8.266 -0.636 1
1 604 . 12 1 1 A 48 48 VAL HA H 48 4.320 4.200 0.120 1
1 612 . 12 1 1 A 48 48 VAL CA C 48 58.700 63.072 -4.372 1
1 613 . 12 1 1 A 48 48 VAL CB C 48 32.100 30.764 1.336 1
1 616 . 12 1 1 A 48 48 VAL N N 48 109.900 119.095 -9.195 1
1 617 . 12 1 1 A 49 49 PRO HA H 49 4.800 4.406 0.394 1
1 624 . 12 1 1 A 49 49 PRO C C 49 176.700 175.927 0.773 1
1 625 . 12 1 1 A 49 49 PRO CA C 49 62.300 63.503 -1.203 1
1 626 . 12 1 1 A 49 49 PRO CB C 49 35.400 32.026 3.374 1
1 629 . 12 1 1 A 50 50 THR H H 50 8.790 8.523 0.267 1
1 630 . 12 1 1 A 50 50 THR HA H 50 4.690 5.113 -0.423 1
1 635 . 12 1 1 A 50 50 THR C C 50 173.500 173.867 -0.367 1
1 636 . 12 1 1 A 50 50 THR CA C 50 60.800 59.695 1.105 1
1 637 . 12 1 1 A 50 50 THR CB C 50 70.800 72.603 -1.803 1
1 639 . 12 1 1 A 50 50 THR N N 50 113.500 111.984 1.516 1
1 640 . 12 1 1 A 51 51 LYS H H 51 7.810 8.278 -0.468 1
1 641 . 12 1 1 A 51 51 LYS HA H 51 4.890 4.597 0.293 1
1 650 . 12 1 1 A 51 51 LYS C C 51 175.900 176.096 -0.196 1
1 651 . 12 1 1 A 51 51 LYS CA C 51 54.100 54.929 -0.829 1
1 652 . 12 1 1 A 51 51 LYS CB C 51 35.300 33.348 1.952 1
1 656 . 12 1 1 A 51 51 LYS N N 51 122.200 119.998 2.202 1
1 657 . 12 1 1 A 52 52 SER H H 52 8.410 8.522 -0.112 1
1 658 . 12 1 1 A 52 52 SER HA H 52 3.630 4.272 -0.642 1
1 661 . 12 1 1 A 52 52 SER C C 52 175.800 175.071 0.729 1
1 662 . 12 1 1 A 52 52 SER CA C 52 58.800 59.850 -1.050 1
1 663 . 12 1 1 A 52 52 SER CB C 52 62.600 62.668 -0.068 1
1 664 . 12 1 1 A 52 52 SER N N 52 118.900 115.369 3.531 1
1 665 . 12 1 1 A 53 53 GLY H H 53 9.070 9.421 -0.351 1
1 666 . 12 1 1 A 53 53 GLY HA2 H 53 3.390 3.974 -0.584 1
1 667 . 12 1 1 A 53 53 GLY HA3 H 53 4.460 3.974 0.486 1
1 668 . 12 1 1 A 53 53 GLY C C 53 174.100 174.398 -0.298 1
1 669 . 12 1 1 A 53 53 GLY CA C 53 44.800 45.474 -0.674 1
1 670 . 12 1 1 A 53 53 GLY N N 53 115.600 113.515 2.085 1
1 671 . 12 1 1 A 54 54 ASN H H 54 7.870 7.862 0.008 1
1 672 . 12 1 1 A 54 54 ASN HA H 54 4.570 4.828 -0.258 1
1 677 . 12 1 1 A 54 54 ASN C C 54 175.500 174.721 0.779 1
1 678 . 12 1 1 A 54 54 ASN CA C 54 53.000 52.422 0.578 1
1 679 . 12 1 1 A 54 54 ASN CB C 54 38.600 39.326 -0.726 1
1 680 . 12 1 1 A 54 54 ASN N N 54 119.600 118.950 0.650 1
1 682 . 12 1 1 A 55 55 VAL H H 55 8.770 8.900 -0.130 1
1 683 . 12 1 1 A 55 55 VAL HA H 55 3.880 4.192 -0.312 1
1 691 . 12 1 1 A 55 55 VAL C C 55 176.200 175.398 0.802 1
1 692 . 12 1 1 A 55 55 VAL CA C 55 63.700 63.337 0.363 1
1 693 . 12 1 1 A 55 55 VAL CB C 55 31.600 31.802 -0.202 1
1 696 . 12 1 1 A 55 55 VAL N N 55 123.900 123.517 0.383 1
1 697 . 12 1 1 A 56 56 VAL H H 56 9.050 9.331 -0.281 1
1 698 . 12 1 1 A 56 56 VAL HA H 56 3.990 4.034 -0.044 1
1 706 . 12 1 1 A 56 56 VAL C C 56 175.200 175.149 0.051 1
1 707 . 12 1 1 A 56 56 VAL CA C 56 62.700 64.189 -1.489 1
1 708 . 12 1 1 A 56 56 VAL CB C 56 32.900 31.855 1.045 1
1 711 . 12 1 1 A 56 56 VAL N N 56 127.500 127.459 0.041 1
1 712 . 12 1 1 A 57 57 CYS H H 57 7.250 8.219 -0.969 1
1 713 . 12 1 1 A 57 57 CYS HA H 57 4.370 4.804 -0.434 1
1 716 . 12 1 1 A 57 57 CYS C C 57 171.900 173.605 -1.705 1
1 717 . 12 1 1 A 57 57 CYS CA C 57 58.600 57.506 1.094 1
1 718 . 12 1 1 A 57 57 CYS CB C 57 28.600 28.817 -0.217 1
1 719 . 12 1 1 A 57 57 CYS N N 57 117.600 117.537 0.063 1
1 720 . 12 1 1 A 58 58 LYS H H 58 8.880 8.694 0.186 1
1 721 . 12 1 1 A 58 58 LYS HA H 58 4.220 4.234 -0.014 1
1 730 . 12 1 1 A 58 58 LYS C C 58 176.000 177.014 -1.014 1
1 731 . 12 1 1 A 58 58 LYS CA C 58 54.400 57.014 -2.614 1
1 732 . 12 1 1 A 58 58 LYS CB C 58 33.600 32.588 1.012 1
1 736 . 12 1 1 A 58 58 LYS N N 58 132.000 127.233 4.767 1
1 737 . 12 1 1 A 59 59 ASN H H 59 9.500 9.038 0.462 1
1 738 . 12 1 1 A 59 59 ASN HA H 59 4.040 4.525 -0.485 1
1 743 . 12 1 1 A 59 59 ASN C C 59 176.400 175.807 0.593 1
1 744 . 12 1 1 A 59 59 ASN CA C 59 53.200 54.017 -0.817 1
1 745 . 12 1 1 A 59 59 ASN CB C 59 35.900 37.598 -1.698 1
1 746 . 12 1 1 A 59 59 ASN N N 59 127.500 124.181 3.319 1
1 748 . 12 1 1 A 60 60 ILE H H 60 8.050 7.801 0.249 1
1 749 . 12 1 1 A 60 60 ILE HA H 60 3.680 3.808 -0.128 1
1 759 . 12 1 1 A 60 60 ILE C C 60 175.700 176.687 -0.987 1
1 760 . 12 1 1 A 60 60 ILE CA C 60 61.900 64.075 -2.175 1
1 761 . 12 1 1 A 60 60 ILE CB C 60 38.300 37.678 0.622 1
1 765 . 12 1 1 A 60 60 ILE N N 60 120.200 120.290 -0.090 1
1 766 . 12 1 1 A 61 61 MET H H 61 9.590 7.882 1.708 1
1 767 . 12 1 1 A 61 61 MET HA H 61 3.920 4.603 -0.683 1
1 775 . 12 1 1 A 61 61 MET C C 61 174.300 174.849 -0.549 1
1 776 . 12 1 1 A 61 61 MET CA C 61 57.000 55.023 1.977 1
1 777 . 12 1 1 A 61 61 MET CB C 61 31.300 32.392 -1.092 1
1 780 . 12 1 1 A 61 61 MET N N 61 124.400 117.955 6.445 1
1 781 . 12 1 1 A 62 62 ASN H H 62 8.250 8.084 0.166 1
1 782 . 12 1 1 A 62 62 ASN HA H 62 4.400 5.273 -0.873 1
1 787 . 12 1 1 A 62 62 ASN C C 62 176.800 175.276 1.524 1
1 788 . 12 1 1 A 62 62 ASN CA C 62 54.400 54.473 -0.073 1
1 789 . 12 1 1 A 62 62 ASN CB C 62 37.600 36.588 1.012 1
1 790 . 12 1 1 A 62 62 ASN N N 62 111.900 114.016 -2.116 1
1 792 . 12 1 1 A 63 63 THR H H 63 7.480 8.196 -0.716 1
1 793 . 12 1 1 A 63 63 THR HA H 63 4.210 4.378 -0.168 1
1 798 . 12 1 1 A 63 63 THR C C 63 177.100 176.362 0.738 1
1 799 . 12 1 1 A 63 63 THR CA C 63 62.900 62.713 0.187 1
1 800 . 12 1 1 A 63 63 THR CB C 63 72.500 70.528 1.972 1
1 802 . 12 1 1 A 63 63 THR N N 63 105.900 111.289 -5.389 1
1 803 . 12 1 1 A 64 64 GLY H H 64 9.110 8.300 0.810 1
1 804 . 12 1 1 A 64 64 GLY HA2 H 64 3.580 3.962 -0.382 1
1 805 . 12 1 1 A 64 64 GLY HA3 H 64 4.090 3.963 0.127 1
1 806 . 12 1 1 A 64 64 GLY C C 64 173.200 174.224 -1.024 1
1 807 . 12 1 1 A 64 64 GLY CA C 64 45.300 45.513 -0.213 1
1 808 . 12 1 1 A 64 64 GLY N N 64 111.500 111.536 -0.036 1
1 809 . 12 1 1 A 65 65 VAL H H 65 7.580 7.583 -0.003 1
1 810 . 12 1 1 A 65 65 VAL HA H 65 4.060 4.044 0.016 1
1 818 . 12 1 1 A 65 65 VAL C C 65 172.900 174.718 -1.818 1
1 819 . 12 1 1 A 65 65 VAL CA C 65 61.400 62.408 -1.008 1
1 820 . 12 1 1 A 65 65 VAL CB C 65 32.900 31.935 0.965 1
1 823 . 12 1 1 A 65 65 VAL N N 65 121.600 122.864 -1.264 1
1 824 . 12 1 1 A 66 66 ASP H H 66 8.210 8.786 -0.576 1
1 825 . 12 1 1 A 66 66 ASP HA H 66 5.320 4.915 0.405 1
1 828 . 12 1 1 A 66 66 ASP C C 66 174.800 175.053 -0.253 1
1 829 . 12 1 1 A 66 66 ASP CA C 66 51.700 53.394 -1.694 1
1 830 . 12 1 1 A 66 66 ASP CB C 66 43.200 41.580 1.620 1
1 831 . 12 1 1 A 66 66 ASP N N 66 123.100 127.823 -4.723 1
1 832 . 12 1 1 A 67 67 ILE H H 67 8.540 8.183 0.357 1
1 833 . 12 1 1 A 67 67 ILE HA H 67 4.630 4.377 0.253 1
1 843 . 12 1 1 A 67 67 ILE C C 67 175.600 175.963 -0.363 1
1 844 . 12 1 1 A 67 67 ILE CA C 67 56.900 61.527 -4.627 1
1 845 . 12 1 1 A 67 67 ILE CB C 67 35.300 37.346 -2.046 1
1 849 . 12 1 1 A 67 67 ILE N N 67 119.200 125.740 -6.540 1
1 850 . 12 1 1 A 68 68 ILE H H 68 9.420 9.358 0.062 1
1 851 . 12 1 1 A 68 68 ILE HA H 68 4.980 5.616 -0.636 1
1 861 . 12 1 1 A 68 68 ILE C C 68 175.000 174.148 0.852 1
1 862 . 12 1 1 A 68 68 ILE CA C 68 58.600 58.908 -0.308 1
1 863 . 12 1 1 A 68 68 ILE CB C 68 40.900 41.095 -0.195 1
1 867 . 12 1 1 A 68 68 ILE N N 68 125.000 123.156 1.844 1
1 868 . 12 1 1 A 69 69 CYS H H 69 8.870 8.949 -0.079 1
1 869 . 12 1 1 A 69 69 CYS HA H 69 4.610 4.788 -0.178 1
1 872 . 12 1 1 A 69 69 CYS C C 69 176.200 174.707 1.493 1
1 873 . 12 1 1 A 69 69 CYS CA C 69 58.900 58.634 0.266 1
1 874 . 12 1 1 A 69 69 CYS CB C 69 27.100 28.041 -0.941 1
1 875 . 12 1 1 A 69 69 CYS N N 69 122.300 124.013 -1.713 1
1 876 . 12 1 1 A 70 70 THR H H 70 8.270 8.345 -0.075 1
1 877 . 12 1 1 A 70 70 THR HA H 70 4.710 4.511 0.199 1
1 882 . 12 1 1 A 70 70 THR C C 70 173.600 173.868 -0.268 1
1 883 . 12 1 1 A 70 70 THR CA C 70 61.500 62.279 -0.779 1
1 884 . 12 1 1 A 70 70 THR CB C 70 68.100 69.321 -1.221 1
1 886 . 12 1 1 A 70 70 THR N N 70 116.700 119.534 -2.834 1
1 887 . 12 1 1 A 71 71 LYS H H 71 7.370 7.511 -0.141 1
1 888 . 12 1 1 A 71 71 LYS HA H 71 4.520 4.652 -0.132 1
1 897 . 12 1 1 A 71 71 LYS CA C 71 55.100 54.918 0.182 1
1 898 . 12 1 1 A 71 71 LYS CB C 71 37.800 34.165 3.635 1
1 902 . 12 1 1 A 71 71 LYS N N 71 120.900 122.788 -1.888 1
1 903 . 12 1 1 A 72 72 ASN H H 72 8.580 8.680 -0.100 1
1 904 . 12 1 1 A 72 72 ASN HA H 72 4.620 5.322 -0.702 1
1 909 . 12 1 1 A 72 72 ASN C C 72 173.500 174.814 -1.314 1
1 910 . 12 1 1 A 72 72 ASN CA C 72 52.200 53.014 -0.814 1
1 911 . 12 1 1 A 72 72 ASN CB C 72 38.500 39.373 -0.873 1
1 912 . 12 1 1 A 72 72 ASN N N 72 122.700 124.380 -1.680 1
1 914 . 12 1 1 A 73 73 LEU H H 73 8.100 8.912 -0.812 1
1 915 . 12 1 1 A 73 73 LEU HA H 73 4.680 5.024 -0.344 1
1 925 . 12 1 1 A 73 73 LEU CA C 73 51.000 51.440 -0.440 1
1 926 . 12 1 1 A 73 73 LEU CB C 73 42.500 42.575 -0.075 1
1 930 . 12 1 1 A 73 73 LEU N N 73 125.100 126.551 -1.451 1
1 931 . 12 1 1 A 74 74 PRO HA H 74 4.670 4.973 -0.303 1
1 938 . 12 1 1 A 74 74 PRO C C 74 176.500 175.979 0.521 1
1 939 . 12 1 1 A 74 74 PRO CA C 74 61.800 62.380 -0.580 1
1 940 . 12 1 1 A 74 74 PRO CB C 74 32.800 32.436 0.364 1
1 943 . 12 1 1 A 75 75 LYS H H 75 8.280 8.579 -0.299 1
1 944 . 12 1 1 A 75 75 LYS HA H 75 4.110 4.795 -0.685 1
1 953 . 12 1 1 A 75 75 LYS CA C 75 56.500 54.634 1.866 1
1 954 . 12 1 1 A 75 75 LYS CB C 75 33.300 36.209 -2.909 1
1 958 . 12 1 1 A 75 75 LYS N N 75 117.000 120.797 -3.797 1
1 959 . 12 1 1 A 76 76 ASP H H 76 8.570 8.643 -0.073 1
1 960 . 12 1 1 A 76 76 ASP HA H 76 4.530 4.480 0.050 1
1 963 . 12 1 1 A 76 76 ASP C C 76 176.300 175.801 0.499 1
1 964 . 12 1 1 A 76 76 ASP CA C 76 55.000 55.004 -0.004 1
1 965 . 12 1 1 A 76 76 ASP CB C 76 41.100 40.481 0.619 1
1 966 . 12 1 1 A 76 76 ASP N N 76 122.700 123.491 -0.791 1
1 967 . 12 1 1 A 77 77 SER H H 77 8.330 8.678 -0.348 1
1 968 . 12 1 1 A 77 77 SER HA H 77 4.410 4.850 -0.440 1
1 971 . 12 1 1 A 77 77 SER C C 77 174.300 174.356 -0.056 1
1 972 . 12 1 1 A 77 77 SER CA C 77 58.000 57.208 0.792 1
1 973 . 12 1 1 A 77 77 SER CB C 77 63.900 64.607 -0.707 1
1 974 . 12 1 1 A 77 77 SER N N 77 116.100 121.477 -5.377 1
1 975 . 12 1 1 A 78 78 LEU H H 78 8.350 8.876 -0.526 1
1 976 . 12 1 1 A 78 78 LEU HA H 78 4.280 4.035 0.245 1
1 986 . 12 1 1 A 78 78 LEU C C 78 177.200 176.137 1.063 1
1 987 . 12 1 1 A 78 78 LEU CA C 78 55.200 55.651 -0.451 1
1 988 . 12 1 1 A 78 78 LEU CB C 78 42.100 40.721 1.379 1
1 992 . 12 1 1 A 78 78 LEU N N 78 124.300 126.272 -1.972 1
1 993 . 12 1 1 A 79 79 GLU H H 79 8.300 8.868 -0.568 1
1 994 . 12 1 1 A 79 79 GLU CA C 79 56.400 55.740 0.660 1
1 995 . 12 1 1 A 79 79 GLU CB C 79 30.200 28.030 2.170 1
1 1 . 13 1 1 A 2 2 HIS HA H 2 4.640 4.149 0.491 1
1 4 . 13 1 1 A 2 2 HIS C C 2 173.600 174.476 -0.876 1
1 5 . 13 1 1 A 2 2 HIS CA C 2 56.500 56.242 0.258 1
1 6 . 13 1 1 A 2 2 HIS CB C 2 31.000 27.833 3.167 1
1 7 . 13 1 1 A 3 3 LYS H H 3 8.160 8.259 -0.099 1
1 8 . 13 1 1 A 3 3 LYS HA H 3 4.660 4.261 0.399 1
1 17 . 13 1 1 A 3 3 LYS C C 3 174.400 175.082 -0.682 1
1 18 . 13 1 1 A 3 3 LYS CA C 3 54.800 56.873 -2.073 1
1 19 . 13 1 1 A 3 3 LYS CB C 3 35.800 33.517 2.283 1
1 23 . 13 1 1 A 3 3 LYS N N 3 121.900 119.243 2.657 1
1 24 . 13 1 1 A 4 4 ASP H H 4 8.470 8.857 -0.387 1
1 25 . 13 1 1 A 4 4 ASP HA H 4 4.900 5.158 -0.258 1
1 28 . 13 1 1 A 4 4 ASP C C 4 176.900 174.590 2.310 1
1 29 . 13 1 1 A 4 4 ASP CA C 4 52.700 52.867 -0.167 1
1 30 . 13 1 1 A 4 4 ASP CB C 4 44.100 44.900 -0.800 1
1 31 . 13 1 1 A 4 4 ASP N N 4 117.900 121.546 -3.646 1
1 32 . 13 1 1 A 5 5 ILE H H 5 9.570 8.789 0.781 1
1 33 . 13 1 1 A 5 5 ILE HA H 5 3.640 4.214 -0.574 1
1 43 . 13 1 1 A 5 5 ILE C C 5 174.800 176.196 -1.396 1
1 44 . 13 1 1 A 5 5 ILE CA C 5 60.900 61.503 -0.603 1
1 45 . 13 1 1 A 5 5 ILE CB C 5 37.000 37.308 -0.308 1
1 49 . 13 1 1 A 5 5 ILE N N 5 124.400 123.459 0.941 1
1 50 . 13 1 1 A 6 6 PHE H H 6 7.790 9.128 -1.338 1
1 51 . 13 1 1 A 6 6 PHE HA H 6 3.160 4.826 -1.666 1
1 58 . 13 1 1 A 6 6 PHE C C 6 173.500 174.444 -0.944 1
1 59 . 13 1 1 A 6 6 PHE CA C 6 56.900 57.724 -0.824 1
1 60 . 13 1 1 A 6 6 PHE CB C 6 40.100 39.066 1.034 1
1 65 . 13 1 1 A 6 6 PHE N N 6 130.200 129.013 1.187 1
1 66 . 13 1 1 A 7 7 THR H H 7 6.790 8.838 -2.048 1
1 67 . 13 1 1 A 7 7 THR HA H 7 4.530 5.245 -0.715 1
1 72 . 13 1 1 A 7 7 THR C C 7 172.300 172.773 -0.473 1
1 73 . 13 1 1 A 7 7 THR CA C 7 59.200 61.243 -2.043 1
1 74 . 13 1 1 A 7 7 THR CB C 7 71.000 70.193 0.807 1
1 76 . 13 1 1 A 7 7 THR N N 7 117.900 123.647 -5.747 1
1 77 . 13 1 1 A 8 8 SER H H 8 7.600 8.516 -0.916 1
1 78 . 13 1 1 A 8 8 SER HA H 8 4.180 4.759 -0.579 1
1 81 . 13 1 1 A 8 8 SER C C 8 175.300 171.979 3.321 1
1 82 . 13 1 1 A 8 8 SER CA C 8 55.800 56.905 -1.105 1
1 83 . 13 1 1 A 8 8 SER CB C 8 64.000 66.314 -2.314 1
1 84 . 13 1 1 A 8 8 SER N N 8 113.400 119.992 -6.592 1
1 85 . 13 1 1 A 9 9 VAL H H 9 8.880 8.562 0.318 1
1 86 . 13 1 1 A 9 9 VAL HA H 9 5.220 4.895 0.325 1
1 94 . 13 1 1 A 9 9 VAL C C 9 174.000 172.901 1.099 1
1 95 . 13 1 1 A 9 9 VAL CA C 9 59.100 59.681 -0.581 1
1 96 . 13 1 1 A 9 9 VAL CB C 9 36.500 35.411 1.089 1
1 99 . 13 1 1 A 9 9 VAL N N 9 114.700 120.815 -6.115 1
1 100 . 13 1 1 A 10 10 VAL H H 10 8.510 9.121 -0.611 1
1 101 . 13 1 1 A 10 10 VAL HA H 10 4.470 4.776 -0.306 1
1 109 . 13 1 1 A 10 10 VAL C C 10 173.700 174.645 -0.945 1
1 110 . 13 1 1 A 10 10 VAL CA C 10 59.400 59.652 -0.252 1
1 111 . 13 1 1 A 10 10 VAL CB C 10 36.000 34.295 1.705 1
1 114 . 13 1 1 A 10 10 VAL N N 10 117.100 127.295 -10.195 1
1 115 . 13 1 1 A 11 11 ARG H H 11 8.500 8.077 0.423 1
1 116 . 13 1 1 A 11 11 ARG HA H 11 4.460 4.532 -0.072 1
1 123 . 13 1 1 A 11 11 ARG C C 11 174.500 175.716 -1.216 1
1 124 . 13 1 1 A 11 11 ARG CA C 11 57.400 55.790 1.610 1
1 125 . 13 1 1 A 11 11 ARG CB C 11 31.000 30.596 0.404 1
1 128 . 13 1 1 A 11 11 ARG N N 11 124.800 126.867 -2.067 1
1 129 . 13 1 1 A 12 12 VAL H H 12 7.650 8.830 -1.180 1
1 130 . 13 1 1 A 12 12 VAL HA H 12 4.970 5.334 -0.364 1
1 138 . 13 1 1 A 12 12 VAL C C 12 176.700 174.027 2.673 1
1 139 . 13 1 1 A 12 12 VAL CA C 12 59.400 60.639 -1.239 1
1 140 . 13 1 1 A 12 12 VAL CB C 12 34.400 34.932 -0.532 1
1 143 . 13 1 1 A 12 12 VAL N N 12 120.900 123.568 -2.668 1
1 144 . 13 1 1 A 13 13 ARG H H 13 9.020 9.092 -0.072 1
1 145 . 13 1 1 A 13 13 ARG HA H 13 4.700 5.113 -0.413 1
1 152 . 13 1 1 A 13 13 ARG C C 13 176.000 175.870 0.130 1
1 153 . 13 1 1 A 13 13 ARG CA C 13 54.600 54.227 0.373 1
1 154 . 13 1 1 A 13 13 ARG CB C 13 32.900 33.249 -0.349 1
1 157 . 13 1 1 A 13 13 ARG N N 13 127.500 126.415 1.085 1
1 158 . 13 1 1 A 14 14 GLY H H 14 8.640 8.858 -0.218 1
1 159 . 13 1 1 A 14 14 GLY HA2 H 14 3.680 3.949 -0.269 1
1 160 . 13 1 1 A 14 14 GLY HA3 H 14 4.190 3.958 0.232 1
1 161 . 13 1 1 A 14 14 GLY C C 14 173.700 174.598 -0.898 1
1 162 . 13 1 1 A 14 14 GLY CA C 14 45.600 47.566 -1.966 1
1 163 . 13 1 1 A 14 14 GLY N N 14 108.800 113.293 -4.493 1
1 164 . 13 1 1 A 15 15 SER H H 15 8.220 9.021 -0.801 1
1 165 . 13 1 1 A 15 15 SER HA H 15 5.020 4.589 0.431 1
1 168 . 13 1 1 A 15 15 SER C C 15 175.400 173.956 1.444 1
1 169 . 13 1 1 A 15 15 SER CA C 15 55.300 58.709 -3.409 1
1 170 . 13 1 1 A 15 15 SER CB C 15 64.900 63.742 1.158 1
1 171 . 13 1 1 A 15 15 SER N N 15 113.200 117.479 -4.279 1
1 172 . 13 1 1 A 16 16 LYS H H 16 9.930 7.757 2.173 1
1 173 . 13 1 1 A 16 16 LYS HA H 16 4.190 4.639 -0.449 1
1 182 . 13 1 1 A 16 16 LYS C C 16 176.500 173.997 2.503 1
1 183 . 13 1 1 A 16 16 LYS CA C 16 57.300 54.940 2.360 1
1 184 . 13 1 1 A 16 16 LYS CB C 16 32.300 34.118 -1.818 1
1 188 . 13 1 1 A 16 16 LYS N N 16 129.200 116.651 12.549 1
1 189 . 13 1 1 A 17 17 LYS H H 17 7.960 8.372 -0.412 1
1 190 . 13 1 1 A 17 17 LYS HA H 17 4.030 4.629 -0.599 1
1 199 . 13 1 1 A 17 17 LYS C C 17 175.600 174.877 0.723 1
1 200 . 13 1 1 A 17 17 LYS CA C 17 56.900 55.380 1.520 1
1 201 . 13 1 1 A 17 17 LYS CB C 17 34.700 31.294 3.406 1
1 205 . 13 1 1 A 17 17 LYS N N 17 118.500 121.993 -3.493 1
1 206 . 13 1 1 A 18 18 TYR H H 18 7.780 7.915 -0.135 1
1 207 . 13 1 1 A 18 18 TYR HA H 18 4.760 4.945 -0.185 1
1 214 . 13 1 1 A 18 18 TYR C C 18 174.000 174.574 -0.574 1
1 215 . 13 1 1 A 18 18 TYR CA C 18 56.800 58.338 -1.538 1
1 216 . 13 1 1 A 18 18 TYR CB C 18 41.100 41.426 -0.326 1
1 221 . 13 1 1 A 18 18 TYR N N 18 117.100 125.706 -8.606 1
1 222 . 13 1 1 A 19 19 ASN H H 19 8.890 9.011 -0.121 1
1 223 . 13 1 1 A 19 19 ASN HA H 19 4.960 4.910 0.050 1
1 228 . 13 1 1 A 19 19 ASN C C 19 176.100 175.365 0.735 1
1 229 . 13 1 1 A 19 19 ASN CA C 19 53.600 55.117 -1.517 1
1 230 . 13 1 1 A 19 19 ASN CB C 19 40.300 41.005 -0.705 1
1 231 . 13 1 1 A 19 19 ASN N N 19 116.600 121.299 -4.699 1
1 233 . 13 1 1 A 20 20 VAL H H 20 7.730 7.133 0.597 1
1 234 . 13 1 1 A 20 20 VAL HA H 20 5.250 4.636 0.614 1
1 242 . 13 1 1 A 20 20 VAL C C 20 173.800 174.076 -0.276 1
1 243 . 13 1 1 A 20 20 VAL CA C 20 59.400 58.862 0.538 1
1 244 . 13 1 1 A 20 20 VAL CB C 20 37.600 35.651 1.949 1
1 247 . 13 1 1 A 20 20 VAL N N 20 113.900 112.215 1.685 1
1 248 . 13 1 1 A 21 21 VAL H H 21 8.890 8.187 0.703 1
1 249 . 13 1 1 A 21 21 VAL HA H 21 4.840 4.538 0.302 1
1 257 . 13 1 1 A 21 21 VAL CA C 21 56.800 57.774 -0.974 1
1 258 . 13 1 1 A 21 21 VAL CB C 21 36.000 35.423 0.577 1
1 261 . 13 1 1 A 21 21 VAL N N 21 118.500 121.492 -2.992 1
1 262 . 13 1 1 A 22 22 PRO HA H 22 4.940 5.208 -0.268 1
1 269 . 13 1 1 A 22 22 PRO C C 22 175.600 176.402 -0.802 1
1 270 . 13 1 1 A 22 22 PRO CA C 22 62.700 62.225 0.475 1
1 271 . 13 1 1 A 22 22 PRO CB C 22 31.800 32.528 -0.728 1
1 274 . 13 1 1 A 23 23 VAL H H 23 8.060 8.737 -0.677 1
1 275 . 13 1 1 A 23 23 VAL HA H 23 5.390 5.069 0.321 1
1 283 . 13 1 1 A 23 23 VAL C C 23 175.400 173.965 1.435 1
1 284 . 13 1 1 A 23 23 VAL CA C 23 57.800 59.295 -1.495 1
1 285 . 13 1 1 A 23 23 VAL CB C 23 36.300 36.187 0.113 1
1 288 . 13 1 1 A 23 23 VAL N N 23 110.900 116.159 -5.259 1
1 289 . 13 1 1 A 24 24 LYS H H 24 8.960 9.315 -0.355 1
1 290 . 13 1 1 A 24 24 LYS HA H 24 5.600 5.701 -0.101 1
1 299 . 13 1 1 A 24 24 LYS C C 24 175.600 174.613 0.987 1
1 300 . 13 1 1 A 24 24 LYS CA C 24 54.200 54.112 0.088 1
1 301 . 13 1 1 A 24 24 LYS CB C 24 37.000 36.377 0.623 1
1 305 . 13 1 1 A 24 24 LYS N N 24 117.900 120.641 -2.741 1
1 306 . 13 1 1 A 25 25 SER H H 25 8.950 8.408 0.542 1
1 307 . 13 1 1 A 25 25 SER HA H 25 5.190 5.079 0.111 1
1 310 . 13 1 1 A 25 25 SER C C 25 173.800 176.088 -2.288 1
1 311 . 13 1 1 A 25 25 SER CA C 25 57.700 55.982 1.718 1
1 312 . 13 1 1 A 25 25 SER CB C 25 65.100 65.577 -0.477 1
1 313 . 13 1 1 A 25 25 SER N N 25 114.600 113.683 0.917 1
1 314 . 13 1 1 A 26 26 ASN H H 26 9.020 9.006 0.014 1
1 315 . 13 1 1 A 26 26 ASN HA H 26 4.370 4.593 -0.223 1
1 320 . 13 1 1 A 26 26 ASN C C 26 173.500 175.311 -1.811 1
1 321 . 13 1 1 A 26 26 ASN CA C 26 53.700 54.755 -1.055 1
1 322 . 13 1 1 A 26 26 ASN CB C 26 37.100 38.224 -1.124 1
1 323 . 13 1 1 A 26 26 ASN N N 26 118.300 119.571 -1.271 1
1 325 . 13 1 1 A 27 27 LYS H H 27 7.400 7.935 -0.535 1
1 326 . 13 1 1 A 27 27 LYS HA H 27 4.780 4.752 0.028 1
1 335 . 13 1 1 A 27 27 LYS CA C 27 53.500 52.919 0.581 1
1 336 . 13 1 1 A 27 27 LYS CB C 27 34.100 33.641 0.459 1
1 340 . 13 1 1 A 27 27 LYS N N 27 116.600 119.255 -2.655 1
1 341 . 13 1 1 A 28 28 PRO HA H 28 4.040 4.749 -0.709 1
1 348 . 13 1 1 A 28 28 PRO C C 28 174.500 175.802 -1.302 1
1 349 . 13 1 1 A 28 28 PRO CA C 28 63.200 63.199 0.001 1
1 350 . 13 1 1 A 28 28 PRO CB C 28 32.500 31.830 0.670 1
1 353 . 13 1 1 A 29 29 VAL H H 29 8.860 8.675 0.185 1
1 354 . 13 1 1 A 29 29 VAL HA H 29 4.420 4.719 -0.299 1
1 362 . 13 1 1 A 29 29 VAL C C 29 174.800 175.165 -0.365 1
1 363 . 13 1 1 A 29 29 VAL CA C 29 60.300 59.724 0.576 1
1 364 . 13 1 1 A 29 29 VAL CB C 29 36.400 34.769 1.631 1
1 367 . 13 1 1 A 29 29 VAL N N 29 119.800 122.550 -2.750 1
1 368 . 13 1 1 A 30 30 GLU H H 30 9.550 8.621 0.929 1
1 369 . 13 1 1 A 30 30 GLU HA H 30 4.260 4.288 -0.028 1
1 374 . 13 1 1 A 30 30 GLU C C 30 177.800 178.226 -0.426 1
1 375 . 13 1 1 A 30 30 GLU CA C 30 58.000 57.525 0.475 1
1 376 . 13 1 1 A 30 30 GLU CB C 30 29.700 29.789 -0.089 1
1 378 . 13 1 1 A 30 30 GLU N N 30 128.900 125.487 3.413 1
1 379 . 13 1 1 A 31 31 ILE H H 31 7.910 8.560 -0.650 1
1 380 . 13 1 1 A 31 31 ILE HA H 31 2.120 3.940 -1.820 1
1 390 . 13 1 1 A 31 31 ILE C C 31 178.000 177.663 0.337 1
1 391 . 13 1 1 A 31 31 ILE CA C 31 63.500 63.235 0.265 1
1 392 . 13 1 1 A 31 31 ILE CB C 31 37.200 37.684 -0.484 1
1 396 . 13 1 1 A 31 31 ILE N N 31 122.500 125.032 -2.532 1
1 397 . 13 1 1 A 32 32 SER H H 32 7.940 8.139 -0.199 1
1 398 . 13 1 1 A 32 32 SER HA H 32 4.070 4.189 -0.119 1
1 401 . 13 1 1 A 32 32 SER C C 32 175.800 175.304 0.496 1
1 402 . 13 1 1 A 32 32 SER CA C 32 60.200 61.927 -1.727 1
1 403 . 13 1 1 A 32 32 SER CB C 32 62.100 63.089 -0.989 1
1 404 . 13 1 1 A 32 32 SER N N 32 115.300 118.001 -2.701 1
1 405 . 13 1 1 A 33 33 LYS H H 33 7.640 7.627 0.013 1
1 406 . 13 1 1 A 33 33 LYS HA H 33 4.400 4.305 0.095 1
1 415 . 13 1 1 A 33 33 LYS C C 33 176.600 176.699 -0.099 1
1 416 . 13 1 1 A 33 33 LYS CA C 33 56.200 55.679 0.521 1
1 417 . 13 1 1 A 33 33 LYS CB C 33 32.700 31.965 0.735 1
1 421 . 13 1 1 A 33 33 LYS N N 33 119.800 117.901 1.899 1
1 422 . 13 1 1 A 34 34 TRP H H 34 7.860 7.575 0.285 1
1 423 . 13 1 1 A 34 34 TRP HA H 34 3.870 4.468 -0.598 1
1 426 . 13 1 1 A 34 34 TRP C C 34 178.600 178.087 0.513 1
1 427 . 13 1 1 A 34 34 TRP CA C 34 60.200 61.095 -0.895 1
1 428 . 13 1 1 A 34 34 TRP CB C 34 28.500 29.898 -1.398 1
1 429 . 13 1 1 A 34 34 TRP N N 34 120.000 121.870 -1.870 1
1 430 . 13 1 1 A 35 35 ILE H H 35 8.200 8.209 -0.009 1
1 431 . 13 1 1 A 35 35 ILE HA H 35 3.990 3.880 0.110 1
1 441 . 13 1 1 A 35 35 ILE C C 35 177.900 177.810 0.090 1
1 442 . 13 1 1 A 35 35 ILE CA C 35 64.300 65.050 -0.750 1
1 443 . 13 1 1 A 35 35 ILE CB C 35 37.200 37.359 -0.159 1
1 447 . 13 1 1 A 35 35 ILE N N 35 119.500 120.120 -0.620 1
1 448 . 13 1 1 A 36 36 ASP H H 36 7.680 8.200 -0.520 1
1 449 . 13 1 1 A 36 36 ASP HA H 36 4.490 4.201 0.289 1
1 452 . 13 1 1 A 36 36 ASP C C 36 179.200 178.997 0.203 1
1 453 . 13 1 1 A 36 36 ASP CA C 36 57.500 57.380 0.120 1
1 454 . 13 1 1 A 36 36 ASP CB C 36 40.400 40.208 0.192 1
1 455 . 13 1 1 A 36 36 ASP N N 36 122.000 120.562 1.438 1
1 456 . 13 1 1 A 37 37 PHE H H 37 8.450 7.761 0.689 1
1 457 . 13 1 1 A 37 37 PHE HA H 37 4.080 4.026 0.054 1
1 465 . 13 1 1 A 37 37 PHE C C 37 178.300 179.261 -0.961 1
1 466 . 13 1 1 A 37 37 PHE CA C 37 58.600 60.104 -1.504 1
1 467 . 13 1 1 A 37 37 PHE CB C 37 37.000 37.281 -0.281 1
1 473 . 13 1 1 A 37 37 PHE N N 37 119.800 118.893 0.907 1
1 474 . 13 1 1 A 38 38 SER H H 38 8.580 8.231 0.349 1
1 475 . 13 1 1 A 38 38 SER HA H 38 4.250 4.328 -0.078 1
1 478 . 13 1 1 A 38 38 SER C C 38 176.800 177.109 -0.309 1
1 479 . 13 1 1 A 38 38 SER CA C 38 62.700 61.404 1.296 1
1 480 . 13 1 1 A 38 38 SER CB C 38 62.700 62.586 0.114 1
1 481 . 13 1 1 A 38 38 SER N N 38 115.800 116.997 -1.197 1
1 482 . 13 1 1 A 39 39 ASN H H 39 8.190 8.249 -0.059 1
1 483 . 13 1 1 A 39 39 ASN HA H 39 4.540 4.538 0.002 1
1 488 . 13 1 1 A 39 39 ASN C C 39 178.500 177.037 1.463 1
1 489 . 13 1 1 A 39 39 ASN CA C 39 56.200 56.234 -0.034 1
1 490 . 13 1 1 A 39 39 ASN CB C 39 37.900 39.247 -1.347 1
1 491 . 13 1 1 A 39 39 ASN N N 39 121.300 120.544 0.756 1
1 493 . 13 1 1 A 40 40 VAL H H 40 7.840 7.442 0.398 1
1 494 . 13 1 1 A 40 40 VAL HA H 40 3.650 3.747 -0.097 1
1 502 . 13 1 1 A 40 40 VAL C C 40 179.000 178.082 0.918 1
1 503 . 13 1 1 A 40 40 VAL CA C 40 66.600 66.380 0.220 1
1 504 . 13 1 1 A 40 40 VAL CB C 40 32.100 31.686 0.414 1
1 507 . 13 1 1 A 40 40 VAL N N 40 121.800 119.161 2.639 1
1 508 . 13 1 1 A 41 41 LEU H H 41 8.210 8.405 -0.195 1
1 509 . 13 1 1 A 41 41 LEU HA H 41 3.840 4.062 -0.222 1
1 519 . 13 1 1 A 41 41 LEU C C 41 178.800 178.543 0.257 1
1 520 . 13 1 1 A 41 41 LEU CA C 41 57.400 57.239 0.161 1
1 521 . 13 1 1 A 41 41 LEU CB C 41 41.200 41.101 0.099 1
1 525 . 13 1 1 A 41 41 LEU N N 41 117.700 119.022 -1.322 1
1 526 . 13 1 1 A 42 42 SER H H 42 7.980 7.771 0.209 1
1 527 . 13 1 1 A 42 42 SER HA H 42 4.260 4.247 0.013 1
1 530 . 13 1 1 A 42 42 SER C C 42 174.900 175.788 -0.888 1
1 531 . 13 1 1 A 42 42 SER CA C 42 61.200 60.266 0.934 1
1 532 . 13 1 1 A 42 42 SER CB C 42 63.100 63.432 -0.332 1
1 533 . 13 1 1 A 42 42 SER N N 42 113.200 112.885 0.315 1
1 534 . 13 1 1 A 43 43 ARG H H 43 7.100 7.965 -0.865 1
1 535 . 13 1 1 A 43 43 ARG HA H 43 4.500 4.386 0.114 1
1 542 . 13 1 1 A 43 43 ARG C C 43 175.800 175.974 -0.174 1
1 543 . 13 1 1 A 43 43 ARG CA C 43 55.600 57.294 -1.694 1
1 544 . 13 1 1 A 43 43 ARG CB C 43 30.800 30.546 0.254 1
1 547 . 13 1 1 A 43 43 ARG N N 43 118.400 120.241 -1.841 1
1 548 . 13 1 1 A 44 44 LEU H H 44 7.610 7.129 0.481 1
1 549 . 13 1 1 A 44 44 LEU HA H 44 4.590 4.717 -0.127 1
1 559 . 13 1 1 A 44 44 LEU C C 44 175.300 174.844 0.456 1
1 560 . 13 1 1 A 44 44 LEU CA C 44 53.900 54.372 -0.472 1
1 561 . 13 1 1 A 44 44 LEU CB C 44 44.100 44.083 0.017 1
1 565 . 13 1 1 A 44 44 LEU N N 44 120.400 120.563 -0.163 1
1 566 . 13 1 1 A 45 45 TYR H H 45 7.630 9.260 -1.630 1
1 567 . 13 1 1 A 45 45 TYR HA H 45 5.180 5.378 -0.198 1
1 574 . 13 1 1 A 45 45 TYR C C 45 174.600 175.369 -0.769 1
1 575 . 13 1 1 A 45 45 TYR CA C 45 56.300 56.366 -0.066 1
1 576 . 13 1 1 A 45 45 TYR CB C 45 41.400 39.935 1.465 1
1 581 . 13 1 1 A 45 45 TYR N N 45 115.300 125.726 -10.426 1
1 582 . 13 1 1 A 46 46 VAL H H 46 8.770 8.678 0.092 1
1 583 . 13 1 1 A 46 46 VAL HA H 46 4.540 4.887 -0.347 1
1 591 . 13 1 1 A 46 46 VAL C C 46 174.600 176.124 -1.524 1
1 592 . 13 1 1 A 46 46 VAL CA C 46 59.600 59.966 -0.366 1
1 593 . 13 1 1 A 46 46 VAL CB C 46 34.700 34.179 0.521 1
1 596 . 13 1 1 A 46 46 VAL N N 46 115.400 119.255 -3.855 1
1 597 . 13 1 1 A 47 47 GLY H H 47 8.280 8.574 -0.294 1
1 598 . 13 1 1 A 47 47 GLY HA2 H 47 3.610 4.082 -0.472 1
1 599 . 13 1 1 A 47 47 GLY HA3 H 47 4.970 4.083 0.887 1
1 600 . 13 1 1 A 47 47 GLY C C 47 173.100 174.598 -1.498 1
1 601 . 13 1 1 A 47 47 GLY CA C 47 43.600 45.273 -1.673 1
1 602 . 13 1 1 A 47 47 GLY N N 47 109.900 111.258 -1.358 1
1 603 . 13 1 1 A 48 48 VAL H H 48 7.630 7.547 0.083 1
1 604 . 13 1 1 A 48 48 VAL HA H 48 4.320 4.230 0.090 1
1 612 . 13 1 1 A 48 48 VAL CA C 48 58.700 61.017 -2.317 1
1 613 . 13 1 1 A 48 48 VAL CB C 48 32.100 31.840 0.260 1
1 616 . 13 1 1 A 48 48 VAL N N 48 109.900 118.054 -8.154 1
1 617 . 13 1 1 A 49 49 PRO HA H 49 4.800 4.737 0.063 1
1 624 . 13 1 1 A 49 49 PRO C C 49 176.700 175.598 1.102 1
1 625 . 13 1 1 A 49 49 PRO CA C 49 62.300 62.461 -0.161 1
1 626 . 13 1 1 A 49 49 PRO CB C 49 35.400 29.421 5.979 1
1 629 . 13 1 1 A 50 50 THR H H 50 8.790 8.015 0.775 1
1 630 . 13 1 1 A 50 50 THR HA H 50 4.690 4.586 0.104 1
1 635 . 13 1 1 A 50 50 THR C C 50 173.500 174.244 -0.744 1
1 636 . 13 1 1 A 50 50 THR CA C 50 60.800 60.608 0.192 1
1 637 . 13 1 1 A 50 50 THR CB C 50 70.800 71.398 -0.598 1
1 639 . 13 1 1 A 50 50 THR N N 50 113.500 113.735 -0.235 1
1 640 . 13 1 1 A 51 51 LYS H H 51 7.810 8.480 -0.670 1
1 641 . 13 1 1 A 51 51 LYS HA H 51 4.890 4.556 0.334 1
1 650 . 13 1 1 A 51 51 LYS C C 51 175.900 175.980 -0.080 1
1 651 . 13 1 1 A 51 51 LYS CA C 51 54.100 54.402 -0.302 1
1 652 . 13 1 1 A 51 51 LYS CB C 51 35.300 34.293 1.007 1
1 656 . 13 1 1 A 51 51 LYS N N 51 122.200 120.550 1.650 1
1 657 . 13 1 1 A 52 52 SER H H 52 8.410 8.555 -0.145 1
1 658 . 13 1 1 A 52 52 SER HA H 52 3.630 4.156 -0.526 1
1 661 . 13 1 1 A 52 52 SER C C 52 175.800 175.532 0.268 1
1 662 . 13 1 1 A 52 52 SER CA C 52 58.800 59.800 -1.000 1
1 663 . 13 1 1 A 52 52 SER CB C 52 62.600 63.137 -0.537 1
1 664 . 13 1 1 A 52 52 SER N N 52 118.900 116.604 2.296 1
1 665 . 13 1 1 A 53 53 GLY H H 53 9.070 8.831 0.239 1
1 666 . 13 1 1 A 53 53 GLY HA2 H 53 3.390 3.842 -0.452 1
1 667 . 13 1 1 A 53 53 GLY HA3 H 53 4.460 3.842 0.618 1
1 668 . 13 1 1 A 53 53 GLY C C 53 174.100 174.230 -0.130 1
1 669 . 13 1 1 A 53 53 GLY CA C 53 44.800 46.279 -1.479 1
1 670 . 13 1 1 A 53 53 GLY N N 53 115.600 114.613 0.987 1
1 671 . 13 1 1 A 54 54 ASN H H 54 7.870 7.854 0.016 1
1 672 . 13 1 1 A 54 54 ASN HA H 54 4.570 4.975 -0.405 1
1 677 . 13 1 1 A 54 54 ASN C C 54 175.500 174.229 1.271 1
1 678 . 13 1 1 A 54 54 ASN CA C 54 53.000 52.070 0.930 1
1 679 . 13 1 1 A 54 54 ASN CB C 54 38.600 39.824 -1.224 1
1 680 . 13 1 1 A 54 54 ASN N N 54 119.600 117.817 1.783 1
1 682 . 13 1 1 A 55 55 VAL H H 55 8.770 8.944 -0.174 1
1 683 . 13 1 1 A 55 55 VAL HA H 55 3.880 3.974 -0.094 1
1 691 . 13 1 1 A 55 55 VAL C C 55 176.200 175.431 0.769 1
1 692 . 13 1 1 A 55 55 VAL CA C 55 63.700 63.278 0.422 1
1 693 . 13 1 1 A 55 55 VAL CB C 55 31.600 31.092 0.508 1
1 696 . 13 1 1 A 55 55 VAL N N 55 123.900 123.237 0.663 1
1 697 . 13 1 1 A 56 56 VAL H H 56 9.050 9.048 0.002 1
1 698 . 13 1 1 A 56 56 VAL HA H 56 3.990 4.004 -0.014 1
1 706 . 13 1 1 A 56 56 VAL C C 56 175.200 176.079 -0.879 1
1 707 . 13 1 1 A 56 56 VAL CA C 56 62.700 63.978 -1.278 1
1 708 . 13 1 1 A 56 56 VAL CB C 56 32.900 32.528 0.372 1
1 711 . 13 1 1 A 56 56 VAL N N 56 127.500 128.506 -1.006 1
1 712 . 13 1 1 A 57 57 CYS H H 57 7.250 7.522 -0.272 1
1 713 . 13 1 1 A 57 57 CYS HA H 57 4.370 4.934 -0.564 1
1 716 . 13 1 1 A 57 57 CYS C C 57 171.900 172.680 -0.780 1
1 717 . 13 1 1 A 57 57 CYS CA C 57 58.600 57.506 1.094 1
1 718 . 13 1 1 A 57 57 CYS CB C 57 28.600 29.413 -0.813 1
1 719 . 13 1 1 A 57 57 CYS N N 57 117.600 117.691 -0.091 1
1 720 . 13 1 1 A 58 58 LYS H H 58 8.880 8.713 0.167 1
1 721 . 13 1 1 A 58 58 LYS HA H 58 4.220 4.528 -0.308 1
1 730 . 13 1 1 A 58 58 LYS C C 58 176.000 176.193 -0.193 1
1 731 . 13 1 1 A 58 58 LYS CA C 58 54.400 55.104 -0.704 1
1 732 . 13 1 1 A 58 58 LYS CB C 58 33.600 34.309 -0.709 1
1 736 . 13 1 1 A 58 58 LYS N N 58 132.000 126.718 5.282 1
1 737 . 13 1 1 A 59 59 ASN H H 59 9.500 9.338 0.162 1
1 738 . 13 1 1 A 59 59 ASN HA H 59 4.040 4.274 -0.234 1
1 743 . 13 1 1 A 59 59 ASN C C 59 176.400 175.238 1.162 1
1 744 . 13 1 1 A 59 59 ASN CA C 59 53.200 53.852 -0.652 1
1 745 . 13 1 1 A 59 59 ASN CB C 59 35.900 37.023 -1.123 1
1 746 . 13 1 1 A 59 59 ASN N N 59 127.500 123.679 3.821 1
1 748 . 13 1 1 A 60 60 ILE H H 60 8.050 7.267 0.783 1
1 749 . 13 1 1 A 60 60 ILE HA H 60 3.680 3.924 -0.244 1
1 759 . 13 1 1 A 60 60 ILE C C 60 175.700 176.611 -0.911 1
1 760 . 13 1 1 A 60 60 ILE CA C 60 61.900 61.835 0.065 1
1 761 . 13 1 1 A 60 60 ILE CB C 60 38.300 37.770 0.530 1
1 765 . 13 1 1 A 60 60 ILE N N 60 120.200 120.491 -0.291 1
1 766 . 13 1 1 A 61 61 MET H H 61 9.590 9.460 0.130 1
1 767 . 13 1 1 A 61 61 MET HA H 61 3.920 4.186 -0.266 1
1 775 . 13 1 1 A 61 61 MET C C 61 174.300 175.445 -1.145 1
1 776 . 13 1 1 A 61 61 MET CA C 61 57.000 56.931 0.069 1
1 777 . 13 1 1 A 61 61 MET CB C 61 31.300 31.218 0.082 1
1 780 . 13 1 1 A 61 61 MET N N 61 124.400 126.424 -2.024 1
1 781 . 13 1 1 A 62 62 ASN H H 62 8.250 8.157 0.093 1
1 782 . 13 1 1 A 62 62 ASN HA H 62 4.400 5.269 -0.869 1
1 787 . 13 1 1 A 62 62 ASN C C 62 176.800 174.975 1.825 1
1 788 . 13 1 1 A 62 62 ASN CA C 62 54.400 54.209 0.191 1
1 789 . 13 1 1 A 62 62 ASN CB C 62 37.600 36.572 1.028 1
1 790 . 13 1 1 A 62 62 ASN N N 62 111.900 109.720 2.180 1
1 792 . 13 1 1 A 63 63 THR H H 63 7.480 8.035 -0.555 1
1 793 . 13 1 1 A 63 63 THR HA H 63 4.210 4.681 -0.471 1
1 798 . 13 1 1 A 63 63 THR C C 63 177.100 176.047 1.053 1
1 799 . 13 1 1 A 63 63 THR CA C 63 62.900 62.098 0.802 1
1 800 . 13 1 1 A 63 63 THR CB C 63 72.500 71.223 1.277 1
1 802 . 13 1 1 A 63 63 THR N N 63 105.900 110.696 -4.796 1
1 803 . 13 1 1 A 64 64 GLY H H 64 9.110 8.194 0.916 1
1 804 . 13 1 1 A 64 64 GLY HA2 H 64 3.580 4.015 -0.435 1
1 805 . 13 1 1 A 64 64 GLY HA3 H 64 4.090 4.024 0.066 1
1 806 . 13 1 1 A 64 64 GLY C C 64 173.200 174.003 -0.803 1
1 807 . 13 1 1 A 64 64 GLY CA C 64 45.300 45.078 0.222 1
1 808 . 13 1 1 A 64 64 GLY N N 64 111.500 111.448 0.052 1
1 809 . 13 1 1 A 65 65 VAL H H 65 7.580 7.199 0.381 1
1 810 . 13 1 1 A 65 65 VAL HA H 65 4.060 4.427 -0.367 1
1 818 . 13 1 1 A 65 65 VAL C C 65 172.900 173.769 -0.869 1
1 819 . 13 1 1 A 65 65 VAL CA C 65 61.400 60.017 1.383 1
1 820 . 13 1 1 A 65 65 VAL CB C 65 32.900 34.080 -1.180 1
1 823 . 13 1 1 A 65 65 VAL N N 65 121.600 120.770 0.830 1
1 824 . 13 1 1 A 66 66 ASP H H 66 8.210 9.007 -0.797 1
1 825 . 13 1 1 A 66 66 ASP HA H 66 5.320 5.375 -0.055 1
1 828 . 13 1 1 A 66 66 ASP C C 66 174.800 174.540 0.260 1
1 829 . 13 1 1 A 66 66 ASP CA C 66 51.700 52.364 -0.664 1
1 830 . 13 1 1 A 66 66 ASP CB C 66 43.200 42.236 0.964 1
1 831 . 13 1 1 A 66 66 ASP N N 66 123.100 127.481 -4.381 1
1 832 . 13 1 1 A 67 67 ILE H H 67 8.540 8.871 -0.331 1
1 833 . 13 1 1 A 67 67 ILE HA H 67 4.630 4.377 0.253 1
1 843 . 13 1 1 A 67 67 ILE C C 67 175.600 175.780 -0.180 1
1 844 . 13 1 1 A 67 67 ILE CA C 67 56.900 60.958 -4.058 1
1 845 . 13 1 1 A 67 67 ILE CB C 67 35.300 37.326 -2.026 1
1 849 . 13 1 1 A 67 67 ILE N N 67 119.200 125.075 -5.875 1
1 850 . 13 1 1 A 68 68 ILE H H 68 9.420 8.806 0.614 1
1 851 . 13 1 1 A 68 68 ILE HA H 68 4.980 5.359 -0.379 1
1 861 . 13 1 1 A 68 68 ILE C C 68 175.000 174.337 0.663 1
1 862 . 13 1 1 A 68 68 ILE CA C 68 58.600 58.851 -0.251 1
1 863 . 13 1 1 A 68 68 ILE CB C 68 40.900 40.343 0.557 1
1 867 . 13 1 1 A 68 68 ILE N N 68 125.000 123.749 1.251 1
1 868 . 13 1 1 A 69 69 CYS H H 69 8.870 9.229 -0.359 1
1 869 . 13 1 1 A 69 69 CYS HA H 69 4.610 4.836 -0.226 1
1 872 . 13 1 1 A 69 69 CYS C C 69 176.200 175.106 1.094 1
1 873 . 13 1 1 A 69 69 CYS CA C 69 58.900 58.224 0.676 1
1 874 . 13 1 1 A 69 69 CYS CB C 69 27.100 29.406 -2.306 1
1 875 . 13 1 1 A 69 69 CYS N N 69 122.300 123.836 -1.536 1
1 876 . 13 1 1 A 70 70 THR H H 70 8.270 8.865 -0.595 1
1 877 . 13 1 1 A 70 70 THR HA H 70 4.710 4.658 0.052 1
1 882 . 13 1 1 A 70 70 THR C C 70 173.600 173.925 -0.325 1
1 883 . 13 1 1 A 70 70 THR CA C 70 61.500 62.041 -0.541 1
1 884 . 13 1 1 A 70 70 THR CB C 70 68.100 70.383 -2.283 1
1 886 . 13 1 1 A 70 70 THR N N 70 116.700 119.011 -2.311 1
1 887 . 13 1 1 A 71 71 LYS H H 71 7.370 7.125 0.245 1
1 888 . 13 1 1 A 71 71 LYS HA H 71 4.520 4.776 -0.256 1
1 897 . 13 1 1 A 71 71 LYS CA C 71 55.100 55.137 -0.037 1
1 898 . 13 1 1 A 71 71 LYS CB C 71 37.800 34.332 3.468 1
1 902 . 13 1 1 A 71 71 LYS N N 71 120.900 122.908 -2.008 1
1 903 . 13 1 1 A 72 72 ASN H H 72 8.580 8.717 -0.137 1
1 904 . 13 1 1 A 72 72 ASN HA H 72 4.620 5.054 -0.434 1
1 909 . 13 1 1 A 72 72 ASN C C 72 173.500 174.757 -1.257 1
1 910 . 13 1 1 A 72 72 ASN CA C 72 52.200 52.829 -0.629 1
1 911 . 13 1 1 A 72 72 ASN CB C 72 38.500 39.471 -0.971 1
1 912 . 13 1 1 A 72 72 ASN N N 72 122.700 122.782 -0.082 1
1 914 . 13 1 1 A 73 73 LEU H H 73 8.100 9.104 -1.004 1
1 915 . 13 1 1 A 73 73 LEU HA H 73 4.680 4.816 -0.136 1
1 925 . 13 1 1 A 73 73 LEU CA C 73 51.000 52.471 -1.471 1
1 926 . 13 1 1 A 73 73 LEU CB C 73 42.500 42.101 0.399 1
1 930 . 13 1 1 A 73 73 LEU N N 73 125.100 126.660 -1.560 1
1 931 . 13 1 1 A 74 74 PRO HA H 74 4.670 4.675 -0.005 1
1 938 . 13 1 1 A 74 74 PRO C C 74 176.500 176.204 0.296 1
1 939 . 13 1 1 A 74 74 PRO CA C 74 61.800 62.613 -0.813 1
1 940 . 13 1 1 A 74 74 PRO CB C 74 32.800 31.155 1.645 1
1 943 . 13 1 1 A 75 75 LYS H H 75 8.280 8.396 -0.116 1
1 944 . 13 1 1 A 75 75 LYS HA H 75 4.110 4.525 -0.415 1
1 953 . 13 1 1 A 75 75 LYS CA C 75 56.500 57.637 -1.137 1
1 954 . 13 1 1 A 75 75 LYS CB C 75 33.300 35.257 -1.957 1
1 958 . 13 1 1 A 75 75 LYS N N 75 117.000 123.074 -6.074 1
1 959 . 13 1 1 A 76 76 ASP H H 76 8.570 7.961 0.609 1
1 960 . 13 1 1 A 76 76 ASP HA H 76 4.530 4.582 -0.052 1
1 963 . 13 1 1 A 76 76 ASP C C 76 176.300 174.694 1.606 1
1 964 . 13 1 1 A 76 76 ASP CA C 76 55.000 53.866 1.134 1
1 965 . 13 1 1 A 76 76 ASP CB C 76 41.100 40.916 0.184 1
1 966 . 13 1 1 A 76 76 ASP N N 76 122.700 120.309 2.391 1
1 967 . 13 1 1 A 77 77 SER H H 77 8.330 8.879 -0.549 1
1 968 . 13 1 1 A 77 77 SER HA H 77 4.410 4.677 -0.267 1
1 971 . 13 1 1 A 77 77 SER C C 77 174.300 174.037 0.263 1
1 972 . 13 1 1 A 77 77 SER CA C 77 58.000 58.727 -0.727 1
1 973 . 13 1 1 A 77 77 SER CB C 77 63.900 63.747 0.153 1
1 974 . 13 1 1 A 77 77 SER N N 77 116.100 122.905 -6.805 1
1 975 . 13 1 1 A 78 78 LEU H H 78 8.350 8.827 -0.477 1
1 976 . 13 1 1 A 78 78 LEU HA H 78 4.280 4.316 -0.036 1
1 986 . 13 1 1 A 78 78 LEU C C 78 177.200 177.065 0.135 1
1 987 . 13 1 1 A 78 78 LEU CA C 78 55.200 55.070 0.130 1
1 988 . 13 1 1 A 78 78 LEU CB C 78 42.100 41.854 0.246 1
1 992 . 13 1 1 A 78 78 LEU N N 78 124.300 127.332 -3.032 1
1 993 . 13 1 1 A 79 79 GLU H H 79 8.300 7.824 0.476 1
1 994 . 13 1 1 A 79 79 GLU CA C 79 56.400 55.371 1.029 1
1 995 . 13 1 1 A 79 79 GLU CB C 79 30.200 30.221 -0.021 1
1 1 . 14 1 1 A 2 2 HIS HA H 2 4.640 5.219 -0.579 1
1 4 . 14 1 1 A 2 2 HIS C C 2 173.600 173.996 -0.396 1
1 5 . 14 1 1 A 2 2 HIS CA C 2 56.500 54.842 1.658 1
1 6 . 14 1 1 A 2 2 HIS CB C 2 31.000 33.555 -2.555 1
1 7 . 14 1 1 A 3 3 LYS H H 3 8.160 7.820 0.340 1
1 8 . 14 1 1 A 3 3 LYS HA H 3 4.660 4.183 0.477 1
1 17 . 14 1 1 A 3 3 LYS C C 3 174.400 175.168 -0.768 1
1 18 . 14 1 1 A 3 3 LYS CA C 3 54.800 56.545 -1.745 1
1 19 . 14 1 1 A 3 3 LYS CB C 3 35.800 33.159 2.641 1
1 23 . 14 1 1 A 3 3 LYS N N 3 121.900 123.511 -1.611 1
1 24 . 14 1 1 A 4 4 ASP H H 4 8.470 9.092 -0.622 1
1 25 . 14 1 1 A 4 4 ASP HA H 4 4.900 5.330 -0.430 1
1 28 . 14 1 1 A 4 4 ASP C C 4 176.900 175.438 1.462 1
1 29 . 14 1 1 A 4 4 ASP CA C 4 52.700 52.772 -0.072 1
1 30 . 14 1 1 A 4 4 ASP CB C 4 44.100 44.337 -0.237 1
1 31 . 14 1 1 A 4 4 ASP N N 4 117.900 121.625 -3.725 1
1 32 . 14 1 1 A 5 5 ILE H H 5 9.570 8.704 0.866 1
1 33 . 14 1 1 A 5 5 ILE HA H 5 3.640 4.194 -0.554 1
1 43 . 14 1 1 A 5 5 ILE C C 5 174.800 175.978 -1.178 1
1 44 . 14 1 1 A 5 5 ILE CA C 5 60.900 61.922 -1.022 1
1 45 . 14 1 1 A 5 5 ILE CB C 5 37.000 37.253 -0.253 1
1 49 . 14 1 1 A 5 5 ILE N N 5 124.400 124.781 -0.381 1
1 50 . 14 1 1 A 6 6 PHE H H 6 7.790 9.106 -1.316 1
1 51 . 14 1 1 A 6 6 PHE HA H 6 3.160 4.889 -1.729 1
1 58 . 14 1 1 A 6 6 PHE C C 6 173.500 174.840 -1.340 1
1 59 . 14 1 1 A 6 6 PHE CA C 6 56.900 59.158 -2.258 1
1 60 . 14 1 1 A 6 6 PHE CB C 6 40.100 39.399 0.701 1
1 65 . 14 1 1 A 6 6 PHE N N 6 130.200 129.255 0.945 1
1 66 . 14 1 1 A 7 7 THR H H 7 6.790 8.327 -1.537 1
1 67 . 14 1 1 A 7 7 THR HA H 7 4.530 5.000 -0.470 1
1 72 . 14 1 1 A 7 7 THR C C 7 172.300 171.821 0.479 1
1 73 . 14 1 1 A 7 7 THR CA C 7 59.200 60.011 -0.811 1
1 74 . 14 1 1 A 7 7 THR CB C 7 71.000 71.441 -0.441 1
1 76 . 14 1 1 A 7 7 THR N N 7 117.900 121.237 -3.337 1
1 77 . 14 1 1 A 8 8 SER H H 8 7.600 8.632 -1.032 1
1 78 . 14 1 1 A 8 8 SER HA H 8 4.180 4.834 -0.654 1
1 81 . 14 1 1 A 8 8 SER C C 8 175.300 172.404 2.896 1
1 82 . 14 1 1 A 8 8 SER CA C 8 55.800 57.430 -1.630 1
1 83 . 14 1 1 A 8 8 SER CB C 8 64.000 67.103 -3.103 1
1 84 . 14 1 1 A 8 8 SER N N 8 113.400 120.655 -7.255 1
1 85 . 14 1 1 A 9 9 VAL H H 9 8.880 8.566 0.314 1
1 86 . 14 1 1 A 9 9 VAL HA H 9 5.220 4.844 0.376 1
1 94 . 14 1 1 A 9 9 VAL C C 9 174.000 174.121 -0.121 1
1 95 . 14 1 1 A 9 9 VAL CA C 9 59.100 60.433 -1.333 1
1 96 . 14 1 1 A 9 9 VAL CB C 9 36.500 33.736 2.764 1
1 99 . 14 1 1 A 9 9 VAL N N 9 114.700 118.199 -3.499 1
1 100 . 14 1 1 A 10 10 VAL H H 10 8.510 8.875 -0.365 1
1 101 . 14 1 1 A 10 10 VAL HA H 10 4.470 4.782 -0.312 1
1 109 . 14 1 1 A 10 10 VAL C C 10 173.700 174.990 -1.290 1
1 110 . 14 1 1 A 10 10 VAL CA C 10 59.400 59.576 -0.176 1
1 111 . 14 1 1 A 10 10 VAL CB C 10 36.000 34.035 1.965 1
1 114 . 14 1 1 A 10 10 VAL N N 10 117.100 127.444 -10.344 1
1 115 . 14 1 1 A 11 11 ARG H H 11 8.500 8.383 0.117 1
1 116 . 14 1 1 A 11 11 ARG HA H 11 4.460 4.931 -0.471 1
1 123 . 14 1 1 A 11 11 ARG C C 11 174.500 175.841 -1.341 1
1 124 . 14 1 1 A 11 11 ARG CA C 11 57.400 56.096 1.304 1
1 125 . 14 1 1 A 11 11 ARG CB C 11 31.000 30.597 0.403 1
1 128 . 14 1 1 A 11 11 ARG N N 11 124.800 128.346 -3.546 1
1 129 . 14 1 1 A 12 12 VAL H H 12 7.650 8.697 -1.047 1
1 130 . 14 1 1 A 12 12 VAL HA H 12 4.970 4.593 0.377 1
1 138 . 14 1 1 A 12 12 VAL C C 12 176.700 174.504 2.196 1
1 139 . 14 1 1 A 12 12 VAL CA C 12 59.400 61.723 -2.323 1
1 140 . 14 1 1 A 12 12 VAL CB C 12 34.400 33.072 1.328 1
1 143 . 14 1 1 A 12 12 VAL N N 12 120.900 127.441 -6.541 1
1 144 . 14 1 1 A 13 13 ARG H H 13 9.020 9.226 -0.206 1
1 145 . 14 1 1 A 13 13 ARG HA H 13 4.700 5.196 -0.496 1
1 152 . 14 1 1 A 13 13 ARG C C 13 176.000 175.390 0.610 1
1 153 . 14 1 1 A 13 13 ARG CA C 13 54.600 54.175 0.425 1
1 154 . 14 1 1 A 13 13 ARG CB C 13 32.900 33.699 -0.799 1
1 157 . 14 1 1 A 13 13 ARG N N 13 127.500 128.109 -0.609 1
1 158 . 14 1 1 A 14 14 GLY H H 14 8.640 8.445 0.195 1
1 159 . 14 1 1 A 14 14 GLY HA2 H 14 3.680 4.103 -0.423 1
1 160 . 14 1 1 A 14 14 GLY HA3 H 14 4.190 4.113 0.077 1
1 161 . 14 1 1 A 14 14 GLY C C 14 173.700 173.997 -0.297 1
1 162 . 14 1 1 A 14 14 GLY CA C 14 45.600 44.067 1.533 1
1 163 . 14 1 1 A 14 14 GLY N N 14 108.800 111.288 -2.488 1
1 164 . 14 1 1 A 15 15 SER H H 15 8.220 8.371 -0.151 1
1 165 . 14 1 1 A 15 15 SER HA H 15 5.020 4.774 0.246 1
1 168 . 14 1 1 A 15 15 SER C C 15 175.400 173.534 1.866 1
1 169 . 14 1 1 A 15 15 SER CA C 15 55.300 58.158 -2.858 1
1 170 . 14 1 1 A 15 15 SER CB C 15 64.900 62.259 2.641 1
1 171 . 14 1 1 A 15 15 SER N N 15 113.200 116.922 -3.722 1
1 172 . 14 1 1 A 16 16 LYS H H 16 9.930 8.102 1.828 1
1 173 . 14 1 1 A 16 16 LYS HA H 16 4.190 4.801 -0.611 1
1 182 . 14 1 1 A 16 16 LYS C C 16 176.500 175.578 0.922 1
1 183 . 14 1 1 A 16 16 LYS CA C 16 57.300 55.047 2.253 1
1 184 . 14 1 1 A 16 16 LYS CB C 16 32.300 33.926 -1.626 1
1 188 . 14 1 1 A 16 16 LYS N N 16 129.200 122.087 7.113 1
1 189 . 14 1 1 A 17 17 LYS H H 17 7.960 8.702 -0.742 1
1 190 . 14 1 1 A 17 17 LYS HA H 17 4.030 4.492 -0.462 1
1 199 . 14 1 1 A 17 17 LYS C C 17 175.600 174.923 0.677 1
1 200 . 14 1 1 A 17 17 LYS CA C 17 56.900 55.269 1.631 1
1 201 . 14 1 1 A 17 17 LYS CB C 17 34.700 33.314 1.386 1
1 205 . 14 1 1 A 17 17 LYS N N 17 118.500 119.942 -1.442 1
1 206 . 14 1 1 A 18 18 TYR H H 18 7.780 7.711 0.069 1
1 207 . 14 1 1 A 18 18 TYR HA H 18 4.760 5.050 -0.290 1
1 214 . 14 1 1 A 18 18 TYR C C 18 174.000 175.553 -1.553 1
1 215 . 14 1 1 A 18 18 TYR CA C 18 56.800 56.652 0.148 1
1 216 . 14 1 1 A 18 18 TYR CB C 18 41.100 42.327 -1.227 1
1 221 . 14 1 1 A 18 18 TYR N N 18 117.100 119.538 -2.438 1
1 222 . 14 1 1 A 19 19 ASN H H 19 8.890 9.105 -0.215 1
1 223 . 14 1 1 A 19 19 ASN HA H 19 4.960 5.102 -0.142 1
1 228 . 14 1 1 A 19 19 ASN C C 19 176.100 174.357 1.743 1
1 229 . 14 1 1 A 19 19 ASN CA C 19 53.600 53.257 0.343 1
1 230 . 14 1 1 A 19 19 ASN CB C 19 40.300 40.437 -0.137 1
1 231 . 14 1 1 A 19 19 ASN N N 19 116.600 118.970 -2.370 1
1 233 . 14 1 1 A 20 20 VAL H H 20 7.730 7.681 0.049 1
1 234 . 14 1 1 A 20 20 VAL HA H 20 5.250 5.146 0.104 1
1 242 . 14 1 1 A 20 20 VAL C C 20 173.800 173.905 -0.105 1
1 243 . 14 1 1 A 20 20 VAL CA C 20 59.400 59.271 0.129 1
1 244 . 14 1 1 A 20 20 VAL CB C 20 37.600 35.822 1.778 1
1 247 . 14 1 1 A 20 20 VAL N N 20 113.900 115.326 -1.426 1
1 248 . 14 1 1 A 21 21 VAL H H 21 8.890 8.859 0.031 1
1 249 . 14 1 1 A 21 21 VAL HA H 21 4.840 4.564 0.276 1
1 257 . 14 1 1 A 21 21 VAL CA C 21 56.800 58.207 -1.407 1
1 258 . 14 1 1 A 21 21 VAL CB C 21 36.000 35.078 0.922 1
1 261 . 14 1 1 A 21 21 VAL N N 21 118.500 121.971 -3.471 1
1 262 . 14 1 1 A 22 22 PRO HA H 22 4.940 4.777 0.163 1
1 269 . 14 1 1 A 22 22 PRO C C 22 175.600 176.258 -0.658 1
1 270 . 14 1 1 A 22 22 PRO CA C 22 62.700 62.746 -0.046 1
1 271 . 14 1 1 A 22 22 PRO CB C 22 31.800 31.701 0.099 1
1 274 . 14 1 1 A 23 23 VAL H H 23 8.060 8.681 -0.621 1
1 275 . 14 1 1 A 23 23 VAL HA H 23 5.390 5.060 0.330 1
1 283 . 14 1 1 A 23 23 VAL C C 23 175.400 174.709 0.691 1
1 284 . 14 1 1 A 23 23 VAL CA C 23 57.800 59.175 -1.375 1
1 285 . 14 1 1 A 23 23 VAL CB C 23 36.300 33.987 2.313 1
1 288 . 14 1 1 A 23 23 VAL N N 23 110.900 116.852 -5.952 1
1 289 . 14 1 1 A 24 24 LYS H H 24 8.960 9.328 -0.368 1
1 290 . 14 1 1 A 24 24 LYS HA H 24 5.600 5.123 0.477 1
1 299 . 14 1 1 A 24 24 LYS C C 24 175.600 174.224 1.376 1
1 300 . 14 1 1 A 24 24 LYS CA C 24 54.200 54.305 -0.105 1
1 301 . 14 1 1 A 24 24 LYS CB C 24 37.000 36.316 0.684 1
1 305 . 14 1 1 A 24 24 LYS N N 24 117.900 121.270 -3.370 1
1 306 . 14 1 1 A 25 25 SER H H 25 8.950 8.665 0.285 1
1 307 . 14 1 1 A 25 25 SER HA H 25 5.190 5.010 0.180 1
1 310 . 14 1 1 A 25 25 SER C C 25 173.800 175.200 -1.400 1
1 311 . 14 1 1 A 25 25 SER CA C 25 57.700 58.162 -0.462 1
1 312 . 14 1 1 A 25 25 SER CB C 25 65.100 64.926 0.174 1
1 313 . 14 1 1 A 25 25 SER N N 25 114.600 117.731 -3.131 1
1 314 . 14 1 1 A 26 26 ASN H H 26 9.020 8.463 0.557 1
1 315 . 14 1 1 A 26 26 ASN HA H 26 4.370 4.634 -0.264 1
1 320 . 14 1 1 A 26 26 ASN C C 26 173.500 174.710 -1.210 1
1 321 . 14 1 1 A 26 26 ASN CA C 26 53.700 54.062 -0.362 1
1 322 . 14 1 1 A 26 26 ASN CB C 26 37.100 38.193 -1.093 1
1 323 . 14 1 1 A 26 26 ASN N N 26 118.300 121.976 -3.676 1
1 325 . 14 1 1 A 27 27 LYS H H 27 7.400 7.675 -0.275 1
1 326 . 14 1 1 A 27 27 LYS HA H 27 4.780 4.831 -0.051 1
1 335 . 14 1 1 A 27 27 LYS CA C 27 53.500 52.663 0.837 1
1 336 . 14 1 1 A 27 27 LYS CB C 27 34.100 33.767 0.333 1
1 340 . 14 1 1 A 27 27 LYS N N 27 116.600 120.159 -3.559 1
1 341 . 14 1 1 A 28 28 PRO HA H 28 4.040 4.728 -0.688 1
1 348 . 14 1 1 A 28 28 PRO C C 28 174.500 175.939 -1.439 1
1 349 . 14 1 1 A 28 28 PRO CA C 28 63.200 62.801 0.399 1
1 350 . 14 1 1 A 28 28 PRO CB C 28 32.500 32.116 0.384 1
1 353 . 14 1 1 A 29 29 VAL H H 29 8.860 9.044 -0.184 1
1 354 . 14 1 1 A 29 29 VAL HA H 29 4.420 4.505 -0.085 1
1 362 . 14 1 1 A 29 29 VAL C C 29 174.800 175.594 -0.794 1
1 363 . 14 1 1 A 29 29 VAL CA C 29 60.300 60.507 -0.207 1
1 364 . 14 1 1 A 29 29 VAL CB C 29 36.400 34.207 2.193 1
1 367 . 14 1 1 A 29 29 VAL N N 29 119.800 123.937 -4.137 1
1 368 . 14 1 1 A 30 30 GLU H H 30 9.550 8.644 0.906 1
1 369 . 14 1 1 A 30 30 GLU HA H 30 4.260 4.514 -0.254 1
1 374 . 14 1 1 A 30 30 GLU C C 30 177.800 177.947 -0.147 1
1 375 . 14 1 1 A 30 30 GLU CA C 30 58.000 55.951 2.049 1
1 376 . 14 1 1 A 30 30 GLU CB C 30 29.700 30.882 -1.182 1
1 378 . 14 1 1 A 30 30 GLU N N 30 128.900 125.917 2.983 1
1 379 . 14 1 1 A 31 31 ILE H H 31 7.910 8.640 -0.730 1
1 380 . 14 1 1 A 31 31 ILE HA H 31 2.120 4.051 -1.931 1
1 390 . 14 1 1 A 31 31 ILE C C 31 178.000 176.699 1.301 1
1 391 . 14 1 1 A 31 31 ILE CA C 31 63.500 62.774 0.726 1
1 392 . 14 1 1 A 31 31 ILE CB C 31 37.200 37.785 -0.585 1
1 396 . 14 1 1 A 31 31 ILE N N 31 122.500 120.534 1.966 1
1 397 . 14 1 1 A 32 32 SER H H 32 7.940 7.886 0.054 1
1 398 . 14 1 1 A 32 32 SER HA H 32 4.070 4.319 -0.249 1
1 401 . 14 1 1 A 32 32 SER C C 32 175.800 175.395 0.405 1
1 402 . 14 1 1 A 32 32 SER CA C 32 60.200 61.006 -0.806 1
1 403 . 14 1 1 A 32 32 SER CB C 32 62.100 63.078 -0.978 1
1 404 . 14 1 1 A 32 32 SER N N 32 115.300 117.463 -2.163 1
1 405 . 14 1 1 A 33 33 LYS H H 33 7.640 7.444 0.196 1
1 406 . 14 1 1 A 33 33 LYS HA H 33 4.400 4.208 0.192 1
1 415 . 14 1 1 A 33 33 LYS C C 33 176.600 177.493 -0.893 1
1 416 . 14 1 1 A 33 33 LYS CA C 33 56.200 56.429 -0.229 1
1 417 . 14 1 1 A 33 33 LYS CB C 33 32.700 32.620 0.080 1
1 421 . 14 1 1 A 33 33 LYS N N 33 119.800 118.957 0.843 1
1 422 . 14 1 1 A 34 34 TRP H H 34 7.860 7.742 0.118 1
1 423 . 14 1 1 A 34 34 TRP HA H 34 3.870 3.765 0.105 1
1 426 . 14 1 1 A 34 34 TRP C C 34 178.600 178.222 0.378 1
1 427 . 14 1 1 A 34 34 TRP CA C 34 60.200 60.753 -0.553 1
1 428 . 14 1 1 A 34 34 TRP CB C 34 28.500 29.599 -1.099 1
1 429 . 14 1 1 A 34 34 TRP N N 34 120.000 122.067 -2.067 1
1 430 . 14 1 1 A 35 35 ILE H H 35 8.200 8.279 -0.079 1
1 431 . 14 1 1 A 35 35 ILE HA H 35 3.990 3.686 0.304 1
1 441 . 14 1 1 A 35 35 ILE C C 35 177.900 177.549 0.351 1
1 442 . 14 1 1 A 35 35 ILE CA C 35 64.300 65.406 -1.106 1
1 443 . 14 1 1 A 35 35 ILE CB C 35 37.200 38.075 -0.875 1
1 447 . 14 1 1 A 35 35 ILE N N 35 119.500 120.579 -1.079 1
1 448 . 14 1 1 A 36 36 ASP H H 36 7.680 8.205 -0.525 1
1 449 . 14 1 1 A 36 36 ASP HA H 36 4.490 4.268 0.222 1
1 452 . 14 1 1 A 36 36 ASP C C 36 179.200 179.083 0.117 1
1 453 . 14 1 1 A 36 36 ASP CA C 36 57.500 57.529 -0.029 1
1 454 . 14 1 1 A 36 36 ASP CB C 36 40.400 40.372 0.028 1
1 455 . 14 1 1 A 36 36 ASP N N 36 122.000 120.330 1.670 1
1 456 . 14 1 1 A 37 37 PHE H H 37 8.450 8.096 0.354 1
1 457 . 14 1 1 A 37 37 PHE HA H 37 4.080 4.105 -0.025 1
1 465 . 14 1 1 A 37 37 PHE C C 37 178.300 177.855 0.445 1
1 466 . 14 1 1 A 37 37 PHE CA C 37 58.600 59.753 -1.153 1
1 467 . 14 1 1 A 37 37 PHE CB C 37 37.000 37.215 -0.215 1
1 473 . 14 1 1 A 37 37 PHE N N 37 119.800 119.035 0.765 1
1 474 . 14 1 1 A 38 38 SER H H 38 8.580 7.854 0.726 1
1 475 . 14 1 1 A 38 38 SER HA H 38 4.250 4.144 0.106 1
1 478 . 14 1 1 A 38 38 SER C C 38 176.800 176.579 0.221 1
1 479 . 14 1 1 A 38 38 SER CA C 38 62.700 61.022 1.678 1
1 480 . 14 1 1 A 38 38 SER CB C 38 62.700 62.344 0.356 1
1 481 . 14 1 1 A 38 38 SER N N 38 115.800 113.880 1.920 1
1 482 . 14 1 1 A 39 39 ASN H H 39 8.190 8.238 -0.048 1
1 483 . 14 1 1 A 39 39 ASN HA H 39 4.540 4.475 0.065 1
1 488 . 14 1 1 A 39 39 ASN C C 39 178.500 178.127 0.373 1
1 489 . 14 1 1 A 39 39 ASN CA C 39 56.200 56.358 -0.158 1
1 490 . 14 1 1 A 39 39 ASN CB C 39 37.900 38.030 -0.130 1
1 491 . 14 1 1 A 39 39 ASN N N 39 121.300 120.783 0.517 1
1 493 . 14 1 1 A 40 40 VAL H H 40 7.840 7.842 -0.002 1
1 494 . 14 1 1 A 40 40 VAL HA H 40 3.650 3.605 0.045 1
1 502 . 14 1 1 A 40 40 VAL C C 40 179.000 178.084 0.916 1
1 503 . 14 1 1 A 40 40 VAL CA C 40 66.600 66.306 0.294 1
1 504 . 14 1 1 A 40 40 VAL CB C 40 32.100 31.482 0.618 1
1 507 . 14 1 1 A 40 40 VAL N N 40 121.800 120.220 1.580 1
1 508 . 14 1 1 A 41 41 LEU H H 41 8.210 7.955 0.255 1
1 509 . 14 1 1 A 41 41 LEU HA H 41 3.840 4.071 -0.231 1
1 519 . 14 1 1 A 41 41 LEU C C 41 178.800 177.620 1.180 1
1 520 . 14 1 1 A 41 41 LEU CA C 41 57.400 57.064 0.336 1
1 521 . 14 1 1 A 41 41 LEU CB C 41 41.200 41.383 -0.183 1
1 525 . 14 1 1 A 41 41 LEU N N 41 117.700 119.574 -1.874 1
1 526 . 14 1 1 A 42 42 SER H H 42 7.980 7.533 0.447 1
1 527 . 14 1 1 A 42 42 SER HA H 42 4.260 4.397 -0.137 1
1 530 . 14 1 1 A 42 42 SER C C 42 174.900 175.582 -0.682 1
1 531 . 14 1 1 A 42 42 SER CA C 42 61.200 58.988 2.212 1
1 532 . 14 1 1 A 42 42 SER CB C 42 63.100 62.952 0.148 1
1 533 . 14 1 1 A 42 42 SER N N 42 113.200 114.169 -0.969 1
1 534 . 14 1 1 A 43 43 ARG H H 43 7.100 8.320 -1.220 1
1 535 . 14 1 1 A 43 43 ARG HA H 43 4.500 4.773 -0.273 1
1 542 . 14 1 1 A 43 43 ARG C C 43 175.800 176.070 -0.270 1
1 543 . 14 1 1 A 43 43 ARG CA C 43 55.600 56.989 -1.389 1
1 544 . 14 1 1 A 43 43 ARG CB C 43 30.800 33.306 -2.506 1
1 547 . 14 1 1 A 43 43 ARG N N 43 118.400 121.356 -2.956 1
1 548 . 14 1 1 A 44 44 LEU H H 44 7.610 7.662 -0.052 1
1 549 . 14 1 1 A 44 44 LEU HA H 44 4.590 4.444 0.146 1
1 559 . 14 1 1 A 44 44 LEU C C 44 175.300 174.813 0.487 1
1 560 . 14 1 1 A 44 44 LEU CA C 44 53.900 54.678 -0.778 1
1 561 . 14 1 1 A 44 44 LEU CB C 44 44.100 42.834 1.266 1
1 565 . 14 1 1 A 44 44 LEU N N 44 120.400 120.276 0.124 1
1 566 . 14 1 1 A 45 45 TYR H H 45 7.630 9.100 -1.470 1
1 567 . 14 1 1 A 45 45 TYR HA H 45 5.180 5.092 0.088 1
1 574 . 14 1 1 A 45 45 TYR C C 45 174.600 175.188 -0.588 1
1 575 . 14 1 1 A 45 45 TYR CA C 45 56.300 56.489 -0.189 1
1 576 . 14 1 1 A 45 45 TYR CB C 45 41.400 39.699 1.701 1
1 581 . 14 1 1 A 45 45 TYR N N 45 115.300 127.411 -12.111 1
1 582 . 14 1 1 A 46 46 VAL H H 46 8.770 8.744 0.026 1
1 583 . 14 1 1 A 46 46 VAL HA H 46 4.540 4.695 -0.155 1
1 591 . 14 1 1 A 46 46 VAL C C 46 174.600 176.629 -2.029 1
1 592 . 14 1 1 A 46 46 VAL CA C 46 59.600 61.192 -1.592 1
1 593 . 14 1 1 A 46 46 VAL CB C 46 34.700 33.165 1.535 1
1 596 . 14 1 1 A 46 46 VAL N N 46 115.400 120.923 -5.523 1
1 597 . 14 1 1 A 47 47 GLY H H 47 8.280 8.813 -0.533 1
1 598 . 14 1 1 A 47 47 GLY HA2 H 47 3.610 4.000 -0.390 1
1 599 . 14 1 1 A 47 47 GLY HA3 H 47 4.970 4.010 0.960 1
1 600 . 14 1 1 A 47 47 GLY C C 47 173.100 173.354 -0.254 1
1 601 . 14 1 1 A 47 47 GLY CA C 47 43.600 45.652 -2.052 1
1 602 . 14 1 1 A 47 47 GLY N N 47 109.900 112.431 -2.531 1
1 603 . 14 1 1 A 48 48 VAL H H 48 7.630 7.491 0.139 1
1 604 . 14 1 1 A 48 48 VAL HA H 48 4.320 4.496 -0.176 1
1 612 . 14 1 1 A 48 48 VAL CA C 48 58.700 59.218 -0.518 1
1 613 . 14 1 1 A 48 48 VAL CB C 48 32.100 32.752 -0.652 1
1 616 . 14 1 1 A 48 48 VAL N N 48 109.900 119.597 -9.697 1
1 617 . 14 1 1 A 49 49 PRO HA H 49 4.800 4.782 0.018 1
1 624 . 14 1 1 A 49 49 PRO C C 49 176.700 175.890 0.810 1
1 625 . 14 1 1 A 49 49 PRO CA C 49 62.300 62.336 -0.036 1
1 626 . 14 1 1 A 49 49 PRO CB C 49 35.400 30.560 4.840 1
1 629 . 14 1 1 A 50 50 THR H H 50 8.790 7.921 0.869 1
1 630 . 14 1 1 A 50 50 THR HA H 50 4.690 4.899 -0.209 1
1 635 . 14 1 1 A 50 50 THR C C 50 173.500 173.676 -0.176 1
1 636 . 14 1 1 A 50 50 THR CA C 50 60.800 59.794 1.006 1
1 637 . 14 1 1 A 50 50 THR CB C 50 70.800 71.621 -0.821 1
1 639 . 14 1 1 A 50 50 THR N N 50 113.500 112.498 1.002 1
1 640 . 14 1 1 A 51 51 LYS H H 51 7.810 8.690 -0.880 1
1 641 . 14 1 1 A 51 51 LYS HA H 51 4.890 4.631 0.259 1
1 650 . 14 1 1 A 51 51 LYS C C 51 175.900 176.048 -0.148 1
1 651 . 14 1 1 A 51 51 LYS CA C 51 54.100 54.857 -0.757 1
1 652 . 14 1 1 A 51 51 LYS CB C 51 35.300 31.985 3.315 1
1 656 . 14 1 1 A 51 51 LYS N N 51 122.200 122.946 -0.746 1
1 657 . 14 1 1 A 52 52 SER H H 52 8.410 8.639 -0.229 1
1 658 . 14 1 1 A 52 52 SER HA H 52 3.630 4.449 -0.819 1
1 661 . 14 1 1 A 52 52 SER C C 52 175.800 174.507 1.293 1
1 662 . 14 1 1 A 52 52 SER CA C 52 58.800 58.440 0.360 1
1 663 . 14 1 1 A 52 52 SER CB C 52 62.600 62.787 -0.187 1
1 664 . 14 1 1 A 52 52 SER N N 52 118.900 119.306 -0.406 1
1 665 . 14 1 1 A 53 53 GLY H H 53 9.070 8.677 0.393 1
1 666 . 14 1 1 A 53 53 GLY HA2 H 53 3.390 3.842 -0.452 1
1 667 . 14 1 1 A 53 53 GLY HA3 H 53 4.460 3.843 0.617 1
1 668 . 14 1 1 A 53 53 GLY C C 53 174.100 173.902 0.198 1
1 669 . 14 1 1 A 53 53 GLY CA C 53 44.800 46.552 -1.752 1
1 670 . 14 1 1 A 53 53 GLY N N 53 115.600 113.712 1.888 1
1 671 . 14 1 1 A 54 54 ASN H H 54 7.870 7.598 0.272 1
1 672 . 14 1 1 A 54 54 ASN HA H 54 4.570 5.036 -0.466 1
1 677 . 14 1 1 A 54 54 ASN C C 54 175.500 173.803 1.697 1
1 678 . 14 1 1 A 54 54 ASN CA C 54 53.000 52.005 0.995 1
1 679 . 14 1 1 A 54 54 ASN CB C 54 38.600 40.334 -1.734 1
1 680 . 14 1 1 A 54 54 ASN N N 54 119.600 116.757 2.843 1
1 682 . 14 1 1 A 55 55 VAL H H 55 8.770 8.999 -0.229 1
1 683 . 14 1 1 A 55 55 VAL HA H 55 3.880 4.282 -0.402 1
1 691 . 14 1 1 A 55 55 VAL C C 55 176.200 177.095 -0.895 1
1 692 . 14 1 1 A 55 55 VAL CA C 55 63.700 63.133 0.567 1
1 693 . 14 1 1 A 55 55 VAL CB C 55 31.600 31.087 0.513 1
1 696 . 14 1 1 A 55 55 VAL N N 55 123.900 124.381 -0.481 1
1 697 . 14 1 1 A 56 56 VAL H H 56 9.050 8.706 0.344 1
1 698 . 14 1 1 A 56 56 VAL HA H 56 3.990 4.182 -0.192 1
1 706 . 14 1 1 A 56 56 VAL C C 56 175.200 176.114 -0.914 1
1 707 . 14 1 1 A 56 56 VAL CA C 56 62.700 63.340 -0.640 1
1 708 . 14 1 1 A 56 56 VAL CB C 56 32.900 32.343 0.557 1
1 711 . 14 1 1 A 56 56 VAL N N 56 127.500 123.138 4.362 1
1 712 . 14 1 1 A 57 57 CYS H H 57 7.250 7.466 -0.216 1
1 713 . 14 1 1 A 57 57 CYS HA H 57 4.370 4.870 -0.500 1
1 716 . 14 1 1 A 57 57 CYS C C 57 171.900 173.037 -1.137 1
1 717 . 14 1 1 A 57 57 CYS CA C 57 58.600 57.789 0.811 1
1 718 . 14 1 1 A 57 57 CYS CB C 57 28.600 29.479 -0.879 1
1 719 . 14 1 1 A 57 57 CYS N N 57 117.600 119.898 -2.298 1
1 720 . 14 1 1 A 58 58 LYS H H 58 8.880 8.647 0.233 1
1 721 . 14 1 1 A 58 58 LYS HA H 58 4.220 4.477 -0.257 1
1 730 . 14 1 1 A 58 58 LYS C C 58 176.000 176.558 -0.558 1
1 731 . 14 1 1 A 58 58 LYS CA C 58 54.400 56.004 -1.604 1
1 732 . 14 1 1 A 58 58 LYS CB C 58 33.600 33.446 0.154 1
1 736 . 14 1 1 A 58 58 LYS N N 58 132.000 127.013 4.987 1
1 737 . 14 1 1 A 59 59 ASN H H 59 9.500 9.081 0.419 1
1 738 . 14 1 1 A 59 59 ASN HA H 59 4.040 4.298 -0.258 1
1 743 . 14 1 1 A 59 59 ASN C C 59 176.400 175.209 1.191 1
1 744 . 14 1 1 A 59 59 ASN CA C 59 53.200 53.835 -0.635 1
1 745 . 14 1 1 A 59 59 ASN CB C 59 35.900 37.004 -1.104 1
1 746 . 14 1 1 A 59 59 ASN N N 59 127.500 123.666 3.834 1
1 748 . 14 1 1 A 60 60 ILE H H 60 8.050 8.022 0.028 1
1 749 . 14 1 1 A 60 60 ILE HA H 60 3.680 3.841 -0.161 1
1 759 . 14 1 1 A 60 60 ILE C C 60 175.700 176.234 -0.534 1
1 760 . 14 1 1 A 60 60 ILE CA C 60 61.900 61.918 -0.018 1
1 761 . 14 1 1 A 60 60 ILE CB C 60 38.300 37.568 0.732 1
1 765 . 14 1 1 A 60 60 ILE N N 60 120.200 121.935 -1.735 1
1 766 . 14 1 1 A 61 61 MET H H 61 9.590 8.734 0.856 1
1 767 . 14 1 1 A 61 61 MET HA H 61 3.920 4.051 -0.131 1
1 775 . 14 1 1 A 61 61 MET C C 61 174.300 174.586 -0.286 1
1 776 . 14 1 1 A 61 61 MET CA C 61 57.000 57.840 -0.840 1
1 777 . 14 1 1 A 61 61 MET CB C 61 31.300 31.140 0.160 1
1 780 . 14 1 1 A 61 61 MET N N 61 124.400 124.217 0.183 1
1 781 . 14 1 1 A 62 62 ASN H H 62 8.250 8.162 0.088 1
1 782 . 14 1 1 A 62 62 ASN HA H 62 4.400 4.967 -0.567 1
1 787 . 14 1 1 A 62 62 ASN C C 62 176.800 173.476 3.324 1
1 788 . 14 1 1 A 62 62 ASN CA C 62 54.400 53.279 1.121 1
1 789 . 14 1 1 A 62 62 ASN CB C 62 37.600 39.096 -1.496 1
1 790 . 14 1 1 A 62 62 ASN N N 62 111.900 115.487 -3.587 1
1 792 . 14 1 1 A 63 63 THR H H 63 7.480 8.741 -1.261 1
1 793 . 14 1 1 A 63 63 THR HA H 63 4.210 4.582 -0.372 1
1 798 . 14 1 1 A 63 63 THR C C 63 177.100 174.882 2.218 1
1 799 . 14 1 1 A 63 63 THR CA C 63 62.900 61.186 1.714 1
1 800 . 14 1 1 A 63 63 THR CB C 63 72.500 70.879 1.621 1
1 802 . 14 1 1 A 63 63 THR N N 63 105.900 119.475 -13.575 1
1 803 . 14 1 1 A 64 64 GLY H H 64 9.110 8.431 0.679 1
1 804 . 14 1 1 A 64 64 GLY HA2 H 64 3.580 3.971 -0.391 1
1 805 . 14 1 1 A 64 64 GLY HA3 H 64 4.090 3.981 0.109 1
1 806 . 14 1 1 A 64 64 GLY C C 64 173.200 174.089 -0.889 1
1 807 . 14 1 1 A 64 64 GLY CA C 64 45.300 45.244 0.056 1
1 808 . 14 1 1 A 64 64 GLY N N 64 111.500 110.572 0.928 1
1 809 . 14 1 1 A 65 65 VAL H H 65 7.580 7.578 0.002 1
1 810 . 14 1 1 A 65 65 VAL HA H 65 4.060 3.959 0.101 1
1 818 . 14 1 1 A 65 65 VAL C C 65 172.900 174.601 -1.701 1
1 819 . 14 1 1 A 65 65 VAL CA C 65 61.400 62.562 -1.162 1
1 820 . 14 1 1 A 65 65 VAL CB C 65 32.900 31.778 1.122 1
1 823 . 14 1 1 A 65 65 VAL N N 65 121.600 121.296 0.304 1
1 824 . 14 1 1 A 66 66 ASP H H 66 8.210 8.832 -0.622 1
1 825 . 14 1 1 A 66 66 ASP HA H 66 5.320 4.973 0.347 1
1 828 . 14 1 1 A 66 66 ASP C C 66 174.800 175.238 -0.438 1
1 829 . 14 1 1 A 66 66 ASP CA C 66 51.700 53.617 -1.917 1
1 830 . 14 1 1 A 66 66 ASP CB C 66 43.200 41.842 1.358 1
1 831 . 14 1 1 A 66 66 ASP N N 66 123.100 127.767 -4.667 1
1 832 . 14 1 1 A 67 67 ILE H H 67 8.540 9.127 -0.587 1
1 833 . 14 1 1 A 67 67 ILE HA H 67 4.630 4.698 -0.068 1
1 843 . 14 1 1 A 67 67 ILE C C 67 175.600 175.961 -0.361 1
1 844 . 14 1 1 A 67 67 ILE CA C 67 56.900 60.543 -3.643 1
1 845 . 14 1 1 A 67 67 ILE CB C 67 35.300 37.984 -2.684 1
1 849 . 14 1 1 A 67 67 ILE N N 67 119.200 125.117 -5.917 1
1 850 . 14 1 1 A 68 68 ILE H H 68 9.420 9.287 0.133 1
1 851 . 14 1 1 A 68 68 ILE HA H 68 4.980 5.293 -0.313 1
1 861 . 14 1 1 A 68 68 ILE C C 68 175.000 174.129 0.871 1
1 862 . 14 1 1 A 68 68 ILE CA C 68 58.600 58.940 -0.340 1
1 863 . 14 1 1 A 68 68 ILE CB C 68 40.900 41.018 -0.118 1
1 867 . 14 1 1 A 68 68 ILE N N 68 125.000 123.174 1.826 1
1 868 . 14 1 1 A 69 69 CYS H H 69 8.870 8.875 -0.005 1
1 869 . 14 1 1 A 69 69 CYS HA H 69 4.610 4.949 -0.339 1
1 872 . 14 1 1 A 69 69 CYS C C 69 176.200 174.726 1.474 1
1 873 . 14 1 1 A 69 69 CYS CA C 69 58.900 57.918 0.982 1
1 874 . 14 1 1 A 69 69 CYS CB C 69 27.100 28.743 -1.643 1
1 875 . 14 1 1 A 69 69 CYS N N 69 122.300 123.132 -0.832 1
1 876 . 14 1 1 A 70 70 THR H H 70 8.270 8.515 -0.245 1
1 877 . 14 1 1 A 70 70 THR HA H 70 4.710 4.512 0.198 1
1 882 . 14 1 1 A 70 70 THR C C 70 173.600 173.868 -0.268 1
1 883 . 14 1 1 A 70 70 THR CA C 70 61.500 62.233 -0.733 1
1 884 . 14 1 1 A 70 70 THR CB C 70 68.100 69.329 -1.229 1
1 886 . 14 1 1 A 70 70 THR N N 70 116.700 119.901 -3.201 1
1 887 . 14 1 1 A 71 71 LYS H H 71 7.370 7.483 -0.113 1
1 888 . 14 1 1 A 71 71 LYS HA H 71 4.520 4.657 -0.137 1
1 897 . 14 1 1 A 71 71 LYS CA C 71 55.100 55.172 -0.072 1
1 898 . 14 1 1 A 71 71 LYS CB C 71 37.800 34.065 3.735 1
1 902 . 14 1 1 A 71 71 LYS N N 71 120.900 122.767 -1.867 1
1 903 . 14 1 1 A 72 72 ASN H H 72 8.580 8.699 -0.119 1
1 904 . 14 1 1 A 72 72 ASN HA H 72 4.620 4.937 -0.317 1
1 909 . 14 1 1 A 72 72 ASN C C 72 173.500 174.080 -0.580 1
1 910 . 14 1 1 A 72 72 ASN CA C 72 52.200 52.486 -0.286 1
1 911 . 14 1 1 A 72 72 ASN CB C 72 38.500 38.975 -0.475 1
1 912 . 14 1 1 A 72 72 ASN N N 72 122.700 123.603 -0.903 1
1 914 . 14 1 1 A 73 73 LEU H H 73 8.100 9.090 -0.990 1
1 915 . 14 1 1 A 73 73 LEU HA H 73 4.680 4.756 -0.076 1
1 925 . 14 1 1 A 73 73 LEU CA C 73 51.000 51.227 -0.227 1
1 926 . 14 1 1 A 73 73 LEU CB C 73 42.500 42.504 -0.004 1
1 930 . 14 1 1 A 73 73 LEU N N 73 125.100 126.248 -1.148 1
1 931 . 14 1 1 A 74 74 PRO HA H 74 4.670 4.900 -0.230 1
1 938 . 14 1 1 A 74 74 PRO C C 74 176.500 176.597 -0.097 1
1 939 . 14 1 1 A 74 74 PRO CA C 74 61.800 62.607 -0.807 1
1 940 . 14 1 1 A 74 74 PRO CB C 74 32.800 31.920 0.880 1
1 943 . 14 1 1 A 75 75 LYS H H 75 8.280 8.419 -0.139 1
1 944 . 14 1 1 A 75 75 LYS HA H 75 4.110 4.566 -0.456 1
1 953 . 14 1 1 A 75 75 LYS CA C 75 56.500 56.114 0.386 1
1 954 . 14 1 1 A 75 75 LYS CB C 75 33.300 32.786 0.514 1
1 958 . 14 1 1 A 75 75 LYS N N 75 117.000 122.474 -5.474 1
1 959 . 14 1 1 A 76 76 ASP H H 76 8.570 8.870 -0.300 1
1 960 . 14 1 1 A 76 76 ASP HA H 76 4.530 5.066 -0.536 1
1 963 . 14 1 1 A 76 76 ASP C C 76 176.300 174.623 1.677 1
1 964 . 14 1 1 A 76 76 ASP CA C 76 55.000 52.586 2.414 1
1 965 . 14 1 1 A 76 76 ASP CB C 76 41.100 41.614 -0.514 1
1 966 . 14 1 1 A 76 76 ASP N N 76 122.700 128.089 -5.389 1
1 967 . 14 1 1 A 77 77 SER H H 77 8.330 9.044 -0.714 1
1 968 . 14 1 1 A 77 77 SER HA H 77 4.410 4.464 -0.054 1
1 971 . 14 1 1 A 77 77 SER C C 77 174.300 173.967 0.333 1
1 972 . 14 1 1 A 77 77 SER CA C 77 58.000 59.215 -1.215 1
1 973 . 14 1 1 A 77 77 SER CB C 77 63.900 62.677 1.223 1
1 974 . 14 1 1 A 77 77 SER N N 77 116.100 123.185 -7.085 1
1 975 . 14 1 1 A 78 78 LEU H H 78 8.350 8.645 -0.295 1
1 976 . 14 1 1 A 78 78 LEU HA H 78 4.280 4.625 -0.345 1
1 986 . 14 1 1 A 78 78 LEU C C 78 177.200 177.298 -0.098 1
1 987 . 14 1 1 A 78 78 LEU CA C 78 55.200 55.052 0.148 1
1 988 . 14 1 1 A 78 78 LEU CB C 78 42.100 42.951 -0.851 1
1 992 . 14 1 1 A 78 78 LEU N N 78 124.300 127.126 -2.826 1
1 993 . 14 1 1 A 79 79 GLU H H 79 8.300 7.734 0.566 1
1 994 . 14 1 1 A 79 79 GLU CA C 79 56.400 55.480 0.920 1
1 995 . 14 1 1 A 79 79 GLU CB C 79 30.200 29.496 0.704 1
1 1 . 15 1 1 A 2 2 HIS HA H 2 4.640 4.972 -0.332 1
1 4 . 15 1 1 A 2 2 HIS C C 2 173.600 174.836 -1.236 1
1 5 . 15 1 1 A 2 2 HIS CA C 2 56.500 55.238 1.262 1
1 6 . 15 1 1 A 2 2 HIS CB C 2 31.000 30.489 0.511 1
1 7 . 15 1 1 A 3 3 LYS H H 3 8.160 7.653 0.507 1
1 8 . 15 1 1 A 3 3 LYS HA H 3 4.660 4.410 0.250 1
1 17 . 15 1 1 A 3 3 LYS C C 3 174.400 175.073 -0.673 1
1 18 . 15 1 1 A 3 3 LYS CA C 3 54.800 56.230 -1.430 1
1 19 . 15 1 1 A 3 3 LYS CB C 3 35.800 33.127 2.673 1
1 23 . 15 1 1 A 3 3 LYS N N 3 121.900 120.578 1.322 1
1 24 . 15 1 1 A 4 4 ASP H H 4 8.470 9.020 -0.550 1
1 25 . 15 1 1 A 4 4 ASP HA H 4 4.900 5.146 -0.246 1
1 28 . 15 1 1 A 4 4 ASP C C 4 176.900 175.737 1.163 1
1 29 . 15 1 1 A 4 4 ASP CA C 4 52.700 52.472 0.228 1
1 30 . 15 1 1 A 4 4 ASP CB C 4 44.100 44.024 0.076 1
1 31 . 15 1 1 A 4 4 ASP N N 4 117.900 123.992 -6.092 1
1 32 . 15 1 1 A 5 5 ILE H H 5 9.570 8.584 0.986 1
1 33 . 15 1 1 A 5 5 ILE HA H 5 3.640 4.024 -0.384 1
1 43 . 15 1 1 A 5 5 ILE C C 5 174.800 176.016 -1.216 1
1 44 . 15 1 1 A 5 5 ILE CA C 5 60.900 61.997 -1.097 1
1 45 . 15 1 1 A 5 5 ILE CB C 5 37.000 37.483 -0.483 1
1 49 . 15 1 1 A 5 5 ILE N N 5 124.400 123.070 1.330 1
1 50 . 15 1 1 A 6 6 PHE H H 6 7.790 8.815 -1.025 1
1 51 . 15 1 1 A 6 6 PHE HA H 6 3.160 4.674 -1.514 1
1 58 . 15 1 1 A 6 6 PHE C C 6 173.500 174.263 -0.763 1
1 59 . 15 1 1 A 6 6 PHE CA C 6 56.900 56.705 0.195 1
1 60 . 15 1 1 A 6 6 PHE CB C 6 40.100 38.817 1.283 1
1 65 . 15 1 1 A 6 6 PHE N N 6 130.200 128.759 1.441 1
1 66 . 15 1 1 A 7 7 THR H H 7 6.790 8.508 -1.718 1
1 67 . 15 1 1 A 7 7 THR HA H 7 4.530 5.258 -0.728 1
1 72 . 15 1 1 A 7 7 THR C C 7 172.300 172.742 -0.442 1
1 73 . 15 1 1 A 7 7 THR CA C 7 59.200 59.533 -0.333 1
1 74 . 15 1 1 A 7 7 THR CB C 7 71.000 71.160 -0.160 1
1 76 . 15 1 1 A 7 7 THR N N 7 117.900 122.236 -4.336 1
1 77 . 15 1 1 A 8 8 SER H H 8 7.600 8.456 -0.856 1
1 78 . 15 1 1 A 8 8 SER HA H 8 4.180 4.777 -0.597 1
1 81 . 15 1 1 A 8 8 SER C C 8 175.300 172.227 3.073 1
1 82 . 15 1 1 A 8 8 SER CA C 8 55.800 57.444 -1.644 1
1 83 . 15 1 1 A 8 8 SER CB C 8 64.000 67.338 -3.338 1
1 84 . 15 1 1 A 8 8 SER N N 8 113.400 123.688 -10.288 1
1 85 . 15 1 1 A 9 9 VAL H H 9 8.880 8.519 0.361 1
1 86 . 15 1 1 A 9 9 VAL HA H 9 5.220 4.711 0.509 1
1 94 . 15 1 1 A 9 9 VAL C C 9 174.000 174.251 -0.251 1
1 95 . 15 1 1 A 9 9 VAL CA C 9 59.100 61.243 -2.143 1
1 96 . 15 1 1 A 9 9 VAL CB C 9 36.500 32.870 3.630 1
1 99 . 15 1 1 A 9 9 VAL N N 9 114.700 121.101 -6.401 1
1 100 . 15 1 1 A 10 10 VAL H H 10 8.510 9.204 -0.694 1
1 101 . 15 1 1 A 10 10 VAL HA H 10 4.470 4.727 -0.257 1
1 109 . 15 1 1 A 10 10 VAL C C 10 173.700 175.104 -1.404 1
1 110 . 15 1 1 A 10 10 VAL CA C 10 59.400 59.678 -0.278 1
1 111 . 15 1 1 A 10 10 VAL CB C 10 36.000 34.119 1.881 1
1 114 . 15 1 1 A 10 10 VAL N N 10 117.100 128.545 -11.445 1
1 115 . 15 1 1 A 11 11 ARG H H 11 8.500 8.531 -0.031 1
1 116 . 15 1 1 A 11 11 ARG HA H 11 4.460 4.634 -0.174 1
1 123 . 15 1 1 A 11 11 ARG C C 11 174.500 175.770 -1.270 1
1 124 . 15 1 1 A 11 11 ARG CA C 11 57.400 56.341 1.059 1
1 125 . 15 1 1 A 11 11 ARG CB C 11 31.000 30.953 0.047 1
1 128 . 15 1 1 A 11 11 ARG N N 11 124.800 127.479 -2.679 1
1 129 . 15 1 1 A 12 12 VAL H H 12 7.650 8.752 -1.102 1
1 130 . 15 1 1 A 12 12 VAL HA H 12 4.970 4.878 0.092 1
1 138 . 15 1 1 A 12 12 VAL C C 12 176.700 174.859 1.841 1
1 139 . 15 1 1 A 12 12 VAL CA C 12 59.400 62.154 -2.754 1
1 140 . 15 1 1 A 12 12 VAL CB C 12 34.400 32.943 1.457 1
1 143 . 15 1 1 A 12 12 VAL N N 12 120.900 127.846 -6.946 1
1 144 . 15 1 1 A 13 13 ARG H H 13 9.020 8.546 0.474 1
1 145 . 15 1 1 A 13 13 ARG HA H 13 4.700 4.863 -0.163 1
1 152 . 15 1 1 A 13 13 ARG C C 13 176.000 175.517 0.483 1
1 153 . 15 1 1 A 13 13 ARG CA C 13 54.600 54.857 -0.257 1
1 154 . 15 1 1 A 13 13 ARG CB C 13 32.900 32.923 -0.023 1
1 157 . 15 1 1 A 13 13 ARG N N 13 127.500 126.918 0.582 1
1 158 . 15 1 1 A 14 14 GLY H H 14 8.640 8.444 0.196 1
1 159 . 15 1 1 A 14 14 GLY HA2 H 14 3.680 4.090 -0.410 1
1 160 . 15 1 1 A 14 14 GLY HA3 H 14 4.190 4.099 0.091 1
1 161 . 15 1 1 A 14 14 GLY C C 14 173.700 173.893 -0.193 1
1 162 . 15 1 1 A 14 14 GLY CA C 14 45.600 44.288 1.312 1
1 163 . 15 1 1 A 14 14 GLY N N 14 108.800 108.928 -0.128 1
1 164 . 15 1 1 A 15 15 SER H H 15 8.220 8.396 -0.176 1
1 165 . 15 1 1 A 15 15 SER HA H 15 5.020 4.801 0.219 1
1 168 . 15 1 1 A 15 15 SER C C 15 175.400 174.333 1.067 1
1 169 . 15 1 1 A 15 15 SER CA C 15 55.300 57.688 -2.388 1
1 170 . 15 1 1 A 15 15 SER CB C 15 64.900 63.377 1.523 1
1 171 . 15 1 1 A 15 15 SER N N 15 113.200 114.938 -1.738 1
1 172 . 15 1 1 A 16 16 LYS H H 16 9.930 7.755 2.175 1
1 173 . 15 1 1 A 16 16 LYS HA H 16 4.190 4.892 -0.702 1
1 182 . 15 1 1 A 16 16 LYS C C 16 176.500 176.055 0.445 1
1 183 . 15 1 1 A 16 16 LYS CA C 16 57.300 55.152 2.148 1
1 184 . 15 1 1 A 16 16 LYS CB C 16 32.300 33.911 -1.611 1
1 188 . 15 1 1 A 16 16 LYS N N 16 129.200 122.681 6.519 1
1 189 . 15 1 1 A 17 17 LYS H H 17 7.960 8.437 -0.477 1
1 190 . 15 1 1 A 17 17 LYS HA H 17 4.030 4.203 -0.173 1
1 199 . 15 1 1 A 17 17 LYS C C 17 175.600 176.420 -0.820 1
1 200 . 15 1 1 A 17 17 LYS CA C 17 56.900 58.231 -1.331 1
1 201 . 15 1 1 A 17 17 LYS CB C 17 34.700 32.965 1.735 1
1 205 . 15 1 1 A 17 17 LYS N N 17 118.500 120.070 -1.570 1
1 206 . 15 1 1 A 18 18 TYR H H 18 7.780 7.578 0.202 1
1 207 . 15 1 1 A 18 18 TYR HA H 18 4.760 4.664 0.096 1
1 214 . 15 1 1 A 18 18 TYR C C 18 174.000 175.770 -1.770 1
1 215 . 15 1 1 A 18 18 TYR CA C 18 56.800 58.254 -1.454 1
1 216 . 15 1 1 A 18 18 TYR CB C 18 41.100 39.374 1.726 1
1 221 . 15 1 1 A 18 18 TYR N N 18 117.100 118.275 -1.175 1
1 222 . 15 1 1 A 19 19 ASN H H 19 8.890 9.291 -0.401 1
1 223 . 15 1 1 A 19 19 ASN HA H 19 4.960 4.975 -0.015 1
1 228 . 15 1 1 A 19 19 ASN C C 19 176.100 174.654 1.446 1
1 229 . 15 1 1 A 19 19 ASN CA C 19 53.600 53.457 0.143 1
1 230 . 15 1 1 A 19 19 ASN CB C 19 40.300 41.205 -0.905 1
1 231 . 15 1 1 A 19 19 ASN N N 19 116.600 120.115 -3.515 1
1 233 . 15 1 1 A 20 20 VAL H H 20 7.730 7.717 0.013 1
1 234 . 15 1 1 A 20 20 VAL HA H 20 5.250 4.975 0.275 1
1 242 . 15 1 1 A 20 20 VAL C C 20 173.800 173.953 -0.153 1
1 243 . 15 1 1 A 20 20 VAL CA C 20 59.400 59.384 0.016 1
1 244 . 15 1 1 A 20 20 VAL CB C 20 37.600 35.848 1.752 1
1 247 . 15 1 1 A 20 20 VAL N N 20 113.900 117.022 -3.122 1
1 248 . 15 1 1 A 21 21 VAL H H 21 8.890 8.962 -0.072 1
1 249 . 15 1 1 A 21 21 VAL HA H 21 4.840 4.651 0.189 1
1 257 . 15 1 1 A 21 21 VAL CA C 21 56.800 57.527 -0.727 1
1 258 . 15 1 1 A 21 21 VAL CB C 21 36.000 35.478 0.522 1
1 261 . 15 1 1 A 21 21 VAL N N 21 118.500 122.155 -3.655 1
1 262 . 15 1 1 A 22 22 PRO HA H 22 4.940 5.001 -0.061 1
1 269 . 15 1 1 A 22 22 PRO C C 22 175.600 176.505 -0.905 1
1 270 . 15 1 1 A 22 22 PRO CA C 22 62.700 62.415 0.285 1
1 271 . 15 1 1 A 22 22 PRO CB C 22 31.800 31.990 -0.190 1
1 274 . 15 1 1 A 23 23 VAL H H 23 8.060 8.824 -0.764 1
1 275 . 15 1 1 A 23 23 VAL HA H 23 5.390 5.058 0.332 1
1 283 . 15 1 1 A 23 23 VAL C C 23 175.400 174.173 1.227 1
1 284 . 15 1 1 A 23 23 VAL CA C 23 57.800 59.248 -1.448 1
1 285 . 15 1 1 A 23 23 VAL CB C 23 36.300 36.062 0.238 1
1 288 . 15 1 1 A 23 23 VAL N N 23 110.900 116.730 -5.830 1
1 289 . 15 1 1 A 24 24 LYS H H 24 8.960 9.380 -0.420 1
1 290 . 15 1 1 A 24 24 LYS HA H 24 5.600 5.117 0.483 1
1 299 . 15 1 1 A 24 24 LYS C C 24 175.600 174.681 0.919 1
1 300 . 15 1 1 A 24 24 LYS CA C 24 54.200 54.294 -0.094 1
1 301 . 15 1 1 A 24 24 LYS CB C 24 37.000 36.413 0.587 1
1 305 . 15 1 1 A 24 24 LYS N N 24 117.900 121.602 -3.702 1
1 306 . 15 1 1 A 25 25 SER H H 25 8.950 8.426 0.524 1
1 307 . 15 1 1 A 25 25 SER HA H 25 5.190 5.213 -0.023 1
1 310 . 15 1 1 A 25 25 SER C C 25 173.800 175.707 -1.907 1
1 311 . 15 1 1 A 25 25 SER CA C 25 57.700 55.875 1.825 1
1 312 . 15 1 1 A 25 25 SER CB C 25 65.100 65.633 -0.533 1
1 313 . 15 1 1 A 25 25 SER N N 25 114.600 113.395 1.205 1
1 314 . 15 1 1 A 26 26 ASN H H 26 9.020 8.671 0.349 1
1 315 . 15 1 1 A 26 26 ASN HA H 26 4.370 4.636 -0.266 1
1 320 . 15 1 1 A 26 26 ASN C C 26 173.500 174.970 -1.470 1
1 321 . 15 1 1 A 26 26 ASN CA C 26 53.700 54.023 -0.323 1
1 322 . 15 1 1 A 26 26 ASN CB C 26 37.100 38.299 -1.199 1
1 323 . 15 1 1 A 26 26 ASN N N 26 118.300 119.312 -1.012 1
1 325 . 15 1 1 A 27 27 LYS H H 27 7.400 7.633 -0.233 1
1 326 . 15 1 1 A 27 27 LYS HA H 27 4.780 4.807 -0.027 1
1 335 . 15 1 1 A 27 27 LYS CA C 27 53.500 53.020 0.480 1
1 336 . 15 1 1 A 27 27 LYS CB C 27 34.100 35.690 -1.590 1
1 340 . 15 1 1 A 27 27 LYS N N 27 116.600 119.341 -2.741 1
1 341 . 15 1 1 A 28 28 PRO HA H 28 4.040 4.537 -0.497 1
1 348 . 15 1 1 A 28 28 PRO C C 28 174.500 175.804 -1.304 1
1 349 . 15 1 1 A 28 28 PRO CA C 28 63.200 63.107 0.093 1
1 350 . 15 1 1 A 28 28 PRO CB C 28 32.500 32.206 0.294 1
1 353 . 15 1 1 A 29 29 VAL H H 29 8.860 8.807 0.053 1
1 354 . 15 1 1 A 29 29 VAL HA H 29 4.420 4.589 -0.169 1
1 362 . 15 1 1 A 29 29 VAL C C 29 174.800 174.912 -0.112 1
1 363 . 15 1 1 A 29 29 VAL CA C 29 60.300 60.154 0.146 1
1 364 . 15 1 1 A 29 29 VAL CB C 29 36.400 35.094 1.306 1
1 367 . 15 1 1 A 29 29 VAL N N 29 119.800 122.735 -2.935 1
1 368 . 15 1 1 A 30 30 GLU H H 30 9.550 8.682 0.868 1
1 369 . 15 1 1 A 30 30 GLU HA H 30 4.260 4.011 0.249 1
1 374 . 15 1 1 A 30 30 GLU C C 30 177.800 178.087 -0.287 1
1 375 . 15 1 1 A 30 30 GLU CA C 30 58.000 56.717 1.283 1
1 376 . 15 1 1 A 30 30 GLU CB C 30 29.700 29.695 0.005 1
1 378 . 15 1 1 A 30 30 GLU N N 30 128.900 124.539 4.361 1
1 379 . 15 1 1 A 31 31 ILE H H 31 7.910 8.280 -0.370 1
1 380 . 15 1 1 A 31 31 ILE HA H 31 2.120 3.920 -1.800 1
1 390 . 15 1 1 A 31 31 ILE C C 31 178.000 177.840 0.160 1
1 391 . 15 1 1 A 31 31 ILE CA C 31 63.500 63.061 0.439 1
1 392 . 15 1 1 A 31 31 ILE CB C 31 37.200 37.821 -0.621 1
1 396 . 15 1 1 A 31 31 ILE N N 31 122.500 124.536 -2.036 1
1 397 . 15 1 1 A 32 32 SER H H 32 7.940 8.106 -0.166 1
1 398 . 15 1 1 A 32 32 SER HA H 32 4.070 4.284 -0.214 1
1 401 . 15 1 1 A 32 32 SER C C 32 175.800 175.562 0.238 1
1 402 . 15 1 1 A 32 32 SER CA C 32 60.200 61.814 -1.614 1
1 403 . 15 1 1 A 32 32 SER CB C 32 62.100 63.087 -0.987 1
1 404 . 15 1 1 A 32 32 SER N N 32 115.300 118.932 -3.632 1
1 405 . 15 1 1 A 33 33 LYS H H 33 7.640 7.664 -0.024 1
1 406 . 15 1 1 A 33 33 LYS HA H 33 4.400 4.364 0.036 1
1 415 . 15 1 1 A 33 33 LYS C C 33 176.600 178.320 -1.720 1
1 416 . 15 1 1 A 33 33 LYS CA C 33 56.200 57.448 -1.248 1
1 417 . 15 1 1 A 33 33 LYS CB C 33 32.700 32.745 -0.045 1
1 421 . 15 1 1 A 33 33 LYS N N 33 119.800 119.364 0.436 1
1 422 . 15 1 1 A 34 34 TRP H H 34 7.860 8.062 -0.202 1
1 423 . 15 1 1 A 34 34 TRP HA H 34 3.870 4.197 -0.327 1
1 426 . 15 1 1 A 34 34 TRP C C 34 178.600 177.787 0.813 1
1 427 . 15 1 1 A 34 34 TRP CA C 34 60.200 60.832 -0.632 1
1 428 . 15 1 1 A 34 34 TRP CB C 34 28.500 29.479 -0.979 1
1 429 . 15 1 1 A 34 34 TRP N N 34 120.000 122.534 -2.534 1
1 430 . 15 1 1 A 35 35 ILE H H 35 8.200 8.317 -0.117 1
1 431 . 15 1 1 A 35 35 ILE HA H 35 3.990 3.529 0.461 1
1 441 . 15 1 1 A 35 35 ILE C C 35 177.900 177.221 0.679 1
1 442 . 15 1 1 A 35 35 ILE CA C 35 64.300 64.076 0.224 1
1 443 . 15 1 1 A 35 35 ILE CB C 35 37.200 37.391 -0.191 1
1 447 . 15 1 1 A 35 35 ILE N N 35 119.500 120.110 -0.610 1
1 448 . 15 1 1 A 36 36 ASP H H 36 7.680 8.139 -0.459 1
1 449 . 15 1 1 A 36 36 ASP HA H 36 4.490 4.306 0.184 1
1 452 . 15 1 1 A 36 36 ASP C C 36 179.200 178.645 0.555 1
1 453 . 15 1 1 A 36 36 ASP CA C 36 57.500 56.847 0.653 1
1 454 . 15 1 1 A 36 36 ASP CB C 36 40.400 40.250 0.150 1
1 455 . 15 1 1 A 36 36 ASP N N 36 122.000 121.014 0.986 1
1 456 . 15 1 1 A 37 37 PHE H H 37 8.450 8.604 -0.154 1
1 457 . 15 1 1 A 37 37 PHE HA H 37 4.080 4.210 -0.130 1
1 465 . 15 1 1 A 37 37 PHE C C 37 178.300 178.145 0.155 1
1 466 . 15 1 1 A 37 37 PHE CA C 37 58.600 60.074 -1.474 1
1 467 . 15 1 1 A 37 37 PHE CB C 37 37.000 38.382 -1.382 1
1 473 . 15 1 1 A 37 37 PHE N N 37 119.800 119.018 0.782 1
1 474 . 15 1 1 A 38 38 SER H H 38 8.580 8.169 0.411 1
1 475 . 15 1 1 A 38 38 SER HA H 38 4.250 4.173 0.077 1
1 478 . 15 1 1 A 38 38 SER C C 38 176.800 176.557 0.243 1
1 479 . 15 1 1 A 38 38 SER CA C 38 62.700 61.691 1.009 1
1 480 . 15 1 1 A 38 38 SER CB C 38 62.700 62.447 0.253 1
1 481 . 15 1 1 A 38 38 SER N N 38 115.800 114.898 0.902 1
1 482 . 15 1 1 A 39 39 ASN H H 39 8.190 7.981 0.209 1
1 483 . 15 1 1 A 39 39 ASN HA H 39 4.540 4.309 0.231 1
1 488 . 15 1 1 A 39 39 ASN C C 39 178.500 178.071 0.429 1
1 489 . 15 1 1 A 39 39 ASN CA C 39 56.200 56.415 -0.215 1
1 490 . 15 1 1 A 39 39 ASN CB C 39 37.900 38.299 -0.399 1
1 491 . 15 1 1 A 39 39 ASN N N 39 121.300 120.680 0.620 1
1 493 . 15 1 1 A 40 40 VAL H H 40 7.840 8.238 -0.398 1
1 494 . 15 1 1 A 40 40 VAL HA H 40 3.650 3.464 0.186 1
1 502 . 15 1 1 A 40 40 VAL C C 40 179.000 178.183 0.817 1
1 503 . 15 1 1 A 40 40 VAL CA C 40 66.600 66.466 0.134 1
1 504 . 15 1 1 A 40 40 VAL CB C 40 32.100 31.304 0.796 1
1 507 . 15 1 1 A 40 40 VAL N N 40 121.800 119.637 2.163 1
1 508 . 15 1 1 A 41 41 LEU H H 41 8.210 8.319 -0.109 1
1 509 . 15 1 1 A 41 41 LEU HA H 41 3.840 3.921 -0.081 1
1 519 . 15 1 1 A 41 41 LEU C C 41 178.800 179.015 -0.215 1
1 520 . 15 1 1 A 41 41 LEU CA C 41 57.400 57.559 -0.159 1
1 521 . 15 1 1 A 41 41 LEU CB C 41 41.200 41.079 0.121 1
1 525 . 15 1 1 A 41 41 LEU N N 41 117.700 120.400 -2.700 1
1 526 . 15 1 1 A 42 42 SER H H 42 7.980 8.295 -0.315 1
1 527 . 15 1 1 A 42 42 SER HA H 42 4.260 4.129 0.131 1
1 530 . 15 1 1 A 42 42 SER C C 42 174.900 174.629 0.271 1
1 531 . 15 1 1 A 42 42 SER CA C 42 61.200 61.380 -0.180 1
1 532 . 15 1 1 A 42 42 SER CB C 42 63.100 63.059 0.041 1
1 533 . 15 1 1 A 42 42 SER N N 42 113.200 116.528 -3.328 1
1 534 . 15 1 1 A 43 43 ARG H H 43 7.100 7.325 -0.225 1
1 535 . 15 1 1 A 43 43 ARG HA H 43 4.500 4.287 0.213 1
1 542 . 15 1 1 A 43 43 ARG C C 43 175.800 175.413 0.387 1
1 543 . 15 1 1 A 43 43 ARG CA C 43 55.600 55.464 0.136 1
1 544 . 15 1 1 A 43 43 ARG CB C 43 30.800 30.724 0.076 1
1 547 . 15 1 1 A 43 43 ARG N N 43 118.400 117.232 1.168 1
1 548 . 15 1 1 A 44 44 LEU H H 44 7.610 7.083 0.527 1
1 549 . 15 1 1 A 44 44 LEU HA H 44 4.590 4.565 0.025 1
1 559 . 15 1 1 A 44 44 LEU C C 44 175.300 174.210 1.090 1
1 560 . 15 1 1 A 44 44 LEU CA C 44 53.900 53.583 0.317 1
1 561 . 15 1 1 A 44 44 LEU CB C 44 44.100 42.550 1.550 1
1 565 . 15 1 1 A 44 44 LEU N N 44 120.400 122.396 -1.996 1
1 566 . 15 1 1 A 45 45 TYR H H 45 7.630 9.055 -1.425 1
1 567 . 15 1 1 A 45 45 TYR HA H 45 5.180 5.012 0.168 1
1 574 . 15 1 1 A 45 45 TYR C C 45 174.600 175.166 -0.566 1
1 575 . 15 1 1 A 45 45 TYR CA C 45 56.300 57.003 -0.703 1
1 576 . 15 1 1 A 45 45 TYR CB C 45 41.400 38.107 3.293 1
1 581 . 15 1 1 A 45 45 TYR N N 45 115.300 126.933 -11.633 1
1 582 . 15 1 1 A 46 46 VAL H H 46 8.770 9.022 -0.252 1
1 583 . 15 1 1 A 46 46 VAL HA H 46 4.540 5.073 -0.533 1
1 591 . 15 1 1 A 46 46 VAL C C 46 174.600 175.918 -1.318 1
1 592 . 15 1 1 A 46 46 VAL CA C 46 59.600 60.643 -1.043 1
1 593 . 15 1 1 A 46 46 VAL CB C 46 34.700 35.483 -0.783 1
1 596 . 15 1 1 A 46 46 VAL N N 46 115.400 123.807 -8.407 1
1 597 . 15 1 1 A 47 47 GLY H H 47 8.280 8.452 -0.172 1
1 598 . 15 1 1 A 47 47 GLY HA2 H 47 3.610 4.241 -0.631 1
1 599 . 15 1 1 A 47 47 GLY HA3 H 47 4.970 4.241 0.729 1
1 600 . 15 1 1 A 47 47 GLY C C 47 173.100 173.203 -0.103 1
1 601 . 15 1 1 A 47 47 GLY CA C 47 43.600 45.397 -1.797 1
1 602 . 15 1 1 A 47 47 GLY N N 47 109.900 111.241 -1.341 1
1 603 . 15 1 1 A 48 48 VAL H H 48 7.630 8.626 -0.996 1
1 604 . 15 1 1 A 48 48 VAL HA H 48 4.320 3.918 0.402 1
1 612 . 15 1 1 A 48 48 VAL CA C 48 58.700 62.791 -4.091 1
1 613 . 15 1 1 A 48 48 VAL CB C 48 32.100 30.759 1.341 1
1 616 . 15 1 1 A 48 48 VAL N N 48 109.900 118.611 -8.711 1
1 617 . 15 1 1 A 49 49 PRO HA H 49 4.800 4.484 0.316 1
1 624 . 15 1 1 A 49 49 PRO C C 49 176.700 176.472 0.228 1
1 625 . 15 1 1 A 49 49 PRO CA C 49 62.300 63.111 -0.811 1
1 626 . 15 1 1 A 49 49 PRO CB C 49 35.400 31.747 3.653 1
1 629 . 15 1 1 A 50 50 THR H H 50 8.790 8.386 0.404 1
1 630 . 15 1 1 A 50 50 THR HA H 50 4.690 4.946 -0.256 1
1 635 . 15 1 1 A 50 50 THR C C 50 173.500 173.800 -0.300 1
1 636 . 15 1 1 A 50 50 THR CA C 50 60.800 59.788 1.012 1
1 637 . 15 1 1 A 50 50 THR CB C 50 70.800 70.821 -0.021 1
1 639 . 15 1 1 A 50 50 THR N N 50 113.500 112.373 1.127 1
1 640 . 15 1 1 A 51 51 LYS H H 51 7.810 8.530 -0.720 1
1 641 . 15 1 1 A 51 51 LYS HA H 51 4.890 4.950 -0.060 1
1 650 . 15 1 1 A 51 51 LYS C C 51 175.900 175.695 0.205 1
1 651 . 15 1 1 A 51 51 LYS CA C 51 54.100 54.238 -0.138 1
1 652 . 15 1 1 A 51 51 LYS CB C 51 35.300 36.496 -1.196 1
1 656 . 15 1 1 A 51 51 LYS N N 51 122.200 120.006 2.194 1
1 657 . 15 1 1 A 52 52 SER H H 52 8.410 8.449 -0.039 1
1 658 . 15 1 1 A 52 52 SER HA H 52 3.630 4.170 -0.540 1
1 661 . 15 1 1 A 52 52 SER C C 52 175.800 175.319 0.481 1
1 662 . 15 1 1 A 52 52 SER CA C 52 58.800 59.917 -1.117 1
1 663 . 15 1 1 A 52 52 SER CB C 52 62.600 62.770 -0.170 1
1 664 . 15 1 1 A 52 52 SER N N 52 118.900 117.353 1.547 1
1 665 . 15 1 1 A 53 53 GLY H H 53 9.070 9.044 0.026 1
1 666 . 15 1 1 A 53 53 GLY HA2 H 53 3.390 3.913 -0.523 1
1 667 . 15 1 1 A 53 53 GLY HA3 H 53 4.460 3.913 0.547 1
1 668 . 15 1 1 A 53 53 GLY C C 53 174.100 174.330 -0.230 1
1 669 . 15 1 1 A 53 53 GLY CA C 53 44.800 45.459 -0.659 1
1 670 . 15 1 1 A 53 53 GLY N N 53 115.600 114.947 0.653 1
1 671 . 15 1 1 A 54 54 ASN H H 54 7.870 7.766 0.104 1
1 672 . 15 1 1 A 54 54 ASN HA H 54 4.570 4.828 -0.258 1
1 677 . 15 1 1 A 54 54 ASN C C 54 175.500 174.778 0.722 1
1 678 . 15 1 1 A 54 54 ASN CA C 54 53.000 52.463 0.537 1
1 679 . 15 1 1 A 54 54 ASN CB C 54 38.600 39.282 -0.682 1
1 680 . 15 1 1 A 54 54 ASN N N 54 119.600 119.291 0.309 1
1 682 . 15 1 1 A 55 55 VAL H H 55 8.770 8.859 -0.089 1
1 683 . 15 1 1 A 55 55 VAL HA H 55 3.880 4.134 -0.254 1
1 691 . 15 1 1 A 55 55 VAL C C 55 176.200 175.241 0.959 1
1 692 . 15 1 1 A 55 55 VAL CA C 55 63.700 62.776 0.924 1
1 693 . 15 1 1 A 55 55 VAL CB C 55 31.600 31.067 0.533 1
1 696 . 15 1 1 A 55 55 VAL N N 55 123.900 123.570 0.330 1
1 697 . 15 1 1 A 56 56 VAL H H 56 9.050 8.918 0.132 1
1 698 . 15 1 1 A 56 56 VAL HA H 56 3.990 3.894 0.096 1
1 706 . 15 1 1 A 56 56 VAL C C 56 175.200 176.124 -0.924 1
1 707 . 15 1 1 A 56 56 VAL CA C 56 62.700 64.795 -2.095 1
1 708 . 15 1 1 A 56 56 VAL CB C 56 32.900 32.319 0.581 1
1 711 . 15 1 1 A 56 56 VAL N N 56 127.500 129.086 -1.586 1
1 712 . 15 1 1 A 57 57 CYS H H 57 7.250 7.625 -0.375 1
1 713 . 15 1 1 A 57 57 CYS HA H 57 4.370 4.829 -0.459 1
1 716 . 15 1 1 A 57 57 CYS C C 57 171.900 172.644 -0.744 1
1 717 . 15 1 1 A 57 57 CYS CA C 57 58.600 57.699 0.901 1
1 718 . 15 1 1 A 57 57 CYS CB C 57 28.600 30.731 -2.131 1
1 719 . 15 1 1 A 57 57 CYS N N 57 117.600 117.450 0.150 1
1 720 . 15 1 1 A 58 58 LYS H H 58 8.880 8.709 0.171 1
1 721 . 15 1 1 A 58 58 LYS HA H 58 4.220 4.580 -0.360 1
1 730 . 15 1 1 A 58 58 LYS C C 58 176.000 176.368 -0.368 1
1 731 . 15 1 1 A 58 58 LYS CA C 58 54.400 55.345 -0.945 1
1 732 . 15 1 1 A 58 58 LYS CB C 58 33.600 33.720 -0.120 1
1 736 . 15 1 1 A 58 58 LYS N N 58 132.000 128.735 3.265 1
1 737 . 15 1 1 A 59 59 ASN H H 59 9.500 8.827 0.673 1
1 738 . 15 1 1 A 59 59 ASN HA H 59 4.040 4.853 -0.813 1
1 743 . 15 1 1 A 59 59 ASN C C 59 176.400 175.756 0.644 1
1 744 . 15 1 1 A 59 59 ASN CA C 59 53.200 53.717 -0.517 1
1 745 . 15 1 1 A 59 59 ASN CB C 59 35.900 36.907 -1.007 1
1 746 . 15 1 1 A 59 59 ASN N N 59 127.500 124.213 3.287 1
1 748 . 15 1 1 A 60 60 ILE H H 60 8.050 7.318 0.732 1
1 749 . 15 1 1 A 60 60 ILE HA H 60 3.680 3.932 -0.252 1
1 759 . 15 1 1 A 60 60 ILE C C 60 175.700 176.391 -0.691 1
1 760 . 15 1 1 A 60 60 ILE CA C 60 61.900 63.782 -1.882 1
1 761 . 15 1 1 A 60 60 ILE CB C 60 38.300 37.801 0.499 1
1 765 . 15 1 1 A 60 60 ILE N N 60 120.200 121.085 -0.885 1
1 766 . 15 1 1 A 61 61 MET H H 61 9.590 7.427 2.163 1
1 767 . 15 1 1 A 61 61 MET HA H 61 3.920 4.549 -0.629 1
1 775 . 15 1 1 A 61 61 MET C C 61 174.300 175.424 -1.124 1
1 776 . 15 1 1 A 61 61 MET CA C 61 57.000 54.730 2.270 1
1 777 . 15 1 1 A 61 61 MET CB C 61 31.300 32.554 -1.254 1
1 780 . 15 1 1 A 61 61 MET N N 61 124.400 117.545 6.855 1
1 781 . 15 1 1 A 62 62 ASN H H 62 8.250 7.978 0.272 1
1 782 . 15 1 1 A 62 62 ASN HA H 62 4.400 4.392 0.008 1
1 787 . 15 1 1 A 62 62 ASN C C 62 176.800 174.961 1.839 1
1 788 . 15 1 1 A 62 62 ASN CA C 62 54.400 53.918 0.482 1
1 789 . 15 1 1 A 62 62 ASN CB C 62 37.600 36.897 0.703 1
1 790 . 15 1 1 A 62 62 ASN N N 62 111.900 116.697 -4.797 1
1 792 . 15 1 1 A 63 63 THR H H 63 7.480 8.227 -0.747 1
1 793 . 15 1 1 A 63 63 THR HA H 63 4.210 4.575 -0.365 1
1 798 . 15 1 1 A 63 63 THR C C 63 177.100 174.814 2.286 1
1 799 . 15 1 1 A 63 63 THR CA C 63 62.900 61.290 1.610 1
1 800 . 15 1 1 A 63 63 THR CB C 63 72.500 70.464 2.036 1
1 802 . 15 1 1 A 63 63 THR N N 63 105.900 115.626 -9.726 1
1 803 . 15 1 1 A 64 64 GLY H H 64 9.110 8.019 1.091 1
1 804 . 15 1 1 A 64 64 GLY HA2 H 64 3.580 3.980 -0.400 1
1 805 . 15 1 1 A 64 64 GLY HA3 H 64 4.090 3.982 0.108 1
1 806 . 15 1 1 A 64 64 GLY C C 64 173.200 174.313 -1.113 1
1 807 . 15 1 1 A 64 64 GLY CA C 64 45.300 46.744 -1.444 1
1 808 . 15 1 1 A 64 64 GLY N N 64 111.500 110.853 0.647 1
1 809 . 15 1 1 A 65 65 VAL H H 65 7.580 7.162 0.418 1
1 810 . 15 1 1 A 65 65 VAL HA H 65 4.060 4.593 -0.533 1
1 818 . 15 1 1 A 65 65 VAL C C 65 172.900 174.513 -1.613 1
1 819 . 15 1 1 A 65 65 VAL CA C 65 61.400 61.274 0.126 1
1 820 . 15 1 1 A 65 65 VAL CB C 65 32.900 34.615 -1.715 1
1 823 . 15 1 1 A 65 65 VAL N N 65 121.600 119.450 2.150 1
1 824 . 15 1 1 A 66 66 ASP H H 66 8.210 9.461 -1.251 1
1 825 . 15 1 1 A 66 66 ASP HA H 66 5.320 5.035 0.285 1
1 828 . 15 1 1 A 66 66 ASP C C 66 174.800 175.248 -0.448 1
1 829 . 15 1 1 A 66 66 ASP CA C 66 51.700 53.718 -2.018 1
1 830 . 15 1 1 A 66 66 ASP CB C 66 43.200 41.906 1.294 1
1 831 . 15 1 1 A 66 66 ASP N N 66 123.100 128.022 -4.922 1
1 832 . 15 1 1 A 67 67 ILE H H 67 8.540 9.054 -0.514 1
1 833 . 15 1 1 A 67 67 ILE HA H 67 4.630 4.551 0.079 1
1 843 . 15 1 1 A 67 67 ILE C C 67 175.600 175.654 -0.054 1
1 844 . 15 1 1 A 67 67 ILE CA C 67 56.900 60.758 -3.858 1
1 845 . 15 1 1 A 67 67 ILE CB C 67 35.300 37.115 -1.815 1
1 849 . 15 1 1 A 67 67 ILE N N 67 119.200 125.462 -6.262 1
1 850 . 15 1 1 A 68 68 ILE H H 68 9.420 8.998 0.422 1
1 851 . 15 1 1 A 68 68 ILE HA H 68 4.980 5.388 -0.408 1
1 861 . 15 1 1 A 68 68 ILE C C 68 175.000 174.323 0.677 1
1 862 . 15 1 1 A 68 68 ILE CA C 68 58.600 58.962 -0.362 1
1 863 . 15 1 1 A 68 68 ILE CB C 68 40.900 40.206 0.694 1
1 867 . 15 1 1 A 68 68 ILE N N 68 125.000 123.369 1.631 1
1 868 . 15 1 1 A 69 69 CYS H H 69 8.870 9.336 -0.466 1
1 869 . 15 1 1 A 69 69 CYS HA H 69 4.610 4.999 -0.389 1
1 872 . 15 1 1 A 69 69 CYS C C 69 176.200 174.748 1.452 1
1 873 . 15 1 1 A 69 69 CYS CA C 69 58.900 57.758 1.142 1
1 874 . 15 1 1 A 69 69 CYS CB C 69 27.100 30.116 -3.016 1
1 875 . 15 1 1 A 69 69 CYS N N 69 122.300 124.265 -1.965 1
1 876 . 15 1 1 A 70 70 THR H H 70 8.270 8.804 -0.534 1
1 877 . 15 1 1 A 70 70 THR HA H 70 4.710 4.576 0.134 1
1 882 . 15 1 1 A 70 70 THR C C 70 173.600 173.878 -0.278 1
1 883 . 15 1 1 A 70 70 THR CA C 70 61.500 61.379 0.121 1
1 884 . 15 1 1 A 70 70 THR CB C 70 68.100 69.852 -1.752 1
1 886 . 15 1 1 A 70 70 THR N N 70 116.700 118.839 -2.139 1
1 887 . 15 1 1 A 71 71 LYS H H 71 7.370 7.141 0.229 1
1 888 . 15 1 1 A 71 71 LYS HA H 71 4.520 4.715 -0.195 1
1 897 . 15 1 1 A 71 71 LYS CA C 71 55.100 55.166 -0.066 1
1 898 . 15 1 1 A 71 71 LYS CB C 71 37.800 34.060 3.740 1
1 902 . 15 1 1 A 71 71 LYS N N 71 120.900 122.832 -1.932 1
1 903 . 15 1 1 A 72 72 ASN H H 72 8.580 8.759 -0.179 1
1 904 . 15 1 1 A 72 72 ASN HA H 72 4.620 5.018 -0.398 1
1 909 . 15 1 1 A 72 72 ASN C C 72 173.500 174.519 -1.019 1
1 910 . 15 1 1 A 72 72 ASN CA C 72 52.200 52.834 -0.634 1
1 911 . 15 1 1 A 72 72 ASN CB C 72 38.500 39.616 -1.116 1
1 912 . 15 1 1 A 72 72 ASN N N 72 122.700 124.619 -1.919 1
1 914 . 15 1 1 A 73 73 LEU H H 73 8.100 8.970 -0.870 1
1 915 . 15 1 1 A 73 73 LEU HA H 73 4.680 5.173 -0.493 1
1 925 . 15 1 1 A 73 73 LEU CA C 73 51.000 51.466 -0.466 1
1 926 . 15 1 1 A 73 73 LEU CB C 73 42.500 42.501 -0.001 1
1 930 . 15 1 1 A 73 73 LEU N N 73 125.100 126.856 -1.756 1
1 931 . 15 1 1 A 74 74 PRO HA H 74 4.670 4.573 0.097 1
1 938 . 15 1 1 A 74 74 PRO C C 74 176.500 177.865 -1.365 1
1 939 . 15 1 1 A 74 74 PRO CA C 74 61.800 63.340 -1.540 1
1 940 . 15 1 1 A 74 74 PRO CB C 74 32.800 31.913 0.887 1
1 943 . 15 1 1 A 75 75 LYS H H 75 8.280 8.829 -0.549 1
1 944 . 15 1 1 A 75 75 LYS HA H 75 4.110 4.092 0.018 1
1 953 . 15 1 1 A 75 75 LYS CA C 75 56.500 59.327 -2.827 1
1 954 . 15 1 1 A 75 75 LYS CB C 75 33.300 33.255 0.045 1
1 958 . 15 1 1 A 75 75 LYS N N 75 117.000 124.294 -7.294 1
1 959 . 15 1 1 A 76 76 ASP H H 76 8.570 8.284 0.286 1
1 960 . 15 1 1 A 76 76 ASP HA H 76 4.530 4.906 -0.376 1
1 963 . 15 1 1 A 76 76 ASP C C 76 176.300 174.672 1.628 1
1 964 . 15 1 1 A 76 76 ASP CA C 76 55.000 53.210 1.790 1
1 965 . 15 1 1 A 76 76 ASP CB C 76 41.100 41.614 -0.514 1
1 966 . 15 1 1 A 76 76 ASP N N 76 122.700 118.505 4.195 1
1 967 . 15 1 1 A 77 77 SER H H 77 8.330 8.910 -0.580 1
1 968 . 15 1 1 A 77 77 SER HA H 77 4.410 4.528 -0.118 1
1 971 . 15 1 1 A 77 77 SER C C 77 174.300 172.852 1.448 1
1 972 . 15 1 1 A 77 77 SER CA C 77 58.000 57.822 0.178 1
1 973 . 15 1 1 A 77 77 SER CB C 77 63.900 63.102 0.798 1
1 974 . 15 1 1 A 77 77 SER N N 77 116.100 120.661 -4.561 1
1 975 . 15 1 1 A 78 78 LEU H H 78 8.350 8.783 -0.433 1
1 976 . 15 1 1 A 78 78 LEU HA H 78 4.280 4.646 -0.366 1
1 986 . 15 1 1 A 78 78 LEU C C 78 177.200 174.939 2.261 1
1 987 . 15 1 1 A 78 78 LEU CA C 78 55.200 54.543 0.657 1
1 988 . 15 1 1 A 78 78 LEU CB C 78 42.100 40.287 1.813 1
1 992 . 15 1 1 A 78 78 LEU N N 78 124.300 129.161 -4.861 1
1 993 . 15 1 1 A 79 79 GLU H H 79 8.300 8.413 -0.113 1
1 994 . 15 1 1 A 79 79 GLU CA C 79 56.400 55.346 1.054 1
1 995 . 15 1 1 A 79 79 GLU CB C 79 30.200 31.444 -1.244 1
1 1 . 16 1 1 A 2 2 HIS HA H 2 4.640 4.828 -0.188 1
1 4 . 16 1 1 A 2 2 HIS C C 2 173.600 173.208 0.392 1
1 5 . 16 1 1 A 2 2 HIS CA C 2 56.500 56.230 0.270 1
1 6 . 16 1 1 A 2 2 HIS CB C 2 31.000 32.854 -1.854 1
1 7 . 16 1 1 A 3 3 LYS H H 3 8.160 8.544 -0.384 1
1 8 . 16 1 1 A 3 3 LYS HA H 3 4.660 5.040 -0.380 1
1 17 . 16 1 1 A 3 3 LYS C C 3 174.400 174.819 -0.419 1
1 18 . 16 1 1 A 3 3 LYS CA C 3 54.800 55.748 -0.948 1
1 19 . 16 1 1 A 3 3 LYS CB C 3 35.800 33.204 2.596 1
1 23 . 16 1 1 A 3 3 LYS N N 3 121.900 126.667 -4.767 1
1 24 . 16 1 1 A 4 4 ASP H H 4 8.470 9.493 -1.023 1
1 25 . 16 1 1 A 4 4 ASP HA H 4 4.900 5.415 -0.515 1
1 28 . 16 1 1 A 4 4 ASP C C 4 176.900 174.912 1.988 1
1 29 . 16 1 1 A 4 4 ASP CA C 4 52.700 52.688 0.012 1
1 30 . 16 1 1 A 4 4 ASP CB C 4 44.100 45.482 -1.382 1
1 31 . 16 1 1 A 4 4 ASP N N 4 117.900 124.868 -6.968 1
1 32 . 16 1 1 A 5 5 ILE H H 5 9.570 8.923 0.647 1
1 33 . 16 1 1 A 5 5 ILE HA H 5 3.640 4.416 -0.776 1
1 43 . 16 1 1 A 5 5 ILE C C 5 174.800 175.338 -0.538 1
1 44 . 16 1 1 A 5 5 ILE CA C 5 60.900 60.284 0.616 1
1 45 . 16 1 1 A 5 5 ILE CB C 5 37.000 38.374 -1.374 1
1 49 . 16 1 1 A 5 5 ILE N N 5 124.400 121.882 2.518 1
1 50 . 16 1 1 A 6 6 PHE H H 6 7.790 8.922 -1.132 1
1 51 . 16 1 1 A 6 6 PHE HA H 6 3.160 3.552 -0.392 1
1 58 . 16 1 1 A 6 6 PHE C C 6 173.500 174.604 -1.104 1
1 59 . 16 1 1 A 6 6 PHE CA C 6 56.900 58.012 -1.112 1
1 60 . 16 1 1 A 6 6 PHE CB C 6 40.100 38.998 1.102 1
1 65 . 16 1 1 A 6 6 PHE N N 6 130.200 128.800 1.400 1
1 66 . 16 1 1 A 7 7 THR H H 7 6.790 8.177 -1.387 1
1 67 . 16 1 1 A 7 7 THR HA H 7 4.530 4.998 -0.468 1
1 72 . 16 1 1 A 7 7 THR C C 7 172.300 172.795 -0.495 1
1 73 . 16 1 1 A 7 7 THR CA C 7 59.200 59.501 -0.301 1
1 74 . 16 1 1 A 7 7 THR CB C 7 71.000 70.922 0.078 1
1 76 . 16 1 1 A 7 7 THR N N 7 117.900 117.008 0.892 1
1 77 . 16 1 1 A 8 8 SER H H 8 7.600 8.359 -0.759 1
1 78 . 16 1 1 A 8 8 SER HA H 8 4.180 4.669 -0.489 1
1 81 . 16 1 1 A 8 8 SER C C 8 175.300 171.573 3.727 1
1 82 . 16 1 1 A 8 8 SER CA C 8 55.800 55.766 0.034 1
1 83 . 16 1 1 A 8 8 SER CB C 8 64.000 64.277 -0.277 1
1 84 . 16 1 1 A 8 8 SER N N 8 113.400 117.703 -4.303 1
1 85 . 16 1 1 A 9 9 VAL H H 9 8.880 8.608 0.272 1
1 86 . 16 1 1 A 9 9 VAL HA H 9 5.220 4.941 0.279 1
1 94 . 16 1 1 A 9 9 VAL C C 9 174.000 172.906 1.094 1
1 95 . 16 1 1 A 9 9 VAL CA C 9 59.100 60.172 -1.072 1
1 96 . 16 1 1 A 9 9 VAL CB C 9 36.500 35.508 0.992 1
1 99 . 16 1 1 A 9 9 VAL N N 9 114.700 121.141 -6.441 1
1 100 . 16 1 1 A 10 10 VAL H H 10 8.510 9.218 -0.708 1
1 101 . 16 1 1 A 10 10 VAL HA H 10 4.470 4.950 -0.480 1
1 109 . 16 1 1 A 10 10 VAL C C 10 173.700 175.068 -1.368 1
1 110 . 16 1 1 A 10 10 VAL CA C 10 59.400 59.427 -0.027 1
1 111 . 16 1 1 A 10 10 VAL CB C 10 36.000 35.563 0.437 1
1 114 . 16 1 1 A 10 10 VAL N N 10 117.100 126.246 -9.146 1
1 115 . 16 1 1 A 11 11 ARG H H 11 8.500 8.467 0.033 1
1 116 . 16 1 1 A 11 11 ARG HA H 11 4.460 4.574 -0.114 1
1 123 . 16 1 1 A 11 11 ARG C C 11 174.500 176.087 -1.587 1
1 124 . 16 1 1 A 11 11 ARG CA C 11 57.400 56.549 0.851 1
1 125 . 16 1 1 A 11 11 ARG CB C 11 31.000 31.055 -0.055 1
1 128 . 16 1 1 A 11 11 ARG N N 11 124.800 126.402 -1.602 1
1 129 . 16 1 1 A 12 12 VAL H H 12 7.650 9.218 -1.568 1
1 130 . 16 1 1 A 12 12 VAL HA H 12 4.970 5.049 -0.079 1
1 138 . 16 1 1 A 12 12 VAL C C 12 176.700 175.191 1.509 1
1 139 . 16 1 1 A 12 12 VAL CA C 12 59.400 60.982 -1.582 1
1 140 . 16 1 1 A 12 12 VAL CB C 12 34.400 33.871 0.529 1
1 143 . 16 1 1 A 12 12 VAL N N 12 120.900 123.041 -2.141 1
1 144 . 16 1 1 A 13 13 ARG H H 13 9.020 9.159 -0.139 1
1 145 . 16 1 1 A 13 13 ARG HA H 13 4.700 4.865 -0.165 1
1 152 . 16 1 1 A 13 13 ARG C C 13 176.000 175.029 0.971 1
1 153 . 16 1 1 A 13 13 ARG CA C 13 54.600 54.782 -0.182 1
1 154 . 16 1 1 A 13 13 ARG CB C 13 32.900 32.913 -0.013 1
1 157 . 16 1 1 A 13 13 ARG N N 13 127.500 126.328 1.172 1
1 158 . 16 1 1 A 14 14 GLY H H 14 8.640 8.417 0.223 1
1 159 . 16 1 1 A 14 14 GLY HA2 H 14 3.680 4.103 -0.423 1
1 160 . 16 1 1 A 14 14 GLY HA3 H 14 4.190 4.108 0.082 1
1 161 . 16 1 1 A 14 14 GLY C C 14 173.700 175.011 -1.311 1
1 162 . 16 1 1 A 14 14 GLY CA C 14 45.600 43.934 1.666 1
1 163 . 16 1 1 A 14 14 GLY N N 14 108.800 111.289 -2.489 1
1 164 . 16 1 1 A 15 15 SER H H 15 8.220 8.415 -0.195 1
1 165 . 16 1 1 A 15 15 SER HA H 15 5.020 4.558 0.462 1
1 168 . 16 1 1 A 15 15 SER C C 15 175.400 173.482 1.918 1
1 169 . 16 1 1 A 15 15 SER CA C 15 55.300 58.489 -3.189 1
1 170 . 16 1 1 A 15 15 SER CB C 15 64.900 63.667 1.233 1
1 171 . 16 1 1 A 15 15 SER N N 15 113.200 120.111 -6.911 1
1 172 . 16 1 1 A 16 16 LYS H H 16 9.930 7.726 2.204 1
1 173 . 16 1 1 A 16 16 LYS HA H 16 4.190 4.696 -0.506 1
1 182 . 16 1 1 A 16 16 LYS C C 16 176.500 174.494 2.006 1
1 183 . 16 1 1 A 16 16 LYS CA C 16 57.300 55.094 2.206 1
1 184 . 16 1 1 A 16 16 LYS CB C 16 32.300 36.108 -3.808 1
1 188 . 16 1 1 A 16 16 LYS N N 16 129.200 117.345 11.855 1
1 189 . 16 1 1 A 17 17 LYS H H 17 7.960 8.511 -0.551 1
1 190 . 16 1 1 A 17 17 LYS HA H 17 4.030 4.554 -0.524 1
1 199 . 16 1 1 A 17 17 LYS C C 17 175.600 175.215 0.385 1
1 200 . 16 1 1 A 17 17 LYS CA C 17 56.900 55.325 1.575 1
1 201 . 16 1 1 A 17 17 LYS CB C 17 34.700 31.912 2.788 1
1 205 . 16 1 1 A 17 17 LYS N N 17 118.500 123.467 -4.967 1
1 206 . 16 1 1 A 18 18 TYR H H 18 7.780 8.623 -0.843 1
1 207 . 16 1 1 A 18 18 TYR HA H 18 4.760 5.175 -0.415 1
1 214 . 16 1 1 A 18 18 TYR C C 18 174.000 175.664 -1.664 1
1 215 . 16 1 1 A 18 18 TYR CA C 18 56.800 56.336 0.464 1
1 216 . 16 1 1 A 18 18 TYR CB C 18 41.100 41.466 -0.366 1
1 221 . 16 1 1 A 18 18 TYR N N 18 117.100 128.032 -10.932 1
1 222 . 16 1 1 A 19 19 ASN H H 19 8.890 8.889 0.001 1
1 223 . 16 1 1 A 19 19 ASN HA H 19 4.960 4.731 0.229 1
1 228 . 16 1 1 A 19 19 ASN C C 19 176.100 175.311 0.789 1
1 229 . 16 1 1 A 19 19 ASN CA C 19 53.600 55.278 -1.678 1
1 230 . 16 1 1 A 19 19 ASN CB C 19 40.300 38.397 1.903 1
1 231 . 16 1 1 A 19 19 ASN N N 19 116.600 124.138 -7.538 1
1 233 . 16 1 1 A 20 20 VAL H H 20 7.730 7.848 -0.118 1
1 234 . 16 1 1 A 20 20 VAL HA H 20 5.250 5.141 0.109 1
1 242 . 16 1 1 A 20 20 VAL C C 20 173.800 173.872 -0.072 1
1 243 . 16 1 1 A 20 20 VAL CA C 20 59.400 59.502 -0.102 1
1 244 . 16 1 1 A 20 20 VAL CB C 20 37.600 35.622 1.978 1
1 247 . 16 1 1 A 20 20 VAL N N 20 113.900 113.720 0.180 1
1 248 . 16 1 1 A 21 21 VAL H H 21 8.890 9.341 -0.451 1
1 249 . 16 1 1 A 21 21 VAL HA H 21 4.840 4.779 0.061 1
1 257 . 16 1 1 A 21 21 VAL CA C 21 56.800 58.007 -1.207 1
1 258 . 16 1 1 A 21 21 VAL CB C 21 36.000 34.832 1.168 1
1 261 . 16 1 1 A 21 21 VAL N N 21 118.500 122.297 -3.797 1
1 262 . 16 1 1 A 22 22 PRO HA H 22 4.940 4.958 -0.018 1
1 269 . 16 1 1 A 22 22 PRO C C 22 175.600 176.450 -0.850 1
1 270 . 16 1 1 A 22 22 PRO CA C 22 62.700 62.583 0.117 1
1 271 . 16 1 1 A 22 22 PRO CB C 22 31.800 31.928 -0.128 1
1 274 . 16 1 1 A 23 23 VAL H H 23 8.060 8.603 -0.543 1
1 275 . 16 1 1 A 23 23 VAL HA H 23 5.390 5.051 0.339 1
1 283 . 16 1 1 A 23 23 VAL C C 23 175.400 174.041 1.359 1
1 284 . 16 1 1 A 23 23 VAL CA C 23 57.800 59.190 -1.390 1
1 285 . 16 1 1 A 23 23 VAL CB C 23 36.300 35.522 0.778 1
1 288 . 16 1 1 A 23 23 VAL N N 23 110.900 116.360 -5.460 1
1 289 . 16 1 1 A 24 24 LYS H H 24 8.960 9.347 -0.387 1
1 290 . 16 1 1 A 24 24 LYS HA H 24 5.600 4.928 0.672 1
1 299 . 16 1 1 A 24 24 LYS C C 24 175.600 173.990 1.610 1
1 300 . 16 1 1 A 24 24 LYS CA C 24 54.200 54.087 0.113 1
1 301 . 16 1 1 A 24 24 LYS CB C 24 37.000 36.191 0.809 1
1 305 . 16 1 1 A 24 24 LYS N N 24 117.900 120.536 -2.636 1
1 306 . 16 1 1 A 25 25 SER H H 25 8.950 8.643 0.307 1
1 307 . 16 1 1 A 25 25 SER HA H 25 5.190 4.880 0.310 1
1 310 . 16 1 1 A 25 25 SER C C 25 173.800 175.092 -1.292 1
1 311 . 16 1 1 A 25 25 SER CA C 25 57.700 57.993 -0.293 1
1 312 . 16 1 1 A 25 25 SER CB C 25 65.100 64.797 0.303 1
1 313 . 16 1 1 A 25 25 SER N N 25 114.600 117.053 -2.453 1
1 314 . 16 1 1 A 26 26 ASN H H 26 9.020 8.356 0.664 1
1 315 . 16 1 1 A 26 26 ASN HA H 26 4.370 4.581 -0.211 1
1 320 . 16 1 1 A 26 26 ASN C C 26 173.500 174.875 -1.375 1
1 321 . 16 1 1 A 26 26 ASN CA C 26 53.700 54.065 -0.365 1
1 322 . 16 1 1 A 26 26 ASN CB C 26 37.100 38.314 -1.214 1
1 323 . 16 1 1 A 26 26 ASN N N 26 118.300 121.887 -3.587 1
1 325 . 16 1 1 A 27 27 LYS H H 27 7.400 7.529 -0.129 1
1 326 . 16 1 1 A 27 27 LYS HA H 27 4.780 4.796 -0.016 1
1 335 . 16 1 1 A 27 27 LYS CA C 27 53.500 52.815 0.685 1
1 336 . 16 1 1 A 27 27 LYS CB C 27 34.100 35.890 -1.790 1
1 340 . 16 1 1 A 27 27 LYS N N 27 116.600 119.159 -2.559 1
1 341 . 16 1 1 A 28 28 PRO HA H 28 4.040 4.535 -0.495 1
1 348 . 16 1 1 A 28 28 PRO C C 28 174.500 176.408 -1.908 1
1 349 . 16 1 1 A 28 28 PRO CA C 28 63.200 63.140 0.060 1
1 350 . 16 1 1 A 28 28 PRO CB C 28 32.500 32.241 0.259 1
1 353 . 16 1 1 A 29 29 VAL H H 29 8.860 8.929 -0.069 1
1 354 . 16 1 1 A 29 29 VAL HA H 29 4.420 4.983 -0.563 1
1 362 . 16 1 1 A 29 29 VAL C C 29 174.800 175.322 -0.522 1
1 363 . 16 1 1 A 29 29 VAL CA C 29 60.300 59.444 0.856 1
1 364 . 16 1 1 A 29 29 VAL CB C 29 36.400 35.604 0.796 1
1 367 . 16 1 1 A 29 29 VAL N N 29 119.800 116.612 3.188 1
1 368 . 16 1 1 A 30 30 GLU H H 30 9.550 8.460 1.090 1
1 369 . 16 1 1 A 30 30 GLU HA H 30 4.260 4.472 -0.212 1
1 374 . 16 1 1 A 30 30 GLU C C 30 177.800 176.577 1.223 1
1 375 . 16 1 1 A 30 30 GLU CA C 30 58.000 56.745 1.255 1
1 376 . 16 1 1 A 30 30 GLU CB C 30 29.700 30.450 -0.750 1
1 378 . 16 1 1 A 30 30 GLU N N 30 128.900 120.761 8.139 1
1 379 . 16 1 1 A 31 31 ILE H H 31 7.910 8.232 -0.322 1
1 380 . 16 1 1 A 31 31 ILE HA H 31 2.120 3.060 -0.940 1
1 390 . 16 1 1 A 31 31 ILE C C 31 178.000 175.412 2.588 1
1 391 . 16 1 1 A 31 31 ILE CA C 31 63.500 60.508 2.992 1
1 392 . 16 1 1 A 31 31 ILE CB C 31 37.200 38.181 -0.981 1
1 396 . 16 1 1 A 31 31 ILE N N 31 122.500 121.699 0.801 1
1 397 . 16 1 1 A 32 32 SER H H 32 7.940 8.053 -0.113 1
1 398 . 16 1 1 A 32 32 SER HA H 32 4.070 3.936 0.134 1
1 401 . 16 1 1 A 32 32 SER C C 32 175.800 174.417 1.383 1
1 402 . 16 1 1 A 32 32 SER CA C 32 60.200 60.590 -0.390 1
1 403 . 16 1 1 A 32 32 SER CB C 32 62.100 60.847 1.253 1
1 404 . 16 1 1 A 32 32 SER N N 32 115.300 115.247 0.053 1
1 405 . 16 1 1 A 33 33 LYS H H 33 7.640 7.880 -0.240 1
1 406 . 16 1 1 A 33 33 LYS HA H 33 4.400 4.023 0.377 1
1 415 . 16 1 1 A 33 33 LYS C C 33 176.600 178.646 -2.046 1
1 416 . 16 1 1 A 33 33 LYS CA C 33 56.200 58.707 -2.507 1
1 417 . 16 1 1 A 33 33 LYS CB C 33 32.700 32.125 0.575 1
1 421 . 16 1 1 A 33 33 LYS N N 33 119.800 119.903 -0.103 1
1 422 . 16 1 1 A 34 34 TRP H H 34 7.860 7.838 0.022 1
1 423 . 16 1 1 A 34 34 TRP HA H 34 3.870 4.265 -0.395 1
1 426 . 16 1 1 A 34 34 TRP C C 34 178.600 178.923 -0.323 1
1 427 . 16 1 1 A 34 34 TRP CA C 34 60.200 59.485 0.715 1
1 428 . 16 1 1 A 34 34 TRP CB C 34 28.500 29.495 -0.995 1
1 429 . 16 1 1 A 34 34 TRP N N 34 120.000 120.021 -0.021 1
1 430 . 16 1 1 A 35 35 ILE H H 35 8.200 8.023 0.177 1
1 431 . 16 1 1 A 35 35 ILE HA H 35 3.990 3.729 0.261 1
1 441 . 16 1 1 A 35 35 ILE C C 35 177.900 178.067 -0.167 1
1 442 . 16 1 1 A 35 35 ILE CA C 35 64.300 65.533 -1.233 1
1 443 . 16 1 1 A 35 35 ILE CB C 35 37.200 37.728 -0.528 1
1 447 . 16 1 1 A 35 35 ILE N N 35 119.500 120.275 -0.775 1
1 448 . 16 1 1 A 36 36 ASP H H 36 7.680 7.705 -0.025 1
1 449 . 16 1 1 A 36 36 ASP HA H 36 4.490 4.200 0.290 1
1 452 . 16 1 1 A 36 36 ASP C C 36 179.200 178.503 0.697 1
1 453 . 16 1 1 A 36 36 ASP CA C 36 57.500 57.102 0.398 1
1 454 . 16 1 1 A 36 36 ASP CB C 36 40.400 40.674 -0.274 1
1 455 . 16 1 1 A 36 36 ASP N N 36 122.000 121.319 0.681 1
1 456 . 16 1 1 A 37 37 PHE H H 37 8.450 7.356 1.094 1
1 457 . 16 1 1 A 37 37 PHE HA H 37 4.080 4.092 -0.012 1
1 465 . 16 1 1 A 37 37 PHE C C 37 178.300 178.337 -0.037 1
1 466 . 16 1 1 A 37 37 PHE CA C 37 58.600 60.281 -1.681 1
1 467 . 16 1 1 A 37 37 PHE CB C 37 37.000 37.705 -0.705 1
1 473 . 16 1 1 A 37 37 PHE N N 37 119.800 118.732 1.068 1
1 474 . 16 1 1 A 38 38 SER H H 38 8.580 8.366 0.214 1
1 475 . 16 1 1 A 38 38 SER HA H 38 4.250 4.418 -0.168 1
1 478 . 16 1 1 A 38 38 SER C C 38 176.800 177.397 -0.597 1
1 479 . 16 1 1 A 38 38 SER CA C 38 62.700 61.492 1.208 1
1 480 . 16 1 1 A 38 38 SER CB C 38 62.700 63.343 -0.643 1
1 481 . 16 1 1 A 38 38 SER N N 38 115.800 115.526 0.274 1
1 482 . 16 1 1 A 39 39 ASN H H 39 8.190 8.191 -0.001 1
1 483 . 16 1 1 A 39 39 ASN HA H 39 4.540 4.437 0.103 1
1 488 . 16 1 1 A 39 39 ASN C C 39 178.500 178.198 0.302 1
1 489 . 16 1 1 A 39 39 ASN CA C 39 56.200 56.462 -0.262 1
1 490 . 16 1 1 A 39 39 ASN CB C 39 37.900 37.892 0.008 1
1 491 . 16 1 1 A 39 39 ASN N N 39 121.300 120.420 0.880 1
1 493 . 16 1 1 A 40 40 VAL H H 40 7.840 7.779 0.061 1
1 494 . 16 1 1 A 40 40 VAL HA H 40 3.650 3.569 0.081 1
1 502 . 16 1 1 A 40 40 VAL C C 40 179.000 177.887 1.113 1
1 503 . 16 1 1 A 40 40 VAL CA C 40 66.600 66.694 -0.094 1
1 504 . 16 1 1 A 40 40 VAL CB C 40 32.100 31.548 0.552 1
1 507 . 16 1 1 A 40 40 VAL N N 40 121.800 119.979 1.821 1
1 508 . 16 1 1 A 41 41 LEU H H 41 8.210 8.306 -0.096 1
1 509 . 16 1 1 A 41 41 LEU HA H 41 3.840 4.137 -0.297 1
1 519 . 16 1 1 A 41 41 LEU C C 41 178.800 179.417 -0.617 1
1 520 . 16 1 1 A 41 41 LEU CA C 41 57.400 57.394 0.006 1
1 521 . 16 1 1 A 41 41 LEU CB C 41 41.200 41.137 0.063 1
1 525 . 16 1 1 A 41 41 LEU N N 41 117.700 118.997 -1.297 1
1 526 . 16 1 1 A 42 42 SER H H 42 7.980 8.022 -0.042 1
1 527 . 16 1 1 A 42 42 SER HA H 42 4.260 4.264 -0.004 1
1 530 . 16 1 1 A 42 42 SER C C 42 174.900 175.472 -0.572 1
1 531 . 16 1 1 A 42 42 SER CA C 42 61.200 61.001 0.199 1
1 532 . 16 1 1 A 42 42 SER CB C 42 63.100 62.869 0.231 1
1 533 . 16 1 1 A 42 42 SER N N 42 113.200 114.656 -1.456 1
1 534 . 16 1 1 A 43 43 ARG H H 43 7.100 7.400 -0.300 1
1 535 . 16 1 1 A 43 43 ARG HA H 43 4.500 4.312 0.188 1
1 542 . 16 1 1 A 43 43 ARG C C 43 175.800 174.837 0.963 1
1 543 . 16 1 1 A 43 43 ARG CA C 43 55.600 54.953 0.647 1
1 544 . 16 1 1 A 43 43 ARG CB C 43 30.800 29.964 0.836 1
1 547 . 16 1 1 A 43 43 ARG N N 43 118.400 117.685 0.715 1
1 548 . 16 1 1 A 44 44 LEU H H 44 7.610 7.149 0.461 1
1 549 . 16 1 1 A 44 44 LEU HA H 44 4.590 4.869 -0.279 1
1 559 . 16 1 1 A 44 44 LEU C C 44 175.300 173.966 1.334 1
1 560 . 16 1 1 A 44 44 LEU CA C 44 53.900 52.989 0.911 1
1 561 . 16 1 1 A 44 44 LEU CB C 44 44.100 45.250 -1.150 1
1 565 . 16 1 1 A 44 44 LEU N N 44 120.400 122.254 -1.854 1
1 566 . 16 1 1 A 45 45 TYR H H 45 7.630 9.175 -1.545 1
1 567 . 16 1 1 A 45 45 TYR HA H 45 5.180 5.148 0.032 1
1 574 . 16 1 1 A 45 45 TYR C C 45 174.600 174.322 0.278 1
1 575 . 16 1 1 A 45 45 TYR CA C 45 56.300 56.334 -0.034 1
1 576 . 16 1 1 A 45 45 TYR CB C 45 41.400 39.872 1.528 1
1 581 . 16 1 1 A 45 45 TYR N N 45 115.300 125.535 -10.235 1
1 582 . 16 1 1 A 46 46 VAL H H 46 8.770 8.578 0.192 1
1 583 . 16 1 1 A 46 46 VAL HA H 46 4.540 4.501 0.039 1
1 591 . 16 1 1 A 46 46 VAL C C 46 174.600 174.982 -0.382 1
1 592 . 16 1 1 A 46 46 VAL CA C 46 59.600 61.874 -2.274 1
1 593 . 16 1 1 A 46 46 VAL CB C 46 34.700 32.776 1.924 1
1 596 . 16 1 1 A 46 46 VAL N N 46 115.400 126.691 -11.291 1
1 597 . 16 1 1 A 47 47 GLY H H 47 8.280 8.670 -0.390 1
1 598 . 16 1 1 A 47 47 GLY HA2 H 47 3.610 4.211 -0.601 1
1 599 . 16 1 1 A 47 47 GLY HA3 H 47 4.970 4.214 0.756 1
1 600 . 16 1 1 A 47 47 GLY C C 47 173.100 173.723 -0.623 1
1 601 . 16 1 1 A 47 47 GLY CA C 47 43.600 43.799 -0.199 1
1 602 . 16 1 1 A 47 47 GLY N N 47 109.900 115.196 -5.296 1
1 603 . 16 1 1 A 48 48 VAL H H 48 7.630 8.587 -0.957 1
1 604 . 16 1 1 A 48 48 VAL HA H 48 4.320 4.239 0.081 1
1 612 . 16 1 1 A 48 48 VAL CA C 48 58.700 63.247 -4.547 1
1 613 . 16 1 1 A 48 48 VAL CB C 48 32.100 30.747 1.353 1
1 616 . 16 1 1 A 48 48 VAL N N 48 109.900 117.802 -7.902 1
1 617 . 16 1 1 A 49 49 PRO HA H 49 4.800 4.411 0.389 1
1 624 . 16 1 1 A 49 49 PRO C C 49 176.700 176.211 0.489 1
1 625 . 16 1 1 A 49 49 PRO CA C 49 62.300 63.058 -0.758 1
1 626 . 16 1 1 A 49 49 PRO CB C 49 35.400 31.891 3.509 1
1 629 . 16 1 1 A 50 50 THR H H 50 8.790 8.311 0.479 1
1 630 . 16 1 1 A 50 50 THR HA H 50 4.690 5.032 -0.342 1
1 635 . 16 1 1 A 50 50 THR C C 50 173.500 172.777 0.723 1
1 636 . 16 1 1 A 50 50 THR CA C 50 60.800 59.495 1.305 1
1 637 . 16 1 1 A 50 50 THR CB C 50 70.800 71.251 -0.451 1
1 639 . 16 1 1 A 50 50 THR N N 50 113.500 112.039 1.461 1
1 640 . 16 1 1 A 51 51 LYS H H 51 7.810 8.855 -1.045 1
1 641 . 16 1 1 A 51 51 LYS HA H 51 4.890 4.847 0.043 1
1 650 . 16 1 1 A 51 51 LYS C C 51 175.900 175.533 0.367 1
1 651 . 16 1 1 A 51 51 LYS CA C 51 54.100 53.995 0.105 1
1 652 . 16 1 1 A 51 51 LYS CB C 51 35.300 35.913 -0.613 1
1 656 . 16 1 1 A 51 51 LYS N N 51 122.200 121.988 0.212 1
1 657 . 16 1 1 A 52 52 SER H H 52 8.410 8.531 -0.121 1
1 658 . 16 1 1 A 52 52 SER HA H 52 3.630 4.183 -0.553 1
1 661 . 16 1 1 A 52 52 SER C C 52 175.800 174.981 0.819 1
1 662 . 16 1 1 A 52 52 SER CA C 52 58.800 59.851 -1.051 1
1 663 . 16 1 1 A 52 52 SER CB C 52 62.600 62.566 0.034 1
1 664 . 16 1 1 A 52 52 SER N N 52 118.900 118.625 0.275 1
1 665 . 16 1 1 A 53 53 GLY H H 53 9.070 9.398 -0.328 1
1 666 . 16 1 1 A 53 53 GLY HA2 H 53 3.390 3.904 -0.514 1
1 667 . 16 1 1 A 53 53 GLY HA3 H 53 4.460 3.910 0.550 1
1 668 . 16 1 1 A 53 53 GLY C C 53 174.100 174.308 -0.208 1
1 669 . 16 1 1 A 53 53 GLY CA C 53 44.800 45.371 -0.571 1
1 670 . 16 1 1 A 53 53 GLY N N 53 115.600 113.474 2.126 1
1 671 . 16 1 1 A 54 54 ASN H H 54 7.870 7.807 0.063 1
1 672 . 16 1 1 A 54 54 ASN HA H 54 4.570 4.802 -0.232 1
1 677 . 16 1 1 A 54 54 ASN C C 54 175.500 174.711 0.789 1
1 678 . 16 1 1 A 54 54 ASN CA C 54 53.000 52.527 0.473 1
1 679 . 16 1 1 A 54 54 ASN CB C 54 38.600 39.263 -0.663 1
1 680 . 16 1 1 A 54 54 ASN N N 54 119.600 119.277 0.323 1
1 682 . 16 1 1 A 55 55 VAL H H 55 8.770 8.851 -0.081 1
1 683 . 16 1 1 A 55 55 VAL HA H 55 3.880 4.140 -0.260 1
1 691 . 16 1 1 A 55 55 VAL C C 55 176.200 176.815 -0.615 1
1 692 . 16 1 1 A 55 55 VAL CA C 55 63.700 63.242 0.458 1
1 693 . 16 1 1 A 55 55 VAL CB C 55 31.600 31.724 -0.124 1
1 696 . 16 1 1 A 55 55 VAL N N 55 123.900 123.344 0.556 1
1 697 . 16 1 1 A 56 56 VAL H H 56 9.050 9.094 -0.044 1
1 698 . 16 1 1 A 56 56 VAL HA H 56 3.990 4.290 -0.300 1
1 706 . 16 1 1 A 56 56 VAL C C 56 175.200 176.199 -0.999 1
1 707 . 16 1 1 A 56 56 VAL CA C 56 62.700 62.657 0.043 1
1 708 . 16 1 1 A 56 56 VAL CB C 56 32.900 32.823 0.077 1
1 711 . 16 1 1 A 56 56 VAL N N 56 127.500 121.912 5.588 1
1 712 . 16 1 1 A 57 57 CYS H H 57 7.250 7.452 -0.202 1
1 713 . 16 1 1 A 57 57 CYS HA H 57 4.370 4.978 -0.608 1
1 716 . 16 1 1 A 57 57 CYS C C 57 171.900 172.900 -1.000 1
1 717 . 16 1 1 A 57 57 CYS CA C 57 58.600 57.906 0.694 1
1 718 . 16 1 1 A 57 57 CYS CB C 57 28.600 29.469 -0.869 1
1 719 . 16 1 1 A 57 57 CYS N N 57 117.600 120.080 -2.480 1
1 720 . 16 1 1 A 58 58 LYS H H 58 8.880 8.675 0.205 1
1 721 . 16 1 1 A 58 58 LYS HA H 58 4.220 4.558 -0.338 1
1 730 . 16 1 1 A 58 58 LYS C C 58 176.000 176.408 -0.408 1
1 731 . 16 1 1 A 58 58 LYS CA C 58 54.400 55.132 -0.732 1
1 732 . 16 1 1 A 58 58 LYS CB C 58 33.600 34.165 -0.565 1
1 736 . 16 1 1 A 58 58 LYS N N 58 132.000 127.122 4.878 1
1 737 . 16 1 1 A 59 59 ASN H H 59 9.500 9.758 -0.258 1
1 738 . 16 1 1 A 59 59 ASN HA H 59 4.040 4.490 -0.450 1
1 743 . 16 1 1 A 59 59 ASN C C 59 176.400 175.849 0.551 1
1 744 . 16 1 1 A 59 59 ASN CA C 59 53.200 53.998 -0.798 1
1 745 . 16 1 1 A 59 59 ASN CB C 59 35.900 37.380 -1.480 1
1 746 . 16 1 1 A 59 59 ASN N N 59 127.500 124.300 3.200 1
1 748 . 16 1 1 A 60 60 ILE H H 60 8.050 7.292 0.758 1
1 749 . 16 1 1 A 60 60 ILE HA H 60 3.680 3.819 -0.139 1
1 759 . 16 1 1 A 60 60 ILE C C 60 175.700 176.582 -0.882 1
1 760 . 16 1 1 A 60 60 ILE CA C 60 61.900 64.546 -2.646 1
1 761 . 16 1 1 A 60 60 ILE CB C 60 38.300 37.893 0.407 1
1 765 . 16 1 1 A 60 60 ILE N N 60 120.200 120.586 -0.386 1
1 766 . 16 1 1 A 61 61 MET H H 61 9.590 7.644 1.946 1
1 767 . 16 1 1 A 61 61 MET HA H 61 3.920 4.869 -0.949 1
1 775 . 16 1 1 A 61 61 MET C C 61 174.300 175.797 -1.497 1
1 776 . 16 1 1 A 61 61 MET CA C 61 57.000 54.688 2.312 1
1 777 . 16 1 1 A 61 61 MET CB C 61 31.300 33.230 -1.930 1
1 780 . 16 1 1 A 61 61 MET N N 61 124.400 118.320 6.080 1
1 781 . 16 1 1 A 62 62 ASN H H 62 8.250 8.108 0.142 1
1 782 . 16 1 1 A 62 62 ASN HA H 62 4.400 4.963 -0.563 1
1 787 . 16 1 1 A 62 62 ASN C C 62 176.800 175.499 1.301 1
1 788 . 16 1 1 A 62 62 ASN CA C 62 54.400 54.294 0.106 1
1 789 . 16 1 1 A 62 62 ASN CB C 62 37.600 36.383 1.217 1
1 790 . 16 1 1 A 62 62 ASN N N 62 111.900 115.855 -3.955 1
1 792 . 16 1 1 A 63 63 THR H H 63 7.480 7.990 -0.510 1
1 793 . 16 1 1 A 63 63 THR HA H 63 4.210 4.414 -0.204 1
1 798 . 16 1 1 A 63 63 THR C C 63 177.100 174.911 2.189 1
1 799 . 16 1 1 A 63 63 THR CA C 63 62.900 63.000 -0.100 1
1 800 . 16 1 1 A 63 63 THR CB C 63 72.500 69.397 3.103 1
1 802 . 16 1 1 A 63 63 THR N N 63 105.900 114.369 -8.469 1
1 803 . 16 1 1 A 64 64 GLY H H 64 9.110 8.100 1.010 1
1 804 . 16 1 1 A 64 64 GLY HA2 H 64 3.580 3.962 -0.382 1
1 805 . 16 1 1 A 64 64 GLY HA3 H 64 4.090 3.962 0.128 1
1 806 . 16 1 1 A 64 64 GLY C C 64 173.200 173.969 -0.769 1
1 807 . 16 1 1 A 64 64 GLY CA C 64 45.300 45.541 -0.241 1
1 808 . 16 1 1 A 64 64 GLY N N 64 111.500 110.540 0.960 1
1 809 . 16 1 1 A 65 65 VAL H H 65 7.580 7.600 -0.020 1
1 810 . 16 1 1 A 65 65 VAL HA H 65 4.060 3.921 0.139 1
1 818 . 16 1 1 A 65 65 VAL C C 65 172.900 175.136 -2.236 1
1 819 . 16 1 1 A 65 65 VAL CA C 65 61.400 62.533 -1.133 1
1 820 . 16 1 1 A 65 65 VAL CB C 65 32.900 31.582 1.318 1
1 823 . 16 1 1 A 65 65 VAL N N 65 121.600 122.323 -0.723 1
1 824 . 16 1 1 A 66 66 ASP H H 66 8.210 8.877 -0.667 1
1 825 . 16 1 1 A 66 66 ASP HA H 66 5.320 5.399 -0.079 1
1 828 . 16 1 1 A 66 66 ASP C C 66 174.800 175.272 -0.472 1
1 829 . 16 1 1 A 66 66 ASP CA C 66 51.700 53.200 -1.500 1
1 830 . 16 1 1 A 66 66 ASP CB C 66 43.200 43.193 0.007 1
1 831 . 16 1 1 A 66 66 ASP N N 66 123.100 127.538 -4.438 1
1 832 . 16 1 1 A 67 67 ILE H H 67 8.540 8.695 -0.155 1
1 833 . 16 1 1 A 67 67 ILE HA H 67 4.630 4.478 0.152 1
1 843 . 16 1 1 A 67 67 ILE C C 67 175.600 175.883 -0.283 1
1 844 . 16 1 1 A 67 67 ILE CA C 67 56.900 60.965 -4.065 1
1 845 . 16 1 1 A 67 67 ILE CB C 67 35.300 37.315 -2.015 1
1 849 . 16 1 1 A 67 67 ILE N N 67 119.200 124.688 -5.488 1
1 850 . 16 1 1 A 68 68 ILE H H 68 9.420 9.218 0.202 1
1 851 . 16 1 1 A 68 68 ILE HA H 68 4.980 5.437 -0.457 1
1 861 . 16 1 1 A 68 68 ILE C C 68 175.000 174.303 0.697 1
1 862 . 16 1 1 A 68 68 ILE CA C 68 58.600 58.839 -0.239 1
1 863 . 16 1 1 A 68 68 ILE CB C 68 40.900 41.003 -0.103 1
1 867 . 16 1 1 A 68 68 ILE N N 68 125.000 122.806 2.194 1
1 868 . 16 1 1 A 69 69 CYS H H 69 8.870 8.925 -0.055 1
1 869 . 16 1 1 A 69 69 CYS HA H 69 4.610 4.850 -0.240 1
1 872 . 16 1 1 A 69 69 CYS C C 69 176.200 174.891 1.309 1
1 873 . 16 1 1 A 69 69 CYS CA C 69 58.900 58.279 0.621 1
1 874 . 16 1 1 A 69 69 CYS CB C 69 27.100 28.552 -1.452 1
1 875 . 16 1 1 A 69 69 CYS N N 69 122.300 123.416 -1.116 1
1 876 . 16 1 1 A 70 70 THR H H 70 8.270 8.208 0.062 1
1 877 . 16 1 1 A 70 70 THR HA H 70 4.710 4.500 0.210 1
1 882 . 16 1 1 A 70 70 THR C C 70 173.600 174.316 -0.716 1
1 883 . 16 1 1 A 70 70 THR CA C 70 61.500 61.733 -0.233 1
1 884 . 16 1 1 A 70 70 THR CB C 70 68.100 69.273 -1.173 1
1 886 . 16 1 1 A 70 70 THR N N 70 116.700 119.039 -2.339 1
1 887 . 16 1 1 A 71 71 LYS H H 71 7.370 7.442 -0.072 1
1 888 . 16 1 1 A 71 71 LYS HA H 71 4.520 4.544 -0.024 1
1 897 . 16 1 1 A 71 71 LYS CA C 71 55.100 54.170 0.930 1
1 898 . 16 1 1 A 71 71 LYS CB C 71 37.800 33.976 3.824 1
1 902 . 16 1 1 A 71 71 LYS N N 71 120.900 122.143 -1.243 1
1 903 . 16 1 1 A 72 72 ASN H H 72 8.580 8.761 -0.181 1
1 904 . 16 1 1 A 72 72 ASN HA H 72 4.620 4.897 -0.277 1
1 909 . 16 1 1 A 72 72 ASN C C 72 173.500 173.951 -0.451 1
1 910 . 16 1 1 A 72 72 ASN CA C 72 52.200 52.397 -0.197 1
1 911 . 16 1 1 A 72 72 ASN CB C 72 38.500 38.802 -0.302 1
1 912 . 16 1 1 A 72 72 ASN N N 72 122.700 121.616 1.084 1
1 914 . 16 1 1 A 73 73 LEU H H 73 8.100 9.091 -0.991 1
1 915 . 16 1 1 A 73 73 LEU HA H 73 4.680 4.624 0.056 1
1 925 . 16 1 1 A 73 73 LEU CA C 73 51.000 50.879 0.121 1
1 926 . 16 1 1 A 73 73 LEU CB C 73 42.500 42.459 0.041 1
1 930 . 16 1 1 A 73 73 LEU N N 73 125.100 125.624 -0.524 1
1 931 . 16 1 1 A 74 74 PRO HA H 74 4.670 4.677 -0.007 1
1 938 . 16 1 1 A 74 74 PRO C C 74 176.500 175.620 0.880 1
1 939 . 16 1 1 A 74 74 PRO CA C 74 61.800 62.114 -0.314 1
1 940 . 16 1 1 A 74 74 PRO CB C 74 32.800 33.164 -0.364 1
1 943 . 16 1 1 A 75 75 LYS H H 75 8.280 8.533 -0.253 1
1 944 . 16 1 1 A 75 75 LYS HA H 75 4.110 4.737 -0.627 1
1 953 . 16 1 1 A 75 75 LYS CA C 75 56.500 55.151 1.349 1
1 954 . 16 1 1 A 75 75 LYS CB C 75 33.300 32.744 0.556 1
1 958 . 16 1 1 A 75 75 LYS N N 75 117.000 120.326 -3.326 1
1 959 . 16 1 1 A 76 76 ASP H H 76 8.570 8.704 -0.134 1
1 960 . 16 1 1 A 76 76 ASP HA H 76 4.530 4.380 0.150 1
1 963 . 16 1 1 A 76 76 ASP C C 76 176.300 175.839 0.461 1
1 964 . 16 1 1 A 76 76 ASP CA C 76 55.000 56.357 -1.357 1
1 965 . 16 1 1 A 76 76 ASP CB C 76 41.100 39.518 1.582 1
1 966 . 16 1 1 A 76 76 ASP N N 76 122.700 119.971 2.729 1
1 967 . 16 1 1 A 77 77 SER H H 77 8.330 8.547 -0.217 1
1 968 . 16 1 1 A 77 77 SER HA H 77 4.410 4.935 -0.525 1
1 971 . 16 1 1 A 77 77 SER C C 77 174.300 174.404 -0.104 1
1 972 . 16 1 1 A 77 77 SER CA C 77 58.000 57.027 0.973 1
1 973 . 16 1 1 A 77 77 SER CB C 77 63.900 63.152 0.748 1
1 974 . 16 1 1 A 77 77 SER N N 77 116.100 113.620 2.480 1
1 975 . 16 1 1 A 78 78 LEU H H 78 8.350 8.949 -0.599 1
1 976 . 16 1 1 A 78 78 LEU HA H 78 4.280 4.443 -0.163 1
1 986 . 16 1 1 A 78 78 LEU C C 78 177.200 176.521 0.679 1
1 987 . 16 1 1 A 78 78 LEU CA C 78 55.200 55.750 -0.550 1
1 988 . 16 1 1 A 78 78 LEU CB C 78 42.100 42.965 -0.865 1
1 992 . 16 1 1 A 78 78 LEU N N 78 124.300 127.071 -2.771 1
1 993 . 16 1 1 A 79 79 GLU H H 79 8.300 7.546 0.754 1
1 994 . 16 1 1 A 79 79 GLU CA C 79 56.400 55.775 0.625 1
1 995 . 16 1 1 A 79 79 GLU CB C 79 30.200 33.102 -2.902 1
1 1 . 17 1 1 A 2 2 HIS HA H 2 4.640 5.068 -0.428 1
1 4 . 17 1 1 A 2 2 HIS C C 2 173.600 173.138 0.462 1
1 5 . 17 1 1 A 2 2 HIS CA C 2 56.500 54.893 1.607 1
1 6 . 17 1 1 A 2 2 HIS CB C 2 31.000 30.789 0.211 1
1 7 . 17 1 1 A 3 3 LYS H H 3 8.160 8.527 -0.367 1
1 8 . 17 1 1 A 3 3 LYS HA H 3 4.660 4.912 -0.252 1
1 17 . 17 1 1 A 3 3 LYS C C 3 174.400 174.249 0.151 1
1 18 . 17 1 1 A 3 3 LYS CA C 3 54.800 54.819 -0.019 1
1 19 . 17 1 1 A 3 3 LYS CB C 3 35.800 35.477 0.323 1
1 23 . 17 1 1 A 3 3 LYS N N 3 121.900 126.450 -4.550 1
1 24 . 17 1 1 A 4 4 ASP H H 4 8.470 9.084 -0.614 1
1 25 . 17 1 1 A 4 4 ASP HA H 4 4.900 5.188 -0.288 1
1 28 . 17 1 1 A 4 4 ASP C C 4 176.900 175.602 1.298 1
1 29 . 17 1 1 A 4 4 ASP CA C 4 52.700 52.842 -0.142 1
1 30 . 17 1 1 A 4 4 ASP CB C 4 44.100 44.291 -0.191 1
1 31 . 17 1 1 A 4 4 ASP N N 4 117.900 125.134 -7.234 1
1 32 . 17 1 1 A 5 5 ILE H H 5 9.570 8.747 0.823 1
1 33 . 17 1 1 A 5 5 ILE HA H 5 3.640 4.097 -0.457 1
1 43 . 17 1 1 A 5 5 ILE C C 5 174.800 175.816 -1.016 1
1 44 . 17 1 1 A 5 5 ILE CA C 5 60.900 61.324 -0.424 1
1 45 . 17 1 1 A 5 5 ILE CB C 5 37.000 37.325 -0.325 1
1 49 . 17 1 1 A 5 5 ILE N N 5 124.400 124.275 0.125 1
1 50 . 17 1 1 A 6 6 PHE H H 6 7.790 8.689 -0.899 1
1 51 . 17 1 1 A 6 6 PHE HA H 6 3.160 3.219 -0.059 1
1 58 . 17 1 1 A 6 6 PHE C C 6 173.500 174.449 -0.949 1
1 59 . 17 1 1 A 6 6 PHE CA C 6 56.900 56.880 0.020 1
1 60 . 17 1 1 A 6 6 PHE CB C 6 40.100 38.204 1.896 1
1 65 . 17 1 1 A 6 6 PHE N N 6 130.200 128.371 1.829 1
1 66 . 17 1 1 A 7 7 THR H H 7 6.790 8.056 -1.266 1
1 67 . 17 1 1 A 7 7 THR HA H 7 4.530 5.202 -0.672 1
1 72 . 17 1 1 A 7 7 THR C C 7 172.300 173.023 -0.723 1
1 73 . 17 1 1 A 7 7 THR CA C 7 59.200 59.996 -0.796 1
1 74 . 17 1 1 A 7 7 THR CB C 7 71.000 70.341 0.659 1
1 76 . 17 1 1 A 7 7 THR N N 7 117.900 117.287 0.613 1
1 77 . 17 1 1 A 8 8 SER H H 8 7.600 8.712 -1.112 1
1 78 . 17 1 1 A 8 8 SER HA H 8 4.180 4.589 -0.409 1
1 81 . 17 1 1 A 8 8 SER C C 8 175.300 171.940 3.360 1
1 82 . 17 1 1 A 8 8 SER CA C 8 55.800 55.457 0.343 1
1 83 . 17 1 1 A 8 8 SER CB C 8 64.000 64.485 -0.485 1
1 84 . 17 1 1 A 8 8 SER N N 8 113.400 119.366 -5.966 1
1 85 . 17 1 1 A 9 9 VAL H H 9 8.880 8.365 0.515 1
1 86 . 17 1 1 A 9 9 VAL HA H 9 5.220 4.727 0.493 1
1 94 . 17 1 1 A 9 9 VAL C C 9 174.000 173.793 0.207 1
1 95 . 17 1 1 A 9 9 VAL CA C 9 59.100 60.766 -1.666 1
1 96 . 17 1 1 A 9 9 VAL CB C 9 36.500 35.270 1.230 1
1 99 . 17 1 1 A 9 9 VAL N N 9 114.700 121.436 -6.736 1
1 100 . 17 1 1 A 10 10 VAL H H 10 8.510 9.141 -0.631 1
1 101 . 17 1 1 A 10 10 VAL HA H 10 4.470 4.815 -0.345 1
1 109 . 17 1 1 A 10 10 VAL C C 10 173.700 173.930 -0.230 1
1 110 . 17 1 1 A 10 10 VAL CA C 10 59.400 59.619 -0.219 1
1 111 . 17 1 1 A 10 10 VAL CB C 10 36.000 34.665 1.335 1
1 114 . 17 1 1 A 10 10 VAL N N 10 117.100 127.920 -10.820 1
1 115 . 17 1 1 A 11 11 ARG H H 11 8.500 8.347 0.153 1
1 116 . 17 1 1 A 11 11 ARG HA H 11 4.460 4.843 -0.383 1
1 123 . 17 1 1 A 11 11 ARG C C 11 174.500 175.347 -0.847 1
1 124 . 17 1 1 A 11 11 ARG CA C 11 57.400 55.845 1.555 1
1 125 . 17 1 1 A 11 11 ARG CB C 11 31.000 31.313 -0.313 1
1 128 . 17 1 1 A 11 11 ARG N N 11 124.800 126.712 -1.912 1
1 129 . 17 1 1 A 12 12 VAL H H 12 7.650 9.525 -1.875 1
1 130 . 17 1 1 A 12 12 VAL HA H 12 4.970 4.905 0.065 1
1 138 . 17 1 1 A 12 12 VAL C C 12 176.700 175.332 1.368 1
1 139 . 17 1 1 A 12 12 VAL CA C 12 59.400 60.949 -1.549 1
1 140 . 17 1 1 A 12 12 VAL CB C 12 34.400 34.435 -0.035 1
1 143 . 17 1 1 A 12 12 VAL N N 12 120.900 123.678 -2.778 1
1 144 . 17 1 1 A 13 13 ARG H H 13 9.020 9.138 -0.118 1
1 145 . 17 1 1 A 13 13 ARG HA H 13 4.700 4.824 -0.124 1
1 152 . 17 1 1 A 13 13 ARG C C 13 176.000 175.823 0.177 1
1 153 . 17 1 1 A 13 13 ARG CA C 13 54.600 54.795 -0.195 1
1 154 . 17 1 1 A 13 13 ARG CB C 13 32.900 32.827 0.073 1
1 157 . 17 1 1 A 13 13 ARG N N 13 127.500 125.465 2.035 1
1 158 . 17 1 1 A 14 14 GLY H H 14 8.640 8.416 0.224 1
1 159 . 17 1 1 A 14 14 GLY HA2 H 14 3.680 4.108 -0.428 1
1 160 . 17 1 1 A 14 14 GLY HA3 H 14 4.190 4.113 0.077 1
1 161 . 17 1 1 A 14 14 GLY C C 14 173.700 174.191 -0.491 1
1 162 . 17 1 1 A 14 14 GLY CA C 14 45.600 44.272 1.328 1
1 163 . 17 1 1 A 14 14 GLY N N 14 108.800 108.911 -0.111 1
1 164 . 17 1 1 A 15 15 SER H H 15 8.220 8.429 -0.209 1
1 165 . 17 1 1 A 15 15 SER HA H 15 5.020 4.665 0.355 1
1 168 . 17 1 1 A 15 15 SER C C 15 175.400 172.968 2.432 1
1 169 . 17 1 1 A 15 15 SER CA C 15 55.300 57.511 -2.211 1
1 170 . 17 1 1 A 15 15 SER CB C 15 64.900 61.541 3.359 1
1 171 . 17 1 1 A 15 15 SER N N 15 113.200 117.420 -4.220 1
1 172 . 17 1 1 A 16 16 LYS H H 16 9.930 8.073 1.857 1
1 173 . 17 1 1 A 16 16 LYS HA H 16 4.190 4.930 -0.740 1
1 182 . 17 1 1 A 16 16 LYS C C 16 176.500 176.605 -0.105 1
1 183 . 17 1 1 A 16 16 LYS CA C 16 57.300 54.449 2.851 1
1 184 . 17 1 1 A 16 16 LYS CB C 16 32.300 35.604 -3.304 1
1 188 . 17 1 1 A 16 16 LYS N N 16 129.200 119.645 9.555 1
1 189 . 17 1 1 A 17 17 LYS H H 17 7.960 8.142 -0.182 1
1 190 . 17 1 1 A 17 17 LYS HA H 17 4.030 4.164 -0.134 1
1 199 . 17 1 1 A 17 17 LYS C C 17 175.600 176.321 -0.721 1
1 200 . 17 1 1 A 17 17 LYS CA C 17 56.900 57.865 -0.965 1
1 201 . 17 1 1 A 17 17 LYS CB C 17 34.700 33.306 1.394 1
1 205 . 17 1 1 A 17 17 LYS N N 17 118.500 119.578 -1.078 1
1 206 . 17 1 1 A 18 18 TYR H H 18 7.780 7.699 0.081 1
1 207 . 17 1 1 A 18 18 TYR HA H 18 4.760 4.599 0.161 1
1 214 . 17 1 1 A 18 18 TYR C C 18 174.000 176.005 -2.005 1
1 215 . 17 1 1 A 18 18 TYR CA C 18 56.800 58.436 -1.636 1
1 216 . 17 1 1 A 18 18 TYR CB C 18 41.100 39.983 1.117 1
1 221 . 17 1 1 A 18 18 TYR N N 18 117.100 117.649 -0.549 1
1 222 . 17 1 1 A 19 19 ASN H H 19 8.890 8.928 -0.038 1
1 223 . 17 1 1 A 19 19 ASN HA H 19 4.960 4.945 0.015 1
1 228 . 17 1 1 A 19 19 ASN C C 19 176.100 174.435 1.665 1
1 229 . 17 1 1 A 19 19 ASN CA C 19 53.600 52.661 0.939 1
1 230 . 17 1 1 A 19 19 ASN CB C 19 40.300 39.026 1.274 1
1 231 . 17 1 1 A 19 19 ASN N N 19 116.600 118.115 -1.515 1
1 233 . 17 1 1 A 20 20 VAL H H 20 7.730 7.591 0.139 1
1 234 . 17 1 1 A 20 20 VAL HA H 20 5.250 5.046 0.204 1
1 242 . 17 1 1 A 20 20 VAL C C 20 173.800 173.909 -0.109 1
1 243 . 17 1 1 A 20 20 VAL CA C 20 59.400 59.222 0.178 1
1 244 . 17 1 1 A 20 20 VAL CB C 20 37.600 35.716 1.884 1
1 247 . 17 1 1 A 20 20 VAL N N 20 113.900 115.196 -1.296 1
1 248 . 17 1 1 A 21 21 VAL H H 21 8.890 8.980 -0.090 1
1 249 . 17 1 1 A 21 21 VAL HA H 21 4.840 4.781 0.059 1
1 257 . 17 1 1 A 21 21 VAL CA C 21 56.800 57.728 -0.928 1
1 258 . 17 1 1 A 21 21 VAL CB C 21 36.000 35.174 0.826 1
1 261 . 17 1 1 A 21 21 VAL N N 21 118.500 122.059 -3.559 1
1 262 . 17 1 1 A 22 22 PRO HA H 22 4.940 4.982 -0.042 1
1 269 . 17 1 1 A 22 22 PRO C C 22 175.600 176.422 -0.822 1
1 270 . 17 1 1 A 22 22 PRO CA C 22 62.700 62.769 -0.069 1
1 271 . 17 1 1 A 22 22 PRO CB C 22 31.800 31.833 -0.033 1
1 274 . 17 1 1 A 23 23 VAL H H 23 8.060 8.650 -0.590 1
1 275 . 17 1 1 A 23 23 VAL HA H 23 5.390 4.949 0.441 1
1 283 . 17 1 1 A 23 23 VAL C C 23 175.400 174.318 1.082 1
1 284 . 17 1 1 A 23 23 VAL CA C 23 57.800 59.170 -1.370 1
1 285 . 17 1 1 A 23 23 VAL CB C 23 36.300 34.823 1.477 1
1 288 . 17 1 1 A 23 23 VAL N N 23 110.900 116.365 -5.465 1
1 289 . 17 1 1 A 24 24 LYS H H 24 8.960 9.401 -0.441 1
1 290 . 17 1 1 A 24 24 LYS HA H 24 5.600 5.153 0.447 1
1 299 . 17 1 1 A 24 24 LYS C C 24 175.600 174.466 1.134 1
1 300 . 17 1 1 A 24 24 LYS CA C 24 54.200 53.980 0.220 1
1 301 . 17 1 1 A 24 24 LYS CB C 24 37.000 36.416 0.584 1
1 305 . 17 1 1 A 24 24 LYS N N 24 117.900 120.778 -2.878 1
1 306 . 17 1 1 A 25 25 SER H H 25 8.950 8.704 0.246 1
1 307 . 17 1 1 A 25 25 SER HA H 25 5.190 4.833 0.357 1
1 310 . 17 1 1 A 25 25 SER C C 25 173.800 175.141 -1.341 1
1 311 . 17 1 1 A 25 25 SER CA C 25 57.700 58.127 -0.427 1
1 312 . 17 1 1 A 25 25 SER CB C 25 65.100 64.792 0.308 1
1 313 . 17 1 1 A 25 25 SER N N 25 114.600 116.895 -2.295 1
1 314 . 17 1 1 A 26 26 ASN H H 26 9.020 8.526 0.494 1
1 315 . 17 1 1 A 26 26 ASN HA H 26 4.370 4.589 -0.219 1
1 320 . 17 1 1 A 26 26 ASN C C 26 173.500 174.895 -1.395 1
1 321 . 17 1 1 A 26 26 ASN CA C 26 53.700 54.384 -0.684 1
1 322 . 17 1 1 A 26 26 ASN CB C 26 37.100 38.365 -1.265 1
1 323 . 17 1 1 A 26 26 ASN N N 26 118.300 121.747 -3.447 1
1 325 . 17 1 1 A 27 27 LYS H H 27 7.400 7.713 -0.313 1
1 326 . 17 1 1 A 27 27 LYS HA H 27 4.780 4.737 0.043 1
1 335 . 17 1 1 A 27 27 LYS CA C 27 53.500 52.660 0.840 1
1 336 . 17 1 1 A 27 27 LYS CB C 27 34.100 33.718 0.382 1
1 340 . 17 1 1 A 27 27 LYS N N 27 116.600 118.591 -1.991 1
1 341 . 17 1 1 A 28 28 PRO HA H 28 4.040 4.616 -0.576 1
1 348 . 17 1 1 A 28 28 PRO C C 28 174.500 176.438 -1.938 1
1 349 . 17 1 1 A 28 28 PRO CA C 28 63.200 62.919 0.281 1
1 350 . 17 1 1 A 28 28 PRO CB C 28 32.500 32.495 0.005 1
1 353 . 17 1 1 A 29 29 VAL H H 29 8.860 8.612 0.248 1
1 354 . 17 1 1 A 29 29 VAL HA H 29 4.420 4.756 -0.336 1
1 362 . 17 1 1 A 29 29 VAL C C 29 174.800 175.555 -0.755 1
1 363 . 17 1 1 A 29 29 VAL CA C 29 60.300 59.266 1.034 1
1 364 . 17 1 1 A 29 29 VAL CB C 29 36.400 35.603 0.797 1
1 367 . 17 1 1 A 29 29 VAL N N 29 119.800 116.922 2.878 1
1 368 . 17 1 1 A 30 30 GLU H H 30 9.550 8.819 0.731 1
1 369 . 17 1 1 A 30 30 GLU HA H 30 4.260 4.340 -0.080 1
1 374 . 17 1 1 A 30 30 GLU C C 30 177.800 178.513 -0.713 1
1 375 . 17 1 1 A 30 30 GLU CA C 30 58.000 57.122 0.878 1
1 376 . 17 1 1 A 30 30 GLU CB C 30 29.700 29.868 -0.168 1
1 378 . 17 1 1 A 30 30 GLU N N 30 128.900 121.897 7.003 1
1 379 . 17 1 1 A 31 31 ILE H H 31 7.910 8.633 -0.723 1
1 380 . 17 1 1 A 31 31 ILE HA H 31 2.120 3.680 -1.560 1
1 390 . 17 1 1 A 31 31 ILE C C 31 178.000 177.434 0.566 1
1 391 . 17 1 1 A 31 31 ILE CA C 31 63.500 63.908 -0.408 1
1 392 . 17 1 1 A 31 31 ILE CB C 31 37.200 37.581 -0.381 1
1 396 . 17 1 1 A 31 31 ILE N N 31 122.500 125.093 -2.593 1
1 397 . 17 1 1 A 32 32 SER H H 32 7.940 8.248 -0.308 1
1 398 . 17 1 1 A 32 32 SER HA H 32 4.070 4.394 -0.324 1
1 401 . 17 1 1 A 32 32 SER C C 32 175.800 175.118 0.682 1
1 402 . 17 1 1 A 32 32 SER CA C 32 60.200 61.170 -0.970 1
1 403 . 17 1 1 A 32 32 SER CB C 32 62.100 63.203 -1.103 1
1 404 . 17 1 1 A 32 32 SER N N 32 115.300 118.712 -3.412 1
1 405 . 17 1 1 A 33 33 LYS H H 33 7.640 8.055 -0.415 1
1 406 . 17 1 1 A 33 33 LYS HA H 33 4.400 4.874 -0.474 1
1 415 . 17 1 1 A 33 33 LYS C C 33 176.600 177.868 -1.268 1
1 416 . 17 1 1 A 33 33 LYS CA C 33 56.200 56.914 -0.714 1
1 417 . 17 1 1 A 33 33 LYS CB C 33 32.700 32.865 -0.165 1
1 421 . 17 1 1 A 33 33 LYS N N 33 119.800 118.883 0.917 1
1 422 . 17 1 1 A 34 34 TRP H H 34 7.860 7.667 0.193 1
1 423 . 17 1 1 A 34 34 TRP HA H 34 3.870 4.254 -0.384 1
1 426 . 17 1 1 A 34 34 TRP C C 34 178.600 179.286 -0.686 1
1 427 . 17 1 1 A 34 34 TRP CA C 34 60.200 59.854 0.346 1
1 428 . 17 1 1 A 34 34 TRP CB C 34 28.500 29.370 -0.870 1
1 429 . 17 1 1 A 34 34 TRP N N 34 120.000 119.791 0.209 1
1 430 . 17 1 1 A 35 35 ILE H H 35 8.200 8.134 0.066 1
1 431 . 17 1 1 A 35 35 ILE HA H 35 3.990 3.709 0.281 1
1 441 . 17 1 1 A 35 35 ILE C C 35 177.900 177.287 0.613 1
1 442 . 17 1 1 A 35 35 ILE CA C 35 64.300 65.014 -0.714 1
1 443 . 17 1 1 A 35 35 ILE CB C 35 37.200 37.681 -0.481 1
1 447 . 17 1 1 A 35 35 ILE N N 35 119.500 120.794 -1.294 1
1 448 . 17 1 1 A 36 36 ASP H H 36 7.680 8.349 -0.669 1
1 449 . 17 1 1 A 36 36 ASP HA H 36 4.490 4.225 0.265 1
1 452 . 17 1 1 A 36 36 ASP C C 36 179.200 178.936 0.264 1
1 453 . 17 1 1 A 36 36 ASP CA C 36 57.500 57.523 -0.023 1
1 454 . 17 1 1 A 36 36 ASP CB C 36 40.400 40.455 -0.055 1
1 455 . 17 1 1 A 36 36 ASP N N 36 122.000 119.968 2.032 1
1 456 . 17 1 1 A 37 37 PHE H H 37 8.450 8.170 0.280 1
1 457 . 17 1 1 A 37 37 PHE HA H 37 4.080 4.065 0.015 1
1 465 . 17 1 1 A 37 37 PHE C C 37 178.300 177.905 0.395 1
1 466 . 17 1 1 A 37 37 PHE CA C 37 58.600 60.072 -1.472 1
1 467 . 17 1 1 A 37 37 PHE CB C 37 37.000 37.189 -0.189 1
1 473 . 17 1 1 A 37 37 PHE N N 37 119.800 118.931 0.869 1
1 474 . 17 1 1 A 38 38 SER H H 38 8.580 7.994 0.586 1
1 475 . 17 1 1 A 38 38 SER HA H 38 4.250 4.406 -0.156 1
1 478 . 17 1 1 A 38 38 SER C C 38 176.800 176.672 0.128 1
1 479 . 17 1 1 A 38 38 SER CA C 38 62.700 61.670 1.030 1
1 480 . 17 1 1 A 38 38 SER CB C 38 62.700 62.900 -0.200 1
1 481 . 17 1 1 A 38 38 SER N N 38 115.800 114.559 1.241 1
1 482 . 17 1 1 A 39 39 ASN H H 39 8.190 8.389 -0.199 1
1 483 . 17 1 1 A 39 39 ASN HA H 39 4.540 4.507 0.033 1
1 488 . 17 1 1 A 39 39 ASN C C 39 178.500 178.100 0.400 1
1 489 . 17 1 1 A 39 39 ASN CA C 39 56.200 56.434 -0.234 1
1 490 . 17 1 1 A 39 39 ASN CB C 39 37.900 37.901 -0.001 1
1 491 . 17 1 1 A 39 39 ASN N N 39 121.300 120.873 0.427 1
1 493 . 17 1 1 A 40 40 VAL H H 40 7.840 7.643 0.197 1
1 494 . 17 1 1 A 40 40 VAL HA H 40 3.650 3.542 0.108 1
1 502 . 17 1 1 A 40 40 VAL C C 40 179.000 178.195 0.805 1
1 503 . 17 1 1 A 40 40 VAL CA C 40 66.600 66.437 0.163 1
1 504 . 17 1 1 A 40 40 VAL CB C 40 32.100 31.496 0.604 1
1 507 . 17 1 1 A 40 40 VAL N N 40 121.800 121.239 0.561 1
1 508 . 17 1 1 A 41 41 LEU H H 41 8.210 8.345 -0.135 1
1 509 . 17 1 1 A 41 41 LEU HA H 41 3.840 3.963 -0.123 1
1 519 . 17 1 1 A 41 41 LEU C C 41 178.800 179.139 -0.339 1
1 520 . 17 1 1 A 41 41 LEU CA C 41 57.400 57.974 -0.574 1
1 521 . 17 1 1 A 41 41 LEU CB C 41 41.200 41.578 -0.378 1
1 525 . 17 1 1 A 41 41 LEU N N 41 117.700 118.981 -1.281 1
1 526 . 17 1 1 A 42 42 SER H H 42 7.980 8.441 -0.461 1
1 527 . 17 1 1 A 42 42 SER HA H 42 4.260 4.249 0.011 1
1 530 . 17 1 1 A 42 42 SER C C 42 174.900 175.175 -0.275 1
1 531 . 17 1 1 A 42 42 SER CA C 42 61.200 61.243 -0.043 1
1 532 . 17 1 1 A 42 42 SER CB C 42 63.100 63.088 0.012 1
1 533 . 17 1 1 A 42 42 SER N N 42 113.200 114.452 -1.252 1
1 534 . 17 1 1 A 43 43 ARG H H 43 7.100 7.820 -0.720 1
1 535 . 17 1 1 A 43 43 ARG HA H 43 4.500 4.529 -0.029 1
1 542 . 17 1 1 A 43 43 ARG C C 43 175.800 175.960 -0.160 1
1 543 . 17 1 1 A 43 43 ARG CA C 43 55.600 56.743 -1.143 1
1 544 . 17 1 1 A 43 43 ARG CB C 43 30.800 31.035 -0.235 1
1 547 . 17 1 1 A 43 43 ARG N N 43 118.400 120.003 -1.603 1
1 548 . 17 1 1 A 44 44 LEU H H 44 7.610 7.372 0.238 1
1 549 . 17 1 1 A 44 44 LEU HA H 44 4.590 4.848 -0.258 1
1 559 . 17 1 1 A 44 44 LEU C C 44 175.300 174.740 0.560 1
1 560 . 17 1 1 A 44 44 LEU CA C 44 53.900 53.698 0.202 1
1 561 . 17 1 1 A 44 44 LEU CB C 44 44.100 43.971 0.129 1
1 565 . 17 1 1 A 44 44 LEU N N 44 120.400 120.828 -0.428 1
1 566 . 17 1 1 A 45 45 TYR H H 45 7.630 9.153 -1.523 1
1 567 . 17 1 1 A 45 45 TYR HA H 45 5.180 5.140 0.040 1
1 574 . 17 1 1 A 45 45 TYR C C 45 174.600 175.813 -1.213 1
1 575 . 17 1 1 A 45 45 TYR CA C 45 56.300 56.540 -0.240 1
1 576 . 17 1 1 A 45 45 TYR CB C 45 41.400 40.546 0.854 1
1 581 . 17 1 1 A 45 45 TYR N N 45 115.300 126.323 -11.023 1
1 582 . 17 1 1 A 46 46 VAL H H 46 8.770 8.437 0.333 1
1 583 . 17 1 1 A 46 46 VAL HA H 46 4.540 5.108 -0.568 1
1 591 . 17 1 1 A 46 46 VAL C C 46 174.600 175.570 -0.970 1
1 592 . 17 1 1 A 46 46 VAL CA C 46 59.600 59.936 -0.336 1
1 593 . 17 1 1 A 46 46 VAL CB C 46 34.700 34.700 0.000 1
1 596 . 17 1 1 A 46 46 VAL N N 46 115.400 118.277 -2.877 1
1 597 . 17 1 1 A 47 47 GLY H H 47 8.280 8.589 -0.309 1
1 598 . 17 1 1 A 47 47 GLY HA2 H 47 3.610 4.202 -0.592 1
1 599 . 17 1 1 A 47 47 GLY HA3 H 47 4.970 4.208 0.762 1
1 600 . 17 1 1 A 47 47 GLY C C 47 173.100 172.886 0.214 1
1 601 . 17 1 1 A 47 47 GLY CA C 47 43.600 45.912 -2.312 1
1 602 . 17 1 1 A 47 47 GLY N N 47 109.900 109.904 -0.004 1
1 603 . 17 1 1 A 48 48 VAL H H 48 7.630 7.559 0.071 1
1 604 . 17 1 1 A 48 48 VAL HA H 48 4.320 4.576 -0.256 1
1 612 . 17 1 1 A 48 48 VAL CA C 48 58.700 59.002 -0.302 1
1 613 . 17 1 1 A 48 48 VAL CB C 48 32.100 35.082 -2.982 1
1 616 . 17 1 1 A 48 48 VAL N N 48 109.900 120.175 -10.275 1
1 617 . 17 1 1 A 49 49 PRO HA H 49 4.800 4.815 -0.015 1
1 624 . 17 1 1 A 49 49 PRO C C 49 176.700 176.464 0.236 1
1 625 . 17 1 1 A 49 49 PRO CA C 49 62.300 62.345 -0.045 1
1 626 . 17 1 1 A 49 49 PRO CB C 49 35.400 30.934 4.466 1
1 629 . 17 1 1 A 50 50 THR H H 50 8.790 8.272 0.518 1
1 630 . 17 1 1 A 50 50 THR HA H 50 4.690 4.682 0.008 1
1 635 . 17 1 1 A 50 50 THR C C 50 173.500 174.639 -1.139 1
1 636 . 17 1 1 A 50 50 THR CA C 50 60.800 60.313 0.487 1
1 637 . 17 1 1 A 50 50 THR CB C 50 70.800 71.256 -0.456 1
1 639 . 17 1 1 A 50 50 THR N N 50 113.500 112.358 1.142 1
1 640 . 17 1 1 A 51 51 LYS H H 51 7.810 8.525 -0.715 1
1 641 . 17 1 1 A 51 51 LYS HA H 51 4.890 4.663 0.227 1
1 650 . 17 1 1 A 51 51 LYS C C 51 175.900 175.762 0.138 1
1 651 . 17 1 1 A 51 51 LYS CA C 51 54.100 54.948 -0.848 1
1 652 . 17 1 1 A 51 51 LYS CB C 51 35.300 33.793 1.507 1
1 656 . 17 1 1 A 51 51 LYS N N 51 122.200 120.598 1.602 1
1 657 . 17 1 1 A 52 52 SER H H 52 8.410 8.400 0.010 1
1 658 . 17 1 1 A 52 52 SER HA H 52 3.630 4.783 -1.153 1
1 661 . 17 1 1 A 52 52 SER C C 52 175.800 175.060 0.740 1
1 662 . 17 1 1 A 52 52 SER CA C 52 58.800 58.561 0.239 1
1 663 . 17 1 1 A 52 52 SER CB C 52 62.600 63.566 -0.966 1
1 664 . 17 1 1 A 52 52 SER N N 52 118.900 113.383 5.517 1
1 665 . 17 1 1 A 53 53 GLY H H 53 9.070 9.029 0.041 1
1 666 . 17 1 1 A 53 53 GLY HA2 H 53 3.390 3.931 -0.541 1
1 667 . 17 1 1 A 53 53 GLY HA3 H 53 4.460 3.933 0.527 1
1 668 . 17 1 1 A 53 53 GLY C C 53 174.100 174.226 -0.126 1
1 669 . 17 1 1 A 53 53 GLY CA C 53 44.800 46.645 -1.845 1
1 670 . 17 1 1 A 53 53 GLY N N 53 115.600 113.372 2.228 1
1 671 . 17 1 1 A 54 54 ASN H H 54 7.870 7.844 0.026 1
1 672 . 17 1 1 A 54 54 ASN HA H 54 4.570 5.028 -0.458 1
1 677 . 17 1 1 A 54 54 ASN C C 54 175.500 174.246 1.254 1
1 678 . 17 1 1 A 54 54 ASN CA C 54 53.000 51.783 1.217 1
1 679 . 17 1 1 A 54 54 ASN CB C 54 38.600 41.168 -2.568 1
1 680 . 17 1 1 A 54 54 ASN N N 54 119.600 118.638 0.962 1
1 682 . 17 1 1 A 55 55 VAL H H 55 8.770 9.027 -0.257 1
1 683 . 17 1 1 A 55 55 VAL HA H 55 3.880 4.097 -0.217 1
1 691 . 17 1 1 A 55 55 VAL C C 55 176.200 175.450 0.750 1
1 692 . 17 1 1 A 55 55 VAL CA C 55 63.700 63.243 0.457 1
1 693 . 17 1 1 A 55 55 VAL CB C 55 31.600 31.111 0.489 1
1 696 . 17 1 1 A 55 55 VAL N N 55 123.900 123.763 0.137 1
1 697 . 17 1 1 A 56 56 VAL H H 56 9.050 9.144 -0.094 1
1 698 . 17 1 1 A 56 56 VAL HA H 56 3.990 4.038 -0.048 1
1 706 . 17 1 1 A 56 56 VAL C C 56 175.200 176.125 -0.925 1
1 707 . 17 1 1 A 56 56 VAL CA C 56 62.700 64.131 -1.431 1
1 708 . 17 1 1 A 56 56 VAL CB C 56 32.900 32.572 0.328 1
1 711 . 17 1 1 A 56 56 VAL N N 56 127.500 128.968 -1.468 1
1 712 . 17 1 1 A 57 57 CYS H H 57 7.250 7.589 -0.339 1
1 713 . 17 1 1 A 57 57 CYS HA H 57 4.370 4.961 -0.591 1
1 716 . 17 1 1 A 57 57 CYS C C 57 171.900 173.261 -1.361 1
1 717 . 17 1 1 A 57 57 CYS CA C 57 58.600 57.845 0.755 1
1 718 . 17 1 1 A 57 57 CYS CB C 57 28.600 29.757 -1.157 1
1 719 . 17 1 1 A 57 57 CYS N N 57 117.600 118.313 -0.713 1
1 720 . 17 1 1 A 58 58 LYS H H 58 8.880 8.675 0.205 1
1 721 . 17 1 1 A 58 58 LYS HA H 58 4.220 4.502 -0.282 1
1 730 . 17 1 1 A 58 58 LYS C C 58 176.000 176.687 -0.687 1
1 731 . 17 1 1 A 58 58 LYS CA C 58 54.400 55.969 -1.569 1
1 732 . 17 1 1 A 58 58 LYS CB C 58 33.600 33.314 0.286 1
1 736 . 17 1 1 A 58 58 LYS N N 58 132.000 126.800 5.200 1
1 737 . 17 1 1 A 59 59 ASN H H 59 9.500 9.371 0.129 1
1 738 . 17 1 1 A 59 59 ASN HA H 59 4.040 4.301 -0.261 1
1 743 . 17 1 1 A 59 59 ASN C C 59 176.400 175.219 1.181 1
1 744 . 17 1 1 A 59 59 ASN CA C 59 53.200 53.834 -0.634 1
1 745 . 17 1 1 A 59 59 ASN CB C 59 35.900 37.028 -1.128 1
1 746 . 17 1 1 A 59 59 ASN N N 59 127.500 124.022 3.478 1
1 748 . 17 1 1 A 60 60 ILE H H 60 8.050 7.857 0.193 1
1 749 . 17 1 1 A 60 60 ILE HA H 60 3.680 3.788 -0.108 1
1 759 . 17 1 1 A 60 60 ILE C C 60 175.700 176.651 -0.951 1
1 760 . 17 1 1 A 60 60 ILE CA C 60 61.900 62.013 -0.113 1
1 761 . 17 1 1 A 60 60 ILE CB C 60 38.300 37.939 0.361 1
1 765 . 17 1 1 A 60 60 ILE N N 60 120.200 119.896 0.304 1
1 766 . 17 1 1 A 61 61 MET H H 61 9.590 9.314 0.276 1
1 767 . 17 1 1 A 61 61 MET HA H 61 3.920 4.062 -0.142 1
1 775 . 17 1 1 A 61 61 MET C C 61 174.300 175.454 -1.154 1
1 776 . 17 1 1 A 61 61 MET CA C 61 57.000 56.903 0.097 1
1 777 . 17 1 1 A 61 61 MET CB C 61 31.300 30.824 0.476 1
1 780 . 17 1 1 A 61 61 MET N N 61 124.400 126.523 -2.123 1
1 781 . 17 1 1 A 62 62 ASN H H 62 8.250 8.068 0.182 1
1 782 . 17 1 1 A 62 62 ASN HA H 62 4.400 4.662 -0.262 1
1 787 . 17 1 1 A 62 62 ASN C C 62 176.800 174.942 1.858 1
1 788 . 17 1 1 A 62 62 ASN CA C 62 54.400 54.744 -0.344 1
1 789 . 17 1 1 A 62 62 ASN CB C 62 37.600 37.222 0.378 1
1 790 . 17 1 1 A 62 62 ASN N N 62 111.900 109.841 2.059 1
1 792 . 17 1 1 A 63 63 THR H H 63 7.480 7.561 -0.081 1
1 793 . 17 1 1 A 63 63 THR HA H 63 4.210 4.472 -0.262 1
1 798 . 17 1 1 A 63 63 THR C C 63 177.100 174.902 2.198 1
1 799 . 17 1 1 A 63 63 THR CA C 63 62.900 62.749 0.151 1
1 800 . 17 1 1 A 63 63 THR CB C 63 72.500 69.694 2.806 1
1 802 . 17 1 1 A 63 63 THR N N 63 105.900 112.605 -6.705 1
1 803 . 17 1 1 A 64 64 GLY H H 64 9.110 7.993 1.117 1
1 804 . 17 1 1 A 64 64 GLY HA2 H 64 3.580 3.980 -0.400 1
1 805 . 17 1 1 A 64 64 GLY HA3 H 64 4.090 3.983 0.107 1
1 806 . 17 1 1 A 64 64 GLY C C 64 173.200 174.328 -1.128 1
1 807 . 17 1 1 A 64 64 GLY CA C 64 45.300 45.224 0.076 1
1 808 . 17 1 1 A 64 64 GLY N N 64 111.500 110.438 1.062 1
1 809 . 17 1 1 A 65 65 VAL H H 65 7.580 7.620 -0.040 1
1 810 . 17 1 1 A 65 65 VAL HA H 65 4.060 3.937 0.123 1
1 818 . 17 1 1 A 65 65 VAL C C 65 172.900 175.274 -2.374 1
1 819 . 17 1 1 A 65 65 VAL CA C 65 61.400 62.461 -1.061 1
1 820 . 17 1 1 A 65 65 VAL CB C 65 32.900 32.038 0.862 1
1 823 . 17 1 1 A 65 65 VAL N N 65 121.600 121.721 -0.121 1
1 824 . 17 1 1 A 66 66 ASP H H 66 8.210 9.468 -1.258 1
1 825 . 17 1 1 A 66 66 ASP HA H 66 5.320 5.510 -0.190 1
1 828 . 17 1 1 A 66 66 ASP C C 66 174.800 175.374 -0.574 1
1 829 . 17 1 1 A 66 66 ASP CA C 66 51.700 53.000 -1.300 1
1 830 . 17 1 1 A 66 66 ASP CB C 66 43.200 43.635 -0.435 1
1 831 . 17 1 1 A 66 66 ASP N N 66 123.100 127.326 -4.226 1
1 832 . 17 1 1 A 67 67 ILE H H 67 8.540 9.020 -0.480 1
1 833 . 17 1 1 A 67 67 ILE HA H 67 4.630 4.534 0.096 1
1 843 . 17 1 1 A 67 67 ILE C C 67 175.600 175.810 -0.210 1
1 844 . 17 1 1 A 67 67 ILE CA C 67 56.900 61.047 -4.147 1
1 845 . 17 1 1 A 67 67 ILE CB C 67 35.300 37.423 -2.123 1
1 849 . 17 1 1 A 67 67 ILE N N 67 119.200 125.331 -6.131 1
1 850 . 17 1 1 A 68 68 ILE H H 68 9.420 9.042 0.378 1
1 851 . 17 1 1 A 68 68 ILE HA H 68 4.980 5.580 -0.600 1
1 861 . 17 1 1 A 68 68 ILE C C 68 175.000 175.100 -0.100 1
1 862 . 17 1 1 A 68 68 ILE CA C 68 58.600 59.154 -0.554 1
1 863 . 17 1 1 A 68 68 ILE CB C 68 40.900 40.787 0.113 1
1 867 . 17 1 1 A 68 68 ILE N N 68 125.000 123.607 1.393 1
1 868 . 17 1 1 A 69 69 CYS H H 69 8.870 8.986 -0.116 1
1 869 . 17 1 1 A 69 69 CYS HA H 69 4.610 4.578 0.032 1
1 872 . 17 1 1 A 69 69 CYS C C 69 176.200 174.479 1.721 1
1 873 . 17 1 1 A 69 69 CYS CA C 69 58.900 58.767 0.133 1
1 874 . 17 1 1 A 69 69 CYS CB C 69 27.100 28.104 -1.004 1
1 875 . 17 1 1 A 69 69 CYS N N 69 122.300 122.985 -0.685 1
1 876 . 17 1 1 A 70 70 THR H H 70 8.270 8.717 -0.447 1
1 877 . 17 1 1 A 70 70 THR HA H 70 4.710 4.563 0.147 1
1 882 . 17 1 1 A 70 70 THR C C 70 173.600 173.843 -0.243 1
1 883 . 17 1 1 A 70 70 THR CA C 70 61.500 61.313 0.187 1
1 884 . 17 1 1 A 70 70 THR CB C 70 68.100 70.507 -2.407 1
1 886 . 17 1 1 A 70 70 THR N N 70 116.700 119.511 -2.811 1
1 887 . 17 1 1 A 71 71 LYS H H 71 7.370 7.489 -0.119 1
1 888 . 17 1 1 A 71 71 LYS HA H 71 4.520 4.768 -0.248 1
1 897 . 17 1 1 A 71 71 LYS CA C 71 55.100 54.667 0.433 1
1 898 . 17 1 1 A 71 71 LYS CB C 71 37.800 34.593 3.207 1
1 902 . 17 1 1 A 71 71 LYS N N 71 120.900 122.757 -1.857 1
1 903 . 17 1 1 A 72 72 ASN H H 72 8.580 8.768 -0.188 1
1 904 . 17 1 1 A 72 72 ASN HA H 72 4.620 5.097 -0.477 1
1 909 . 17 1 1 A 72 72 ASN C C 72 173.500 174.678 -1.178 1
1 910 . 17 1 1 A 72 72 ASN CA C 72 52.200 53.189 -0.989 1
1 911 . 17 1 1 A 72 72 ASN CB C 72 38.500 38.494 0.006 1
1 912 . 17 1 1 A 72 72 ASN N N 72 122.700 124.492 -1.792 1
1 914 . 17 1 1 A 73 73 LEU H H 73 8.100 9.405 -1.305 1
1 915 . 17 1 1 A 73 73 LEU HA H 73 4.680 4.832 -0.152 1
1 925 . 17 1 1 A 73 73 LEU CA C 73 51.000 52.176 -1.176 1
1 926 . 17 1 1 A 73 73 LEU CB C 73 42.500 42.075 0.425 1
1 930 . 17 1 1 A 73 73 LEU N N 73 125.100 126.654 -1.554 1
1 931 . 17 1 1 A 74 74 PRO HA H 74 4.670 4.629 0.041 1
1 938 . 17 1 1 A 74 74 PRO C C 74 176.500 176.768 -0.268 1
1 939 . 17 1 1 A 74 74 PRO CA C 74 61.800 63.099 -1.299 1
1 940 . 17 1 1 A 74 74 PRO CB C 74 32.800 31.601 1.199 1
1 943 . 17 1 1 A 75 75 LYS H H 75 8.280 8.431 -0.151 1
1 944 . 17 1 1 A 75 75 LYS HA H 75 4.110 4.364 -0.254 1
1 953 . 17 1 1 A 75 75 LYS CA C 75 56.500 55.975 0.525 1
1 954 . 17 1 1 A 75 75 LYS CB C 75 33.300 31.985 1.315 1
1 958 . 17 1 1 A 75 75 LYS N N 75 117.000 122.721 -5.721 1
1 959 . 17 1 1 A 76 76 ASP H H 76 8.570 8.895 -0.325 1
1 960 . 17 1 1 A 76 76 ASP HA H 76 4.530 4.635 -0.105 1
1 963 . 17 1 1 A 76 76 ASP C C 76 176.300 174.894 1.406 1
1 964 . 17 1 1 A 76 76 ASP CA C 76 55.000 53.218 1.782 1
1 965 . 17 1 1 A 76 76 ASP CB C 76 41.100 39.090 2.010 1
1 966 . 17 1 1 A 76 76 ASP N N 76 122.700 126.947 -4.247 1
1 967 . 17 1 1 A 77 77 SER H H 77 8.330 8.266 0.064 1
1 968 . 17 1 1 A 77 77 SER HA H 77 4.410 4.898 -0.488 1
1 971 . 17 1 1 A 77 77 SER C C 77 174.300 172.362 1.938 1
1 972 . 17 1 1 A 77 77 SER CA C 77 58.000 57.518 0.482 1
1 973 . 17 1 1 A 77 77 SER CB C 77 63.900 65.857 -1.957 1
1 974 . 17 1 1 A 77 77 SER N N 77 116.100 118.417 -2.317 1
1 975 . 17 1 1 A 78 78 LEU H H 78 8.350 8.905 -0.555 1
1 976 . 17 1 1 A 78 78 LEU HA H 78 4.280 5.006 -0.726 1
1 986 . 17 1 1 A 78 78 LEU C C 78 177.200 175.967 1.233 1
1 987 . 17 1 1 A 78 78 LEU CA C 78 55.200 53.320 1.880 1
1 988 . 17 1 1 A 78 78 LEU CB C 78 42.100 44.187 -2.087 1
1 992 . 17 1 1 A 78 78 LEU N N 78 124.300 127.753 -3.453 1
1 993 . 17 1 1 A 79 79 GLU H H 79 8.300 8.684 -0.384 1
1 994 . 17 1 1 A 79 79 GLU CA C 79 56.400 55.955 0.445 1
1 995 . 17 1 1 A 79 79 GLU CB C 79 30.200 29.590 0.610 1
1 1 . 18 1 1 A 2 2 HIS HA H 2 4.640 4.193 0.447 1
1 4 . 18 1 1 A 2 2 HIS C C 2 173.600 174.380 -0.780 1
1 5 . 18 1 1 A 2 2 HIS CA C 2 56.500 58.763 -2.263 1
1 6 . 18 1 1 A 2 2 HIS CB C 2 31.000 28.299 2.701 1
1 7 . 18 1 1 A 3 3 LYS H H 3 8.160 8.623 -0.463 1
1 8 . 18 1 1 A 3 3 LYS HA H 3 4.660 4.804 -0.144 1
1 17 . 18 1 1 A 3 3 LYS C C 3 174.400 174.621 -0.221 1
1 18 . 18 1 1 A 3 3 LYS CA C 3 54.800 54.902 -0.102 1
1 19 . 18 1 1 A 3 3 LYS CB C 3 35.800 35.262 0.538 1
1 23 . 18 1 1 A 3 3 LYS N N 3 121.900 121.285 0.615 1
1 24 . 18 1 1 A 4 4 ASP H H 4 8.470 9.107 -0.637 1
1 25 . 18 1 1 A 4 4 ASP HA H 4 4.900 5.385 -0.485 1
1 28 . 18 1 1 A 4 4 ASP C C 4 176.900 175.008 1.892 1
1 29 . 18 1 1 A 4 4 ASP CA C 4 52.700 52.582 0.118 1
1 30 . 18 1 1 A 4 4 ASP CB C 4 44.100 44.908 -0.808 1
1 31 . 18 1 1 A 4 4 ASP N N 4 117.900 123.583 -5.683 1
1 32 . 18 1 1 A 5 5 ILE H H 5 9.570 8.748 0.822 1
1 33 . 18 1 1 A 5 5 ILE HA H 5 3.640 4.487 -0.847 1
1 43 . 18 1 1 A 5 5 ILE C C 5 174.800 175.792 -0.992 1
1 44 . 18 1 1 A 5 5 ILE CA C 5 60.900 60.847 0.053 1
1 45 . 18 1 1 A 5 5 ILE CB C 5 37.000 37.451 -0.451 1
1 49 . 18 1 1 A 5 5 ILE N N 5 124.400 123.288 1.112 1
1 50 . 18 1 1 A 6 6 PHE H H 6 7.790 8.809 -1.019 1
1 51 . 18 1 1 A 6 6 PHE HA H 6 3.160 4.663 -1.503 1
1 58 . 18 1 1 A 6 6 PHE C C 6 173.500 174.407 -0.907 1
1 59 . 18 1 1 A 6 6 PHE CA C 6 56.900 58.756 -1.856 1
1 60 . 18 1 1 A 6 6 PHE CB C 6 40.100 39.350 0.750 1
1 65 . 18 1 1 A 6 6 PHE N N 6 130.200 129.494 0.706 1
1 66 . 18 1 1 A 7 7 THR H H 7 6.790 8.698 -1.908 1
1 67 . 18 1 1 A 7 7 THR HA H 7 4.530 5.253 -0.723 1
1 72 . 18 1 1 A 7 7 THR C C 7 172.300 172.879 -0.579 1
1 73 . 18 1 1 A 7 7 THR CA C 7 59.200 61.047 -1.847 1
1 74 . 18 1 1 A 7 7 THR CB C 7 71.000 70.686 0.314 1
1 76 . 18 1 1 A 7 7 THR N N 7 117.900 123.743 -5.843 1
1 77 . 18 1 1 A 8 8 SER H H 8 7.600 8.670 -1.070 1
1 78 . 18 1 1 A 8 8 SER HA H 8 4.180 4.846 -0.666 1
1 81 . 18 1 1 A 8 8 SER C C 8 175.300 172.302 2.998 1
1 82 . 18 1 1 A 8 8 SER CA C 8 55.800 57.114 -1.314 1
1 83 . 18 1 1 A 8 8 SER CB C 8 64.000 67.252 -3.252 1
1 84 . 18 1 1 A 8 8 SER N N 8 113.400 119.471 -6.071 1
1 85 . 18 1 1 A 9 9 VAL H H 9 8.880 8.536 0.344 1
1 86 . 18 1 1 A 9 9 VAL HA H 9 5.220 5.116 0.104 1
1 94 . 18 1 1 A 9 9 VAL C C 9 174.000 173.914 0.086 1
1 95 . 18 1 1 A 9 9 VAL CA C 9 59.100 59.329 -0.229 1
1 96 . 18 1 1 A 9 9 VAL CB C 9 36.500 34.637 1.863 1
1 99 . 18 1 1 A 9 9 VAL N N 9 114.700 117.640 -2.940 1
1 100 . 18 1 1 A 10 10 VAL H H 10 8.510 9.209 -0.699 1
1 101 . 18 1 1 A 10 10 VAL HA H 10 4.470 4.861 -0.391 1
1 109 . 18 1 1 A 10 10 VAL C C 10 173.700 174.013 -0.313 1
1 110 . 18 1 1 A 10 10 VAL CA C 10 59.400 59.567 -0.167 1
1 111 . 18 1 1 A 10 10 VAL CB C 10 36.000 34.663 1.337 1
1 114 . 18 1 1 A 10 10 VAL N N 10 117.100 125.000 -7.900 1
1 115 . 18 1 1 A 11 11 ARG H H 11 8.500 8.396 0.104 1
1 116 . 18 1 1 A 11 11 ARG HA H 11 4.460 4.696 -0.236 1
1 123 . 18 1 1 A 11 11 ARG C C 11 174.500 174.787 -0.287 1
1 124 . 18 1 1 A 11 11 ARG CA C 11 57.400 55.697 1.703 1
1 125 . 18 1 1 A 11 11 ARG CB C 11 31.000 30.938 0.062 1
1 128 . 18 1 1 A 11 11 ARG N N 11 124.800 126.699 -1.899 1
1 129 . 18 1 1 A 12 12 VAL H H 12 7.650 9.012 -1.362 1
1 130 . 18 1 1 A 12 12 VAL HA H 12 4.970 4.628 0.342 1
1 138 . 18 1 1 A 12 12 VAL C C 12 176.700 175.497 1.203 1
1 139 . 18 1 1 A 12 12 VAL CA C 12 59.400 61.763 -2.363 1
1 140 . 18 1 1 A 12 12 VAL CB C 12 34.400 33.726 0.674 1
1 143 . 18 1 1 A 12 12 VAL N N 12 120.900 125.713 -4.813 1
1 144 . 18 1 1 A 13 13 ARG H H 13 9.020 8.818 0.202 1
1 145 . 18 1 1 A 13 13 ARG HA H 13 4.700 4.530 0.170 1
1 152 . 18 1 1 A 13 13 ARG C C 13 176.000 177.042 -1.042 1
1 153 . 18 1 1 A 13 13 ARG CA C 13 54.600 55.847 -1.247 1
1 154 . 18 1 1 A 13 13 ARG CB C 13 32.900 30.754 2.146 1
1 157 . 18 1 1 A 13 13 ARG N N 13 127.500 127.340 0.160 1
1 158 . 18 1 1 A 14 14 GLY H H 14 8.640 8.603 0.037 1
1 159 . 18 1 1 A 14 14 GLY HA2 H 14 3.680 3.998 -0.318 1
1 160 . 18 1 1 A 14 14 GLY HA3 H 14 4.190 4.006 0.184 1
1 161 . 18 1 1 A 14 14 GLY C C 14 173.700 175.127 -1.427 1
1 162 . 18 1 1 A 14 14 GLY CA C 14 45.600 46.563 -0.963 1
1 163 . 18 1 1 A 14 14 GLY N N 14 108.800 110.839 -2.039 1
1 164 . 18 1 1 A 15 15 SER H H 15 8.220 8.625 -0.405 1
1 165 . 18 1 1 A 15 15 SER HA H 15 5.020 4.745 0.275 1
1 168 . 18 1 1 A 15 15 SER C C 15 175.400 173.568 1.832 1
1 169 . 18 1 1 A 15 15 SER CA C 15 55.300 57.547 -2.247 1
1 170 . 18 1 1 A 15 15 SER CB C 15 64.900 64.083 0.817 1
1 171 . 18 1 1 A 15 15 SER N N 15 113.200 116.994 -3.794 1
1 172 . 18 1 1 A 16 16 LYS H H 16 9.930 7.523 2.407 1
1 173 . 18 1 1 A 16 16 LYS HA H 16 4.190 4.458 -0.268 1
1 182 . 18 1 1 A 16 16 LYS C C 16 176.500 175.978 0.522 1
1 183 . 18 1 1 A 16 16 LYS CA C 16 57.300 55.430 1.870 1
1 184 . 18 1 1 A 16 16 LYS CB C 16 32.300 33.304 -1.004 1
1 188 . 18 1 1 A 16 16 LYS N N 16 129.200 117.336 11.864 1
1 189 . 18 1 1 A 17 17 LYS H H 17 7.960 8.835 -0.875 1
1 190 . 18 1 1 A 17 17 LYS HA H 17 4.030 4.175 -0.145 1
1 199 . 18 1 1 A 17 17 LYS C C 17 175.600 176.428 -0.828 1
1 200 . 18 1 1 A 17 17 LYS CA C 17 56.900 58.661 -1.761 1
1 201 . 18 1 1 A 17 17 LYS CB C 17 34.700 32.778 1.922 1
1 205 . 18 1 1 A 17 17 LYS N N 17 118.500 117.383 1.117 1
1 206 . 18 1 1 A 18 18 TYR H H 18 7.780 7.857 -0.077 1
1 207 . 18 1 1 A 18 18 TYR HA H 18 4.760 4.684 0.076 1
1 214 . 18 1 1 A 18 18 TYR C C 18 174.000 175.583 -1.583 1
1 215 . 18 1 1 A 18 18 TYR CA C 18 56.800 57.582 -0.782 1
1 216 . 18 1 1 A 18 18 TYR CB C 18 41.100 38.033 3.067 1
1 221 . 18 1 1 A 18 18 TYR N N 18 117.100 118.654 -1.554 1
1 222 . 18 1 1 A 19 19 ASN H H 19 8.890 8.966 -0.076 1
1 223 . 18 1 1 A 19 19 ASN HA H 19 4.960 5.061 -0.101 1
1 228 . 18 1 1 A 19 19 ASN C C 19 176.100 174.530 1.570 1
1 229 . 18 1 1 A 19 19 ASN CA C 19 53.600 53.477 0.123 1
1 230 . 18 1 1 A 19 19 ASN CB C 19 40.300 39.029 1.271 1
1 231 . 18 1 1 A 19 19 ASN N N 19 116.600 122.618 -6.018 1
1 233 . 18 1 1 A 20 20 VAL H H 20 7.730 7.585 0.145 1
1 234 . 18 1 1 A 20 20 VAL HA H 20 5.250 4.974 0.276 1
1 242 . 18 1 1 A 20 20 VAL C C 20 173.800 174.119 -0.319 1
1 243 . 18 1 1 A 20 20 VAL CA C 20 59.400 59.974 -0.574 1
1 244 . 18 1 1 A 20 20 VAL CB C 20 37.600 35.052 2.548 1
1 247 . 18 1 1 A 20 20 VAL N N 20 113.900 115.390 -1.490 1
1 248 . 18 1 1 A 21 21 VAL H H 21 8.890 8.762 0.128 1
1 249 . 18 1 1 A 21 21 VAL HA H 21 4.840 4.804 0.036 1
1 257 . 18 1 1 A 21 21 VAL CA C 21 56.800 56.692 0.108 1
1 258 . 18 1 1 A 21 21 VAL CB C 21 36.000 35.369 0.631 1
1 261 . 18 1 1 A 21 21 VAL N N 21 118.500 125.908 -7.408 1
1 262 . 18 1 1 A 22 22 PRO HA H 22 4.940 5.185 -0.245 1
1 269 . 18 1 1 A 22 22 PRO C C 22 175.600 176.341 -0.741 1
1 270 . 18 1 1 A 22 22 PRO CA C 22 62.700 62.539 0.161 1
1 271 . 18 1 1 A 22 22 PRO CB C 22 31.800 31.781 0.019 1
1 274 . 18 1 1 A 23 23 VAL H H 23 8.060 8.696 -0.636 1
1 275 . 18 1 1 A 23 23 VAL HA H 23 5.390 4.974 0.416 1
1 283 . 18 1 1 A 23 23 VAL C C 23 175.400 174.261 1.139 1
1 284 . 18 1 1 A 23 23 VAL CA C 23 57.800 59.133 -1.333 1
1 285 . 18 1 1 A 23 23 VAL CB C 23 36.300 34.610 1.690 1
1 288 . 18 1 1 A 23 23 VAL N N 23 110.900 116.504 -5.604 1
1 289 . 18 1 1 A 24 24 LYS H H 24 8.960 9.316 -0.356 1
1 290 . 18 1 1 A 24 24 LYS HA H 24 5.600 5.335 0.265 1
1 299 . 18 1 1 A 24 24 LYS C C 24 175.600 174.500 1.100 1
1 300 . 18 1 1 A 24 24 LYS CA C 24 54.200 54.139 0.061 1
1 301 . 18 1 1 A 24 24 LYS CB C 24 37.000 36.225 0.775 1
1 305 . 18 1 1 A 24 24 LYS N N 24 117.900 121.175 -3.275 1
1 306 . 18 1 1 A 25 25 SER H H 25 8.950 8.401 0.549 1
1 307 . 18 1 1 A 25 25 SER HA H 25 5.190 5.113 0.077 1
1 310 . 18 1 1 A 25 25 SER C C 25 173.800 175.797 -1.997 1
1 311 . 18 1 1 A 25 25 SER CA C 25 57.700 56.482 1.218 1
1 312 . 18 1 1 A 25 25 SER CB C 25 65.100 64.841 0.259 1
1 313 . 18 1 1 A 25 25 SER N N 25 114.600 113.792 0.808 1
1 314 . 18 1 1 A 26 26 ASN H H 26 9.020 8.547 0.473 1
1 315 . 18 1 1 A 26 26 ASN HA H 26 4.370 4.559 -0.189 1
1 320 . 18 1 1 A 26 26 ASN C C 26 173.500 175.282 -1.782 1
1 321 . 18 1 1 A 26 26 ASN CA C 26 53.700 54.875 -1.175 1
1 322 . 18 1 1 A 26 26 ASN CB C 26 37.100 38.024 -0.924 1
1 323 . 18 1 1 A 26 26 ASN N N 26 118.300 120.410 -2.110 1
1 325 . 18 1 1 A 27 27 LYS H H 27 7.400 7.810 -0.410 1
1 326 . 18 1 1 A 27 27 LYS HA H 27 4.780 4.760 0.020 1
1 335 . 18 1 1 A 27 27 LYS CA C 27 53.500 52.678 0.822 1
1 336 . 18 1 1 A 27 27 LYS CB C 27 34.100 33.623 0.477 1
1 340 . 18 1 1 A 27 27 LYS N N 27 116.600 118.977 -2.377 1
1 341 . 18 1 1 A 28 28 PRO HA H 28 4.040 4.702 -0.662 1
1 348 . 18 1 1 A 28 28 PRO C C 28 174.500 176.386 -1.886 1
1 349 . 18 1 1 A 28 28 PRO CA C 28 63.200 63.102 0.098 1
1 350 . 18 1 1 A 28 28 PRO CB C 28 32.500 32.047 0.453 1
1 353 . 18 1 1 A 29 29 VAL H H 29 8.860 8.785 0.075 1
1 354 . 18 1 1 A 29 29 VAL HA H 29 4.420 4.816 -0.396 1
1 362 . 18 1 1 A 29 29 VAL C C 29 174.800 175.425 -0.625 1
1 363 . 18 1 1 A 29 29 VAL CA C 29 60.300 59.452 0.848 1
1 364 . 18 1 1 A 29 29 VAL CB C 29 36.400 35.105 1.295 1
1 367 . 18 1 1 A 29 29 VAL N N 29 119.800 116.833 2.967 1
1 368 . 18 1 1 A 30 30 GLU H H 30 9.550 8.590 0.960 1
1 369 . 18 1 1 A 30 30 GLU HA H 30 4.260 4.502 -0.242 1
1 374 . 18 1 1 A 30 30 GLU C C 30 177.800 176.349 1.451 1
1 375 . 18 1 1 A 30 30 GLU CA C 30 58.000 56.818 1.182 1
1 376 . 18 1 1 A 30 30 GLU CB C 30 29.700 30.010 -0.310 1
1 378 . 18 1 1 A 30 30 GLU N N 30 128.900 121.774 7.126 1
1 379 . 18 1 1 A 31 31 ILE H H 31 7.910 8.665 -0.755 1
1 380 . 18 1 1 A 31 31 ILE HA H 31 2.120 4.373 -2.253 1
1 390 . 18 1 1 A 31 31 ILE C C 31 178.000 175.663 2.337 1
1 391 . 18 1 1 A 31 31 ILE CA C 31 63.500 60.809 2.691 1
1 392 . 18 1 1 A 31 31 ILE CB C 31 37.200 37.342 -0.142 1
1 396 . 18 1 1 A 31 31 ILE N N 31 122.500 127.297 -4.797 1
1 397 . 18 1 1 A 32 32 SER H H 32 7.940 8.748 -0.808 1
1 398 . 18 1 1 A 32 32 SER HA H 32 4.070 4.948 -0.878 1
1 401 . 18 1 1 A 32 32 SER C C 32 175.800 175.025 0.775 1
1 402 . 18 1 1 A 32 32 SER CA C 32 60.200 58.306 1.894 1
1 403 . 18 1 1 A 32 32 SER CB C 32 62.100 65.159 -3.059 1
1 404 . 18 1 1 A 32 32 SER N N 32 115.300 124.649 -9.349 1
1 405 . 18 1 1 A 33 33 LYS H H 33 7.640 7.706 -0.066 1
1 406 . 18 1 1 A 33 33 LYS HA H 33 4.400 4.214 0.186 1
1 415 . 18 1 1 A 33 33 LYS C C 33 176.600 176.580 0.020 1
1 416 . 18 1 1 A 33 33 LYS CA C 33 56.200 55.465 0.735 1
1 417 . 18 1 1 A 33 33 LYS CB C 33 32.700 31.611 1.089 1
1 421 . 18 1 1 A 33 33 LYS N N 33 119.800 117.915 1.885 1
1 422 . 18 1 1 A 34 34 TRP H H 34 7.860 8.185 -0.325 1
1 423 . 18 1 1 A 34 34 TRP HA H 34 3.870 4.452 -0.582 1
1 426 . 18 1 1 A 34 34 TRP C C 34 178.600 179.079 -0.479 1
1 427 . 18 1 1 A 34 34 TRP CA C 34 60.200 59.932 0.268 1
1 428 . 18 1 1 A 34 34 TRP CB C 34 28.500 28.275 0.225 1
1 429 . 18 1 1 A 34 34 TRP N N 34 120.000 121.195 -1.195 1
1 430 . 18 1 1 A 35 35 ILE H H 35 8.200 7.127 1.073 1
1 431 . 18 1 1 A 35 35 ILE HA H 35 3.990 3.302 0.688 1
1 441 . 18 1 1 A 35 35 ILE C C 35 177.900 177.218 0.682 1
1 442 . 18 1 1 A 35 35 ILE CA C 35 64.300 63.905 0.395 1
1 443 . 18 1 1 A 35 35 ILE CB C 35 37.200 36.860 0.340 1
1 447 . 18 1 1 A 35 35 ILE N N 35 119.500 122.221 -2.721 1
1 448 . 18 1 1 A 36 36 ASP H H 36 7.680 8.017 -0.337 1
1 449 . 18 1 1 A 36 36 ASP HA H 36 4.490 4.160 0.330 1
1 452 . 18 1 1 A 36 36 ASP C C 36 179.200 179.327 -0.127 1
1 453 . 18 1 1 A 36 36 ASP CA C 36 57.500 57.181 0.319 1
1 454 . 18 1 1 A 36 36 ASP CB C 36 40.400 39.911 0.489 1
1 455 . 18 1 1 A 36 36 ASP N N 36 122.000 119.272 2.728 1
1 456 . 18 1 1 A 37 37 PHE H H 37 8.450 8.321 0.129 1
1 457 . 18 1 1 A 37 37 PHE HA H 37 4.080 4.244 -0.164 1
1 465 . 18 1 1 A 37 37 PHE C C 37 178.300 179.029 -0.729 1
1 466 . 18 1 1 A 37 37 PHE CA C 37 58.600 60.626 -2.026 1
1 467 . 18 1 1 A 37 37 PHE CB C 37 37.000 37.944 -0.944 1
1 473 . 18 1 1 A 37 37 PHE N N 37 119.800 119.567 0.233 1
1 474 . 18 1 1 A 38 38 SER H H 38 8.580 8.317 0.263 1
1 475 . 18 1 1 A 38 38 SER HA H 38 4.250 4.370 -0.120 1
1 478 . 18 1 1 A 38 38 SER C C 38 176.800 176.895 -0.095 1
1 479 . 18 1 1 A 38 38 SER CA C 38 62.700 61.536 1.164 1
1 480 . 18 1 1 A 38 38 SER CB C 38 62.700 62.734 -0.034 1
1 481 . 18 1 1 A 38 38 SER N N 38 115.800 115.987 -0.187 1
1 482 . 18 1 1 A 39 39 ASN H H 39 8.190 8.189 0.001 1
1 483 . 18 1 1 A 39 39 ASN HA H 39 4.540 4.404 0.136 1
1 488 . 18 1 1 A 39 39 ASN C C 39 178.500 177.958 0.542 1
1 489 . 18 1 1 A 39 39 ASN CA C 39 56.200 56.873 -0.673 1
1 490 . 18 1 1 A 39 39 ASN CB C 39 37.900 39.230 -1.330 1
1 491 . 18 1 1 A 39 39 ASN N N 39 121.300 120.550 0.750 1
1 493 . 18 1 1 A 40 40 VAL H H 40 7.840 8.033 -0.193 1
1 494 . 18 1 1 A 40 40 VAL HA H 40 3.650 3.648 0.002 1
1 502 . 18 1 1 A 40 40 VAL C C 40 179.000 178.175 0.825 1
1 503 . 18 1 1 A 40 40 VAL CA C 40 66.600 66.373 0.227 1
1 504 . 18 1 1 A 40 40 VAL CB C 40 32.100 31.538 0.562 1
1 507 . 18 1 1 A 40 40 VAL N N 40 121.800 118.839 2.961 1
1 508 . 18 1 1 A 41 41 LEU H H 41 8.210 8.344 -0.134 1
1 509 . 18 1 1 A 41 41 LEU HA H 41 3.840 4.060 -0.220 1
1 519 . 18 1 1 A 41 41 LEU C C 41 178.800 177.749 1.051 1
1 520 . 18 1 1 A 41 41 LEU CA C 41 57.400 57.290 0.110 1
1 521 . 18 1 1 A 41 41 LEU CB C 41 41.200 41.239 -0.039 1
1 525 . 18 1 1 A 41 41 LEU N N 41 117.700 120.065 -2.365 1
1 526 . 18 1 1 A 42 42 SER H H 42 7.980 7.948 0.032 1
1 527 . 18 1 1 A 42 42 SER HA H 42 4.260 4.429 -0.169 1
1 530 . 18 1 1 A 42 42 SER C C 42 174.900 174.868 0.032 1
1 531 . 18 1 1 A 42 42 SER CA C 42 61.200 59.338 1.862 1
1 532 . 18 1 1 A 42 42 SER CB C 42 63.100 63.308 -0.208 1
1 533 . 18 1 1 A 42 42 SER N N 42 113.200 114.370 -1.170 1
1 534 . 18 1 1 A 43 43 ARG H H 43 7.100 8.054 -0.954 1
1 535 . 18 1 1 A 43 43 ARG HA H 43 4.500 4.755 -0.255 1
1 542 . 18 1 1 A 43 43 ARG C C 43 175.800 175.602 0.198 1
1 543 . 18 1 1 A 43 43 ARG CA C 43 55.600 55.482 0.118 1
1 544 . 18 1 1 A 43 43 ARG CB C 43 30.800 31.558 -0.758 1
1 547 . 18 1 1 A 43 43 ARG N N 43 118.400 116.765 1.635 1
1 548 . 18 1 1 A 44 44 LEU H H 44 7.610 7.222 0.388 1
1 549 . 18 1 1 A 44 44 LEU HA H 44 4.590 4.597 -0.007 1
1 559 . 18 1 1 A 44 44 LEU C C 44 175.300 174.820 0.480 1
1 560 . 18 1 1 A 44 44 LEU CA C 44 53.900 53.321 0.579 1
1 561 . 18 1 1 A 44 44 LEU CB C 44 44.100 42.313 1.787 1
1 565 . 18 1 1 A 44 44 LEU N N 44 120.400 122.657 -2.257 1
1 566 . 18 1 1 A 45 45 TYR H H 45 7.630 8.977 -1.347 1
1 567 . 18 1 1 A 45 45 TYR HA H 45 5.180 4.881 0.299 1
1 574 . 18 1 1 A 45 45 TYR C C 45 174.600 175.016 -0.416 1
1 575 . 18 1 1 A 45 45 TYR CA C 45 56.300 57.408 -1.108 1
1 576 . 18 1 1 A 45 45 TYR CB C 45 41.400 37.268 4.132 1
1 581 . 18 1 1 A 45 45 TYR N N 45 115.300 124.990 -9.690 1
1 582 . 18 1 1 A 46 46 VAL H H 46 8.770 8.337 0.433 1
1 583 . 18 1 1 A 46 46 VAL HA H 46 4.540 4.538 0.002 1
1 591 . 18 1 1 A 46 46 VAL C C 46 174.600 176.008 -1.408 1
1 592 . 18 1 1 A 46 46 VAL CA C 46 59.600 61.373 -1.773 1
1 593 . 18 1 1 A 46 46 VAL CB C 46 34.700 33.516 1.184 1
1 596 . 18 1 1 A 46 46 VAL N N 46 115.400 125.194 -9.794 1
1 597 . 18 1 1 A 47 47 GLY H H 47 8.280 8.602 -0.322 1
1 598 . 18 1 1 A 47 47 GLY HA2 H 47 3.610 4.168 -0.558 1
1 599 . 18 1 1 A 47 47 GLY HA3 H 47 4.970 4.171 0.799 1
1 600 . 18 1 1 A 47 47 GLY C C 47 173.100 173.825 -0.725 1
1 601 . 18 1 1 A 47 47 GLY CA C 47 43.600 46.308 -2.708 1
1 602 . 18 1 1 A 47 47 GLY N N 47 109.900 114.374 -4.474 1
1 603 . 18 1 1 A 48 48 VAL H H 48 7.630 7.560 0.070 1
1 604 . 18 1 1 A 48 48 VAL HA H 48 4.320 4.869 -0.549 1
1 612 . 18 1 1 A 48 48 VAL CA C 48 58.700 58.185 0.515 1
1 613 . 18 1 1 A 48 48 VAL CB C 48 32.100 34.661 -2.561 1
1 616 . 18 1 1 A 48 48 VAL N N 48 109.900 116.239 -6.339 1
1 617 . 18 1 1 A 49 49 PRO HA H 49 4.800 4.796 0.004 1
1 624 . 18 1 1 A 49 49 PRO C C 49 176.700 176.625 0.075 1
1 625 . 18 1 1 A 49 49 PRO CA C 49 62.300 62.732 -0.432 1
1 626 . 18 1 1 A 49 49 PRO CB C 49 35.400 32.011 3.389 1
1 629 . 18 1 1 A 50 50 THR H H 50 8.790 8.596 0.194 1
1 630 . 18 1 1 A 50 50 THR HA H 50 4.690 5.150 -0.460 1
1 635 . 18 1 1 A 50 50 THR C C 50 173.500 172.813 0.687 1
1 636 . 18 1 1 A 50 50 THR CA C 50 60.800 59.611 1.189 1
1 637 . 18 1 1 A 50 50 THR CB C 50 70.800 72.671 -1.871 1
1 639 . 18 1 1 A 50 50 THR N N 50 113.500 112.407 1.093 1
1 640 . 18 1 1 A 51 51 LYS H H 51 7.810 8.646 -0.836 1
1 641 . 18 1 1 A 51 51 LYS HA H 51 4.890 4.898 -0.008 1
1 650 . 18 1 1 A 51 51 LYS C C 51 175.900 176.016 -0.116 1
1 651 . 18 1 1 A 51 51 LYS CA C 51 54.100 54.269 -0.169 1
1 652 . 18 1 1 A 51 51 LYS CB C 51 35.300 35.578 -0.278 1
1 656 . 18 1 1 A 51 51 LYS N N 51 122.200 120.006 2.194 1
1 657 . 18 1 1 A 52 52 SER H H 52 8.410 8.530 -0.120 1
1 658 . 18 1 1 A 52 52 SER HA H 52 3.630 4.157 -0.527 1
1 661 . 18 1 1 A 52 52 SER C C 52 175.800 175.353 0.447 1
1 662 . 18 1 1 A 52 52 SER CA C 52 58.800 59.905 -1.105 1
1 663 . 18 1 1 A 52 52 SER CB C 52 62.600 62.711 -0.111 1
1 664 . 18 1 1 A 52 52 SER N N 52 118.900 117.261 1.639 1
1 665 . 18 1 1 A 53 53 GLY H H 53 9.070 9.165 -0.095 1
1 666 . 18 1 1 A 53 53 GLY HA2 H 53 3.390 3.897 -0.507 1
1 667 . 18 1 1 A 53 53 GLY HA3 H 53 4.460 3.899 0.561 1
1 668 . 18 1 1 A 53 53 GLY C C 53 174.100 174.188 -0.088 1
1 669 . 18 1 1 A 53 53 GLY CA C 53 44.800 45.523 -0.723 1
1 670 . 18 1 1 A 53 53 GLY N N 53 115.600 114.934 0.666 1
1 671 . 18 1 1 A 54 54 ASN H H 54 7.870 7.754 0.116 1
1 672 . 18 1 1 A 54 54 ASN HA H 54 4.570 4.907 -0.337 1
1 677 . 18 1 1 A 54 54 ASN C C 54 175.500 174.482 1.018 1
1 678 . 18 1 1 A 54 54 ASN CA C 54 53.000 52.290 0.710 1
1 679 . 18 1 1 A 54 54 ASN CB C 54 38.600 39.671 -1.071 1
1 680 . 18 1 1 A 54 54 ASN N N 54 119.600 118.710 0.890 1
1 682 . 18 1 1 A 55 55 VAL H H 55 8.770 8.941 -0.171 1
1 683 . 18 1 1 A 55 55 VAL HA H 55 3.880 3.954 -0.074 1
1 691 . 18 1 1 A 55 55 VAL C C 55 176.200 175.391 0.809 1
1 692 . 18 1 1 A 55 55 VAL CA C 55 63.700 63.492 0.208 1
1 693 . 18 1 1 A 55 55 VAL CB C 55 31.600 31.163 0.437 1
1 696 . 18 1 1 A 55 55 VAL N N 55 123.900 123.150 0.750 1
1 697 . 18 1 1 A 56 56 VAL H H 56 9.050 9.098 -0.048 1
1 698 . 18 1 1 A 56 56 VAL HA H 56 3.990 4.008 -0.018 1
1 706 . 18 1 1 A 56 56 VAL C C 56 175.200 176.267 -1.067 1
1 707 . 18 1 1 A 56 56 VAL CA C 56 62.700 64.136 -1.436 1
1 708 . 18 1 1 A 56 56 VAL CB C 56 32.900 32.609 0.291 1
1 711 . 18 1 1 A 56 56 VAL N N 56 127.500 128.388 -0.888 1
1 712 . 18 1 1 A 57 57 CYS H H 57 7.250 7.663 -0.413 1
1 713 . 18 1 1 A 57 57 CYS HA H 57 4.370 4.806 -0.436 1
1 716 . 18 1 1 A 57 57 CYS C C 57 171.900 172.762 -0.862 1
1 717 . 18 1 1 A 57 57 CYS CA C 57 58.600 57.496 1.104 1
1 718 . 18 1 1 A 57 57 CYS CB C 57 28.600 30.104 -1.504 1
1 719 . 18 1 1 A 57 57 CYS N N 57 117.600 116.980 0.620 1
1 720 . 18 1 1 A 58 58 LYS H H 58 8.880 8.647 0.233 1
1 721 . 18 1 1 A 58 58 LYS HA H 58 4.220 4.449 -0.229 1
1 730 . 18 1 1 A 58 58 LYS C C 58 176.000 176.525 -0.525 1
1 731 . 18 1 1 A 58 58 LYS CA C 58 54.400 56.072 -1.672 1
1 732 . 18 1 1 A 58 58 LYS CB C 58 33.600 33.267 0.333 1
1 736 . 18 1 1 A 58 58 LYS N N 58 132.000 129.106 2.894 1
1 737 . 18 1 1 A 59 59 ASN H H 59 9.500 8.990 0.510 1
1 738 . 18 1 1 A 59 59 ASN HA H 59 4.040 4.393 -0.353 1
1 743 . 18 1 1 A 59 59 ASN C C 59 176.400 175.456 0.944 1
1 744 . 18 1 1 A 59 59 ASN CA C 59 53.200 54.241 -1.041 1
1 745 . 18 1 1 A 59 59 ASN CB C 59 35.900 36.550 -0.650 1
1 746 . 18 1 1 A 59 59 ASN N N 59 127.500 122.570 4.930 1
1 748 . 18 1 1 A 60 60 ILE H H 60 8.050 7.745 0.305 1
1 749 . 18 1 1 A 60 60 ILE HA H 60 3.680 3.883 -0.203 1
1 759 . 18 1 1 A 60 60 ILE C C 60 175.700 176.590 -0.890 1
1 760 . 18 1 1 A 60 60 ILE CA C 60 61.900 64.108 -2.208 1
1 761 . 18 1 1 A 60 60 ILE CB C 60 38.300 37.527 0.773 1
1 765 . 18 1 1 A 60 60 ILE N N 60 120.200 118.943 1.257 1
1 766 . 18 1 1 A 61 61 MET H H 61 9.590 7.764 1.826 1
1 767 . 18 1 1 A 61 61 MET HA H 61 3.920 4.808 -0.888 1
1 775 . 18 1 1 A 61 61 MET C C 61 174.300 175.317 -1.017 1
1 776 . 18 1 1 A 61 61 MET CA C 61 57.000 54.727 2.273 1
1 777 . 18 1 1 A 61 61 MET CB C 61 31.300 33.150 -1.850 1
1 780 . 18 1 1 A 61 61 MET N N 61 124.400 118.285 6.115 1
1 781 . 18 1 1 A 62 62 ASN H H 62 8.250 7.929 0.321 1
1 782 . 18 1 1 A 62 62 ASN HA H 62 4.400 4.450 -0.050 1
1 787 . 18 1 1 A 62 62 ASN C C 62 176.800 175.336 1.464 1
1 788 . 18 1 1 A 62 62 ASN CA C 62 54.400 54.553 -0.153 1
1 789 . 18 1 1 A 62 62 ASN CB C 62 37.600 36.488 1.112 1
1 790 . 18 1 1 A 62 62 ASN N N 62 111.900 114.425 -2.525 1
1 792 . 18 1 1 A 63 63 THR H H 63 7.480 8.184 -0.704 1
1 793 . 18 1 1 A 63 63 THR HA H 63 4.210 4.376 -0.166 1
1 798 . 18 1 1 A 63 63 THR C C 63 177.100 176.387 0.713 1
1 799 . 18 1 1 A 63 63 THR CA C 63 62.900 62.736 0.164 1
1 800 . 18 1 1 A 63 63 THR CB C 63 72.500 70.530 1.970 1
1 802 . 18 1 1 A 63 63 THR N N 63 105.900 111.267 -5.367 1
1 803 . 18 1 1 A 64 64 GLY H H 64 9.110 8.510 0.600 1
1 804 . 18 1 1 A 64 64 GLY HA2 H 64 3.580 3.940 -0.360 1
1 805 . 18 1 1 A 64 64 GLY HA3 H 64 4.090 3.944 0.146 1
1 806 . 18 1 1 A 64 64 GLY C C 64 173.200 174.575 -1.375 1
1 807 . 18 1 1 A 64 64 GLY CA C 64 45.300 45.701 -0.401 1
1 808 . 18 1 1 A 64 64 GLY N N 64 111.500 112.211 -0.711 1
1 809 . 18 1 1 A 65 65 VAL H H 65 7.580 7.550 0.030 1
1 810 . 18 1 1 A 65 65 VAL HA H 65 4.060 4.293 -0.233 1
1 818 . 18 1 1 A 65 65 VAL C C 65 172.900 174.568 -1.668 1
1 819 . 18 1 1 A 65 65 VAL CA C 65 61.400 61.472 -0.072 1
1 820 . 18 1 1 A 65 65 VAL CB C 65 32.900 33.161 -0.261 1
1 823 . 18 1 1 A 65 65 VAL N N 65 121.600 122.453 -0.853 1
1 824 . 18 1 1 A 66 66 ASP H H 66 8.210 8.975 -0.765 1
1 825 . 18 1 1 A 66 66 ASP HA H 66 5.320 4.936 0.384 1
1 828 . 18 1 1 A 66 66 ASP C C 66 174.800 175.201 -0.401 1
1 829 . 18 1 1 A 66 66 ASP CA C 66 51.700 53.403 -1.703 1
1 830 . 18 1 1 A 66 66 ASP CB C 66 43.200 41.508 1.692 1
1 831 . 18 1 1 A 66 66 ASP N N 66 123.100 127.417 -4.317 1
1 832 . 18 1 1 A 67 67 ILE H H 67 8.540 8.426 0.114 1
1 833 . 18 1 1 A 67 67 ILE HA H 67 4.630 4.302 0.328 1
1 843 . 18 1 1 A 67 67 ILE C C 67 175.600 175.794 -0.194 1
1 844 . 18 1 1 A 67 67 ILE CA C 67 56.900 61.083 -4.183 1
1 845 . 18 1 1 A 67 67 ILE CB C 67 35.300 36.793 -1.493 1
1 849 . 18 1 1 A 67 67 ILE N N 67 119.200 125.432 -6.232 1
1 850 . 18 1 1 A 68 68 ILE H H 68 9.420 8.960 0.460 1
1 851 . 18 1 1 A 68 68 ILE HA H 68 4.980 5.324 -0.344 1
1 861 . 18 1 1 A 68 68 ILE C C 68 175.000 174.259 0.741 1
1 862 . 18 1 1 A 68 68 ILE CA C 68 58.600 58.780 -0.180 1
1 863 . 18 1 1 A 68 68 ILE CB C 68 40.900 40.786 0.114 1
1 867 . 18 1 1 A 68 68 ILE N N 68 125.000 122.921 2.079 1
1 868 . 18 1 1 A 69 69 CYS H H 69 8.870 9.024 -0.154 1
1 869 . 18 1 1 A 69 69 CYS HA H 69 4.610 4.853 -0.243 1
1 872 . 18 1 1 A 69 69 CYS C C 69 176.200 174.921 1.279 1
1 873 . 18 1 1 A 69 69 CYS CA C 69 58.900 58.117 0.783 1
1 874 . 18 1 1 A 69 69 CYS CB C 69 27.100 29.445 -2.345 1
1 875 . 18 1 1 A 69 69 CYS N N 69 122.300 123.078 -0.778 1
1 876 . 18 1 1 A 70 70 THR H H 70 8.270 8.422 -0.152 1
1 877 . 18 1 1 A 70 70 THR HA H 70 4.710 4.561 0.149 1
1 882 . 18 1 1 A 70 70 THR C C 70 173.600 173.757 -0.157 1
1 883 . 18 1 1 A 70 70 THR CA C 70 61.500 61.449 0.051 1
1 884 . 18 1 1 A 70 70 THR CB C 70 68.100 70.133 -2.033 1
1 886 . 18 1 1 A 70 70 THR N N 70 116.700 119.559 -2.859 1
1 887 . 18 1 1 A 71 71 LYS H H 71 7.370 7.054 0.316 1
1 888 . 18 1 1 A 71 71 LYS HA H 71 4.520 4.781 -0.261 1
1 897 . 18 1 1 A 71 71 LYS CA C 71 55.100 54.640 0.460 1
1 898 . 18 1 1 A 71 71 LYS CB C 71 37.800 34.458 3.342 1
1 902 . 18 1 1 A 71 71 LYS N N 71 120.900 122.985 -2.085 1
1 903 . 18 1 1 A 72 72 ASN H H 72 8.580 8.811 -0.231 1
1 904 . 18 1 1 A 72 72 ASN HA H 72 4.620 5.276 -0.656 1
1 909 . 18 1 1 A 72 72 ASN C C 72 173.500 174.120 -0.620 1
1 910 . 18 1 1 A 72 72 ASN CA C 72 52.200 52.520 -0.320 1
1 911 . 18 1 1 A 72 72 ASN CB C 72 38.500 39.435 -0.935 1
1 912 . 18 1 1 A 72 72 ASN N N 72 122.700 123.488 -0.788 1
1 914 . 18 1 1 A 73 73 LEU H H 73 8.100 9.478 -1.378 1
1 915 . 18 1 1 A 73 73 LEU HA H 73 4.680 4.725 -0.045 1
1 925 . 18 1 1 A 73 73 LEU CA C 73 51.000 51.652 -0.652 1
1 926 . 18 1 1 A 73 73 LEU CB C 73 42.500 42.003 0.497 1
1 930 . 18 1 1 A 73 73 LEU N N 73 125.100 126.345 -1.245 1
1 931 . 18 1 1 A 74 74 PRO HA H 74 4.670 4.868 -0.198 1
1 938 . 18 1 1 A 74 74 PRO C C 74 176.500 175.340 1.160 1
1 939 . 18 1 1 A 74 74 PRO CA C 74 61.800 62.606 -0.806 1
1 940 . 18 1 1 A 74 74 PRO CB C 74 32.800 32.506 0.294 1
1 943 . 18 1 1 A 75 75 LYS H H 75 8.280 8.629 -0.349 1
1 944 . 18 1 1 A 75 75 LYS HA H 75 4.110 4.735 -0.625 1
1 953 . 18 1 1 A 75 75 LYS CA C 75 56.500 55.615 0.885 1
1 954 . 18 1 1 A 75 75 LYS CB C 75 33.300 35.719 -2.419 1
1 958 . 18 1 1 A 75 75 LYS N N 75 117.000 122.400 -5.400 1
1 959 . 18 1 1 A 76 76 ASP H H 76 8.570 8.832 -0.262 1
1 960 . 18 1 1 A 76 76 ASP HA H 76 4.530 4.692 -0.162 1
1 963 . 18 1 1 A 76 76 ASP C C 76 176.300 175.810 0.490 1
1 964 . 18 1 1 A 76 76 ASP CA C 76 55.000 54.343 0.657 1
1 965 . 18 1 1 A 76 76 ASP CB C 76 41.100 41.354 -0.254 1
1 966 . 18 1 1 A 76 76 ASP N N 76 122.700 125.266 -2.566 1
1 967 . 18 1 1 A 77 77 SER H H 77 8.330 8.495 -0.165 1
1 968 . 18 1 1 A 77 77 SER HA H 77 4.410 4.744 -0.334 1
1 971 . 18 1 1 A 77 77 SER C C 77 174.300 173.874 0.426 1
1 972 . 18 1 1 A 77 77 SER CA C 77 58.000 57.712 0.288 1
1 973 . 18 1 1 A 77 77 SER CB C 77 63.900 63.119 0.781 1
1 974 . 18 1 1 A 77 77 SER N N 77 116.100 117.802 -1.702 1
1 975 . 18 1 1 A 78 78 LEU H H 78 8.350 7.480 0.870 1
1 976 . 18 1 1 A 78 78 LEU HA H 78 4.280 4.223 0.057 1
1 986 . 18 1 1 A 78 78 LEU C C 78 177.200 176.188 1.012 1
1 987 . 18 1 1 A 78 78 LEU CA C 78 55.200 55.516 -0.316 1
1 988 . 18 1 1 A 78 78 LEU CB C 78 42.100 43.122 -1.022 1
1 992 . 18 1 1 A 78 78 LEU N N 78 124.300 124.389 -0.089 1
1 993 . 18 1 1 A 79 79 GLU H H 79 8.300 8.435 -0.135 1
1 994 . 18 1 1 A 79 79 GLU CA C 79 56.400 56.690 -0.290 1
1 995 . 18 1 1 A 79 79 GLU CB C 79 30.200 30.043 0.157 1
1 1 . 19 1 1 A 2 2 HIS HA H 2 4.640 4.753 -0.113 1
1 4 . 19 1 1 A 2 2 HIS C C 2 173.600 174.500 -0.900 1
1 5 . 19 1 1 A 2 2 HIS CA C 2 56.500 55.074 1.426 1
1 6 . 19 1 1 A 2 2 HIS CB C 2 31.000 31.372 -0.372 1
1 7 . 19 1 1 A 3 3 LYS H H 3 8.160 7.699 0.461 1
1 8 . 19 1 1 A 3 3 LYS HA H 3 4.660 4.852 -0.192 1
1 17 . 19 1 1 A 3 3 LYS C C 3 174.400 175.044 -0.644 1
1 18 . 19 1 1 A 3 3 LYS CA C 3 54.800 54.786 0.014 1
1 19 . 19 1 1 A 3 3 LYS CB C 3 35.800 34.788 1.012 1
1 23 . 19 1 1 A 3 3 LYS N N 3 121.900 120.140 1.760 1
1 24 . 19 1 1 A 4 4 ASP H H 4 8.470 8.839 -0.369 1
1 25 . 19 1 1 A 4 4 ASP HA H 4 4.900 5.261 -0.361 1
1 28 . 19 1 1 A 4 4 ASP C C 4 176.900 174.584 2.316 1
1 29 . 19 1 1 A 4 4 ASP CA C 4 52.700 52.728 -0.028 1
1 30 . 19 1 1 A 4 4 ASP CB C 4 44.100 44.883 -0.783 1
1 31 . 19 1 1 A 4 4 ASP N N 4 117.900 122.363 -4.463 1
1 32 . 19 1 1 A 5 5 ILE H H 5 9.570 8.710 0.860 1
1 33 . 19 1 1 A 5 5 ILE HA H 5 3.640 4.115 -0.475 1
1 43 . 19 1 1 A 5 5 ILE C C 5 174.800 176.096 -1.296 1
1 44 . 19 1 1 A 5 5 ILE CA C 5 60.900 61.275 -0.375 1
1 45 . 19 1 1 A 5 5 ILE CB C 5 37.000 37.490 -0.490 1
1 49 . 19 1 1 A 5 5 ILE N N 5 124.400 122.006 2.394 1
1 50 . 19 1 1 A 6 6 PHE H H 6 7.790 8.885 -1.095 1
1 51 . 19 1 1 A 6 6 PHE HA H 6 3.160 4.682 -1.522 1
1 58 . 19 1 1 A 6 6 PHE C C 6 173.500 174.640 -1.140 1
1 59 . 19 1 1 A 6 6 PHE CA C 6 56.900 58.744 -1.844 1
1 60 . 19 1 1 A 6 6 PHE CB C 6 40.100 39.099 1.001 1
1 65 . 19 1 1 A 6 6 PHE N N 6 130.200 128.717 1.483 1
1 66 . 19 1 1 A 7 7 THR H H 7 6.790 8.867 -2.077 1
1 67 . 19 1 1 A 7 7 THR HA H 7 4.530 4.961 -0.431 1
1 72 . 19 1 1 A 7 7 THR C C 7 172.300 173.318 -1.018 1
1 73 . 19 1 1 A 7 7 THR CA C 7 59.200 60.847 -1.647 1
1 74 . 19 1 1 A 7 7 THR CB C 7 71.000 70.583 0.417 1
1 76 . 19 1 1 A 7 7 THR N N 7 117.900 123.850 -5.950 1
1 77 . 19 1 1 A 8 8 SER H H 8 7.600 8.789 -1.189 1
1 78 . 19 1 1 A 8 8 SER HA H 8 4.180 4.727 -0.547 1
1 81 . 19 1 1 A 8 8 SER C C 8 175.300 172.293 3.007 1
1 82 . 19 1 1 A 8 8 SER CA C 8 55.800 55.742 0.058 1
1 83 . 19 1 1 A 8 8 SER CB C 8 64.000 64.549 -0.549 1
1 84 . 19 1 1 A 8 8 SER N N 8 113.400 120.254 -6.854 1
1 85 . 19 1 1 A 9 9 VAL H H 9 8.880 8.487 0.393 1
1 86 . 19 1 1 A 9 9 VAL HA H 9 5.220 4.965 0.255 1
1 94 . 19 1 1 A 9 9 VAL C C 9 174.000 173.448 0.552 1
1 95 . 19 1 1 A 9 9 VAL CA C 9 59.100 59.229 -0.129 1
1 96 . 19 1 1 A 9 9 VAL CB C 9 36.500 35.722 0.778 1
1 99 . 19 1 1 A 9 9 VAL N N 9 114.700 118.390 -3.690 1
1 100 . 19 1 1 A 10 10 VAL H H 10 8.510 9.093 -0.583 1
1 101 . 19 1 1 A 10 10 VAL HA H 10 4.470 4.785 -0.315 1
1 109 . 19 1 1 A 10 10 VAL C C 10 173.700 174.165 -0.465 1
1 110 . 19 1 1 A 10 10 VAL CA C 10 59.400 59.573 -0.173 1
1 111 . 19 1 1 A 10 10 VAL CB C 10 36.000 34.960 1.040 1
1 114 . 19 1 1 A 10 10 VAL N N 10 117.100 122.310 -5.210 1
1 115 . 19 1 1 A 11 11 ARG H H 11 8.500 8.216 0.284 1
1 116 . 19 1 1 A 11 11 ARG HA H 11 4.460 4.596 -0.136 1
1 123 . 19 1 1 A 11 11 ARG C C 11 174.500 175.334 -0.834 1
1 124 . 19 1 1 A 11 11 ARG CA C 11 57.400 55.724 1.676 1
1 125 . 19 1 1 A 11 11 ARG CB C 11 31.000 30.256 0.744 1
1 128 . 19 1 1 A 11 11 ARG N N 11 124.800 126.489 -1.689 1
1 129 . 19 1 1 A 12 12 VAL H H 12 7.650 8.953 -1.303 1
1 130 . 19 1 1 A 12 12 VAL HA H 12 4.970 5.108 -0.138 1
1 138 . 19 1 1 A 12 12 VAL C C 12 176.700 174.611 2.089 1
1 139 . 19 1 1 A 12 12 VAL CA C 12 59.400 61.721 -2.321 1
1 140 . 19 1 1 A 12 12 VAL CB C 12 34.400 32.780 1.620 1
1 143 . 19 1 1 A 12 12 VAL N N 12 120.900 125.182 -4.282 1
1 144 . 19 1 1 A 13 13 ARG H H 13 9.020 9.033 -0.013 1
1 145 . 19 1 1 A 13 13 ARG HA H 13 4.700 5.109 -0.409 1
1 152 . 19 1 1 A 13 13 ARG C C 13 176.000 175.328 0.672 1
1 153 . 19 1 1 A 13 13 ARG CA C 13 54.600 54.842 -0.242 1
1 154 . 19 1 1 A 13 13 ARG CB C 13 32.900 33.034 -0.134 1
1 157 . 19 1 1 A 13 13 ARG N N 13 127.500 129.292 -1.792 1
1 158 . 19 1 1 A 14 14 GLY H H 14 8.640 8.328 0.312 1
1 159 . 19 1 1 A 14 14 GLY HA2 H 14 3.680 4.222 -0.542 1
1 160 . 19 1 1 A 14 14 GLY HA3 H 14 4.190 4.223 -0.033 1
1 161 . 19 1 1 A 14 14 GLY C C 14 173.700 171.772 1.928 1
1 162 . 19 1 1 A 14 14 GLY CA C 14 45.600 45.767 -0.167 1
1 163 . 19 1 1 A 14 14 GLY N N 14 108.800 113.550 -4.750 1
1 164 . 19 1 1 A 15 15 SER H H 15 8.220 8.410 -0.190 1
1 165 . 19 1 1 A 15 15 SER HA H 15 5.020 4.735 0.285 1
1 168 . 19 1 1 A 15 15 SER C C 15 175.400 173.461 1.939 1
1 169 . 19 1 1 A 15 15 SER CA C 15 55.300 57.838 -2.538 1
1 170 . 19 1 1 A 15 15 SER CB C 15 64.900 63.072 1.828 1
1 171 . 19 1 1 A 15 15 SER N N 15 113.200 115.498 -2.298 1
1 172 . 19 1 1 A 16 16 LYS H H 16 9.930 8.446 1.484 1
1 173 . 19 1 1 A 16 16 LYS HA H 16 4.190 4.843 -0.653 1
1 182 . 19 1 1 A 16 16 LYS C C 16 176.500 174.180 2.320 1
1 183 . 19 1 1 A 16 16 LYS CA C 16 57.300 55.193 2.107 1
1 184 . 19 1 1 A 16 16 LYS CB C 16 32.300 34.007 -1.707 1
1 188 . 19 1 1 A 16 16 LYS N N 16 129.200 124.681 4.519 1
1 189 . 19 1 1 A 17 17 LYS H H 17 7.960 8.155 -0.195 1
1 190 . 19 1 1 A 17 17 LYS HA H 17 4.030 4.697 -0.667 1
1 199 . 19 1 1 A 17 17 LYS C C 17 175.600 174.683 0.917 1
1 200 . 19 1 1 A 17 17 LYS CA C 17 56.900 55.199 1.701 1
1 201 . 19 1 1 A 17 17 LYS CB C 17 34.700 33.074 1.626 1
1 205 . 19 1 1 A 17 17 LYS N N 17 118.500 119.255 -0.755 1
1 206 . 19 1 1 A 18 18 TYR H H 18 7.780 8.460 -0.680 1
1 207 . 19 1 1 A 18 18 TYR HA H 18 4.760 5.028 -0.268 1
1 214 . 19 1 1 A 18 18 TYR C C 18 174.000 175.013 -1.013 1
1 215 . 19 1 1 A 18 18 TYR CA C 18 56.800 56.594 0.206 1
1 216 . 19 1 1 A 18 18 TYR CB C 18 41.100 43.563 -2.463 1
1 221 . 19 1 1 A 18 18 TYR N N 18 117.100 121.667 -4.567 1
1 222 . 19 1 1 A 19 19 ASN H H 19 8.890 9.163 -0.273 1
1 223 . 19 1 1 A 19 19 ASN HA H 19 4.960 4.925 0.035 1
1 228 . 19 1 1 A 19 19 ASN C C 19 176.100 174.730 1.370 1
1 229 . 19 1 1 A 19 19 ASN CA C 19 53.600 54.856 -1.256 1
1 230 . 19 1 1 A 19 19 ASN CB C 19 40.300 41.544 -1.244 1
1 231 . 19 1 1 A 19 19 ASN N N 19 116.600 119.553 -2.953 1
1 233 . 19 1 1 A 20 20 VAL H H 20 7.730 7.848 -0.118 1
1 234 . 19 1 1 A 20 20 VAL HA H 20 5.250 4.832 0.418 1
1 242 . 19 1 1 A 20 20 VAL C C 20 173.800 174.003 -0.203 1
1 243 . 19 1 1 A 20 20 VAL CA C 20 59.400 59.877 -0.477 1
1 244 . 19 1 1 A 20 20 VAL CB C 20 37.600 35.019 2.581 1
1 247 . 19 1 1 A 20 20 VAL N N 20 113.900 114.956 -1.056 1
1 248 . 19 1 1 A 21 21 VAL H H 21 8.890 8.759 0.131 1
1 249 . 19 1 1 A 21 21 VAL HA H 21 4.840 4.702 0.138 1
1 257 . 19 1 1 A 21 21 VAL CA C 21 56.800 56.893 -0.093 1
1 258 . 19 1 1 A 21 21 VAL CB C 21 36.000 35.257 0.743 1
1 261 . 19 1 1 A 21 21 VAL N N 21 118.500 124.105 -5.605 1
1 262 . 19 1 1 A 22 22 PRO HA H 22 4.940 4.789 0.151 1
1 269 . 19 1 1 A 22 22 PRO C C 22 175.600 175.330 0.270 1
1 270 . 19 1 1 A 22 22 PRO CA C 22 62.700 62.624 0.076 1
1 271 . 19 1 1 A 22 22 PRO CB C 22 31.800 32.059 -0.259 1
1 274 . 19 1 1 A 23 23 VAL H H 23 8.060 8.734 -0.674 1
1 275 . 19 1 1 A 23 23 VAL HA H 23 5.390 4.901 0.489 1
1 283 . 19 1 1 A 23 23 VAL C C 23 175.400 173.626 1.774 1
1 284 . 19 1 1 A 23 23 VAL CA C 23 57.800 59.545 -1.745 1
1 285 . 19 1 1 A 23 23 VAL CB C 23 36.300 35.674 0.626 1
1 288 . 19 1 1 A 23 23 VAL N N 23 110.900 122.251 -11.351 1
1 289 . 19 1 1 A 24 24 LYS H H 24 8.960 9.168 -0.208 1
1 290 . 19 1 1 A 24 24 LYS HA H 24 5.600 5.413 0.187 1
1 299 . 19 1 1 A 24 24 LYS C C 24 175.600 174.370 1.230 1
1 300 . 19 1 1 A 24 24 LYS CA C 24 54.200 54.139 0.061 1
1 301 . 19 1 1 A 24 24 LYS CB C 24 37.000 36.106 0.894 1
1 305 . 19 1 1 A 24 24 LYS N N 24 117.900 125.524 -7.624 1
1 306 . 19 1 1 A 25 25 SER H H 25 8.950 8.052 0.898 1
1 307 . 19 1 1 A 25 25 SER HA H 25 5.190 5.171 0.019 1
1 310 . 19 1 1 A 25 25 SER C C 25 173.800 175.236 -1.436 1
1 311 . 19 1 1 A 25 25 SER CA C 25 57.700 56.470 1.230 1
1 312 . 19 1 1 A 25 25 SER CB C 25 65.100 64.982 0.118 1
1 313 . 19 1 1 A 25 25 SER N N 25 114.600 113.775 0.825 1
1 314 . 19 1 1 A 26 26 ASN H H 26 9.020 8.652 0.368 1
1 315 . 19 1 1 A 26 26 ASN HA H 26 4.370 4.501 -0.131 1
1 320 . 19 1 1 A 26 26 ASN C C 26 173.500 174.961 -1.461 1
1 321 . 19 1 1 A 26 26 ASN CA C 26 53.700 56.517 -2.817 1
1 322 . 19 1 1 A 26 26 ASN CB C 26 37.100 38.287 -1.187 1
1 323 . 19 1 1 A 26 26 ASN N N 26 118.300 122.278 -3.978 1
1 325 . 19 1 1 A 27 27 LYS H H 27 7.400 7.765 -0.365 1
1 326 . 19 1 1 A 27 27 LYS HA H 27 4.780 4.870 -0.090 1
1 335 . 19 1 1 A 27 27 LYS CA C 27 53.500 52.965 0.535 1
1 336 . 19 1 1 A 27 27 LYS CB C 27 34.100 35.729 -1.629 1
1 340 . 19 1 1 A 27 27 LYS N N 27 116.600 118.113 -1.513 1
1 341 . 19 1 1 A 28 28 PRO HA H 28 4.040 4.604 -0.564 1
1 348 . 19 1 1 A 28 28 PRO C C 28 174.500 175.490 -0.990 1
1 349 . 19 1 1 A 28 28 PRO CA C 28 63.200 63.246 -0.046 1
1 350 . 19 1 1 A 28 28 PRO CB C 28 32.500 31.948 0.552 1
1 353 . 19 1 1 A 29 29 VAL H H 29 8.860 8.745 0.115 1
1 354 . 19 1 1 A 29 29 VAL HA H 29 4.420 4.683 -0.263 1
1 362 . 19 1 1 A 29 29 VAL C C 29 174.800 174.754 0.046 1
1 363 . 19 1 1 A 29 29 VAL CA C 29 60.300 59.690 0.610 1
1 364 . 19 1 1 A 29 29 VAL CB C 29 36.400 35.447 0.953 1
1 367 . 19 1 1 A 29 29 VAL N N 29 119.800 122.630 -2.830 1
1 368 . 19 1 1 A 30 30 GLU H H 30 9.550 8.665 0.885 1
1 369 . 19 1 1 A 30 30 GLU HA H 30 4.260 4.290 -0.030 1
1 374 . 19 1 1 A 30 30 GLU C C 30 177.800 178.243 -0.443 1
1 375 . 19 1 1 A 30 30 GLU CA C 30 58.000 57.053 0.947 1
1 376 . 19 1 1 A 30 30 GLU CB C 30 29.700 30.077 -0.377 1
1 378 . 19 1 1 A 30 30 GLU N N 30 128.900 124.511 4.389 1
1 379 . 19 1 1 A 31 31 ILE H H 31 7.910 8.477 -0.567 1
1 380 . 19 1 1 A 31 31 ILE HA H 31 2.120 4.097 -1.977 1
1 390 . 19 1 1 A 31 31 ILE C C 31 178.000 178.212 -0.212 1
1 391 . 19 1 1 A 31 31 ILE CA C 31 63.500 63.009 0.491 1
1 392 . 19 1 1 A 31 31 ILE CB C 31 37.200 37.840 -0.640 1
1 396 . 19 1 1 A 31 31 ILE N N 31 122.500 124.114 -1.614 1
1 397 . 19 1 1 A 32 32 SER H H 32 7.940 8.028 -0.088 1
1 398 . 19 1 1 A 32 32 SER HA H 32 4.070 4.239 -0.169 1
1 401 . 19 1 1 A 32 32 SER C C 32 175.800 175.717 0.083 1
1 402 . 19 1 1 A 32 32 SER CA C 32 60.200 61.209 -1.009 1
1 403 . 19 1 1 A 32 32 SER CB C 32 62.100 63.267 -1.167 1
1 404 . 19 1 1 A 32 32 SER N N 32 115.300 118.656 -3.356 1
1 405 . 19 1 1 A 33 33 LYS H H 33 7.640 7.423 0.217 1
1 406 . 19 1 1 A 33 33 LYS HA H 33 4.400 4.736 -0.336 1
1 415 . 19 1 1 A 33 33 LYS C C 33 176.600 177.165 -0.565 1
1 416 . 19 1 1 A 33 33 LYS CA C 33 56.200 55.937 0.263 1
1 417 . 19 1 1 A 33 33 LYS CB C 33 32.700 32.793 -0.093 1
1 421 . 19 1 1 A 33 33 LYS N N 33 119.800 117.914 1.886 1
1 422 . 19 1 1 A 34 34 TRP H H 34 7.860 7.713 0.147 1
1 423 . 19 1 1 A 34 34 TRP HA H 34 3.870 4.153 -0.283 1
1 426 . 19 1 1 A 34 34 TRP C C 34 178.600 178.379 0.221 1
1 427 . 19 1 1 A 34 34 TRP CA C 34 60.200 60.920 -0.720 1
1 428 . 19 1 1 A 34 34 TRP CB C 34 28.500 29.789 -1.289 1
1 429 . 19 1 1 A 34 34 TRP N N 34 120.000 121.987 -1.987 1
1 430 . 19 1 1 A 35 35 ILE H H 35 8.200 8.438 -0.238 1
1 431 . 19 1 1 A 35 35 ILE HA H 35 3.990 3.863 0.127 1
1 441 . 19 1 1 A 35 35 ILE C C 35 177.900 178.079 -0.179 1
1 442 . 19 1 1 A 35 35 ILE CA C 35 64.300 65.476 -1.176 1
1 443 . 19 1 1 A 35 35 ILE CB C 35 37.200 37.979 -0.779 1
1 447 . 19 1 1 A 35 35 ILE N N 35 119.500 120.715 -1.215 1
1 448 . 19 1 1 A 36 36 ASP H H 36 7.680 7.914 -0.234 1
1 449 . 19 1 1 A 36 36 ASP HA H 36 4.490 4.301 0.189 1
1 452 . 19 1 1 A 36 36 ASP C C 36 179.200 178.617 0.583 1
1 453 . 19 1 1 A 36 36 ASP CA C 36 57.500 57.173 0.327 1
1 454 . 19 1 1 A 36 36 ASP CB C 36 40.400 40.850 -0.450 1
1 455 . 19 1 1 A 36 36 ASP N N 36 122.000 121.081 0.919 1
1 456 . 19 1 1 A 37 37 PHE H H 37 8.450 8.240 0.210 1
1 457 . 19 1 1 A 37 37 PHE HA H 37 4.080 4.100 -0.020 1
1 465 . 19 1 1 A 37 37 PHE C C 37 178.300 178.706 -0.406 1
1 466 . 19 1 1 A 37 37 PHE CA C 37 58.600 59.924 -1.324 1
1 467 . 19 1 1 A 37 37 PHE CB C 37 37.000 37.443 -0.443 1
1 473 . 19 1 1 A 37 37 PHE N N 37 119.800 118.914 0.886 1
1 474 . 19 1 1 A 38 38 SER H H 38 8.580 8.169 0.411 1
1 475 . 19 1 1 A 38 38 SER HA H 38 4.250 4.295 -0.045 1
1 478 . 19 1 1 A 38 38 SER C C 38 176.800 177.085 -0.285 1
1 479 . 19 1 1 A 38 38 SER CA C 38 62.700 61.260 1.440 1
1 480 . 19 1 1 A 38 38 SER CB C 38 62.700 62.390 0.310 1
1 481 . 19 1 1 A 38 38 SER N N 38 115.800 116.260 -0.460 1
1 482 . 19 1 1 A 39 39 ASN H H 39 8.190 7.614 0.576 1
1 483 . 19 1 1 A 39 39 ASN HA H 39 4.540 4.730 -0.190 1
1 488 . 19 1 1 A 39 39 ASN C C 39 178.500 177.792 0.708 1
1 489 . 19 1 1 A 39 39 ASN CA C 39 56.200 56.085 0.115 1
1 490 . 19 1 1 A 39 39 ASN CB C 39 37.900 38.323 -0.423 1
1 491 . 19 1 1 A 39 39 ASN N N 39 121.300 120.717 0.583 1
1 493 . 19 1 1 A 40 40 VAL H H 40 7.840 7.576 0.264 1
1 494 . 19 1 1 A 40 40 VAL HA H 40 3.650 3.563 0.087 1
1 502 . 19 1 1 A 40 40 VAL C C 40 179.000 178.123 0.877 1
1 503 . 19 1 1 A 40 40 VAL CA C 40 66.600 66.346 0.254 1
1 504 . 19 1 1 A 40 40 VAL CB C 40 32.100 31.210 0.890 1
1 507 . 19 1 1 A 40 40 VAL N N 40 121.800 121.474 0.326 1
1 508 . 19 1 1 A 41 41 LEU H H 41 8.210 7.868 0.342 1
1 509 . 19 1 1 A 41 41 LEU HA H 41 3.840 3.903 -0.063 1
1 519 . 19 1 1 A 41 41 LEU C C 41 178.800 177.952 0.848 1
1 520 . 19 1 1 A 41 41 LEU CA C 41 57.400 57.971 -0.571 1
1 521 . 19 1 1 A 41 41 LEU CB C 41 41.200 41.402 -0.202 1
1 525 . 19 1 1 A 41 41 LEU N N 41 117.700 119.216 -1.516 1
1 526 . 19 1 1 A 42 42 SER H H 42 7.980 7.809 0.171 1
1 527 . 19 1 1 A 42 42 SER HA H 42 4.260 4.343 -0.083 1
1 530 . 19 1 1 A 42 42 SER C C 42 174.900 175.260 -0.360 1
1 531 . 19 1 1 A 42 42 SER CA C 42 61.200 60.287 0.913 1
1 532 . 19 1 1 A 42 42 SER CB C 42 63.100 63.118 -0.018 1
1 533 . 19 1 1 A 42 42 SER N N 42 113.200 113.015 0.185 1
1 534 . 19 1 1 A 43 43 ARG H H 43 7.100 7.991 -0.891 1
1 535 . 19 1 1 A 43 43 ARG HA H 43 4.500 4.580 -0.080 1
1 542 . 19 1 1 A 43 43 ARG C C 43 175.800 178.876 -3.076 1
1 543 . 19 1 1 A 43 43 ARG CA C 43 55.600 57.081 -1.481 1
1 544 . 19 1 1 A 43 43 ARG CB C 43 30.800 31.237 -0.437 1
1 547 . 19 1 1 A 43 43 ARG N N 43 118.400 120.615 -2.215 1
1 548 . 19 1 1 A 44 44 LEU H H 44 7.610 7.481 0.129 1
1 549 . 19 1 1 A 44 44 LEU HA H 44 4.590 4.054 0.536 1
1 559 . 19 1 1 A 44 44 LEU C C 44 175.300 176.568 -1.268 1
1 560 . 19 1 1 A 44 44 LEU CA C 44 53.900 57.862 -3.962 1
1 561 . 19 1 1 A 44 44 LEU CB C 44 44.100 41.689 2.411 1
1 565 . 19 1 1 A 44 44 LEU N N 44 120.400 119.146 1.254 1
1 566 . 19 1 1 A 45 45 TYR H H 45 7.630 8.056 -0.426 1
1 567 . 19 1 1 A 45 45 TYR HA H 45 5.180 4.508 0.672 1
1 574 . 19 1 1 A 45 45 TYR C C 45 174.600 174.220 0.380 1
1 575 . 19 1 1 A 45 45 TYR CA C 45 56.300 58.449 -2.149 1
1 576 . 19 1 1 A 45 45 TYR CB C 45 41.400 36.297 5.103 1
1 581 . 19 1 1 A 45 45 TYR N N 45 115.300 116.131 -0.831 1
1 582 . 19 1 1 A 46 46 VAL H H 46 8.770 7.499 1.271 1
1 583 . 19 1 1 A 46 46 VAL HA H 46 4.540 5.001 -0.461 1
1 591 . 19 1 1 A 46 46 VAL C C 46 174.600 173.989 0.611 1
1 592 . 19 1 1 A 46 46 VAL CA C 46 59.600 59.750 -0.150 1
1 593 . 19 1 1 A 46 46 VAL CB C 46 34.700 35.328 -0.628 1
1 596 . 19 1 1 A 46 46 VAL N N 46 115.400 118.697 -3.297 1
1 597 . 19 1 1 A 47 47 GLY H H 47 8.280 8.782 -0.502 1
1 598 . 19 1 1 A 47 47 GLY HA2 H 47 3.610 4.197 -0.587 1
1 599 . 19 1 1 A 47 47 GLY HA3 H 47 4.970 4.209 0.761 1
1 600 . 19 1 1 A 47 47 GLY C C 47 173.100 172.171 0.929 1
1 601 . 19 1 1 A 47 47 GLY CA C 47 43.600 45.218 -1.618 1
1 602 . 19 1 1 A 47 47 GLY N N 47 109.900 114.088 -4.188 1
1 603 . 19 1 1 A 48 48 VAL H H 48 7.630 8.851 -1.221 1
1 604 . 19 1 1 A 48 48 VAL HA H 48 4.320 4.602 -0.282 1
1 612 . 19 1 1 A 48 48 VAL CA C 48 58.700 58.992 -0.292 1
1 613 . 19 1 1 A 48 48 VAL CB C 48 32.100 35.170 -3.070 1
1 616 . 19 1 1 A 48 48 VAL N N 48 109.900 126.135 -16.235 1
1 617 . 19 1 1 A 49 49 PRO HA H 49 4.800 4.555 0.245 1
1 624 . 19 1 1 A 49 49 PRO C C 49 176.700 176.312 0.388 1
1 625 . 19 1 1 A 49 49 PRO CA C 49 62.300 63.021 -0.721 1
1 626 . 19 1 1 A 49 49 PRO CB C 49 35.400 31.872 3.528 1
1 629 . 19 1 1 A 50 50 THR H H 50 8.790 8.473 0.317 1
1 630 . 19 1 1 A 50 50 THR HA H 50 4.690 5.146 -0.456 1
1 635 . 19 1 1 A 50 50 THR C C 50 173.500 173.427 0.073 1
1 636 . 19 1 1 A 50 50 THR CA C 50 60.800 59.587 1.213 1
1 637 . 19 1 1 A 50 50 THR CB C 50 70.800 72.493 -1.693 1
1 639 . 19 1 1 A 50 50 THR N N 50 113.500 112.403 1.097 1
1 640 . 19 1 1 A 51 51 LYS H H 51 7.810 8.459 -0.649 1
1 641 . 19 1 1 A 51 51 LYS HA H 51 4.890 4.727 0.163 1
1 650 . 19 1 1 A 51 51 LYS C C 51 175.900 175.789 0.111 1
1 651 . 19 1 1 A 51 51 LYS CA C 51 54.100 54.537 -0.437 1
1 652 . 19 1 1 A 51 51 LYS CB C 51 35.300 34.241 1.059 1
1 656 . 19 1 1 A 51 51 LYS N N 51 122.200 120.458 1.742 1
1 657 . 19 1 1 A 52 52 SER H H 52 8.410 8.494 -0.084 1
1 658 . 19 1 1 A 52 52 SER HA H 52 3.630 4.277 -0.647 1
1 661 . 19 1 1 A 52 52 SER C C 52 175.800 175.034 0.766 1
1 662 . 19 1 1 A 52 52 SER CA C 52 58.800 59.800 -1.000 1
1 663 . 19 1 1 A 52 52 SER CB C 52 62.600 62.725 -0.125 1
1 664 . 19 1 1 A 52 52 SER N N 52 118.900 114.874 4.026 1
1 665 . 19 1 1 A 53 53 GLY H H 53 9.070 9.211 -0.141 1
1 666 . 19 1 1 A 53 53 GLY HA2 H 53 3.390 3.910 -0.520 1
1 667 . 19 1 1 A 53 53 GLY HA3 H 53 4.460 3.911 0.549 1
1 668 . 19 1 1 A 53 53 GLY C C 53 174.100 174.388 -0.288 1
1 669 . 19 1 1 A 53 53 GLY CA C 53 44.800 45.623 -0.823 1
1 670 . 19 1 1 A 53 53 GLY N N 53 115.600 113.367 2.233 1
1 671 . 19 1 1 A 54 54 ASN H H 54 7.870 7.801 0.069 1
1 672 . 19 1 1 A 54 54 ASN HA H 54 4.570 4.821 -0.251 1
1 677 . 19 1 1 A 54 54 ASN C C 54 175.500 174.756 0.744 1
1 678 . 19 1 1 A 54 54 ASN CA C 54 53.000 52.572 0.428 1
1 679 . 19 1 1 A 54 54 ASN CB C 54 38.600 39.269 -0.669 1
1 680 . 19 1 1 A 54 54 ASN N N 54 119.600 119.230 0.370 1
1 682 . 19 1 1 A 55 55 VAL H H 55 8.770 8.856 -0.086 1
1 683 . 19 1 1 A 55 55 VAL HA H 55 3.880 4.257 -0.377 1
1 691 . 19 1 1 A 55 55 VAL C C 55 176.200 175.261 0.939 1
1 692 . 19 1 1 A 55 55 VAL CA C 55 63.700 62.817 0.883 1
1 693 . 19 1 1 A 55 55 VAL CB C 55 31.600 31.211 0.389 1
1 696 . 19 1 1 A 55 55 VAL N N 55 123.900 123.663 0.237 1
1 697 . 19 1 1 A 56 56 VAL H H 56 9.050 9.103 -0.053 1
1 698 . 19 1 1 A 56 56 VAL HA H 56 3.990 3.945 0.045 1
1 706 . 19 1 1 A 56 56 VAL C C 56 175.200 175.664 -0.464 1
1 707 . 19 1 1 A 56 56 VAL CA C 56 62.700 64.854 -2.154 1
1 708 . 19 1 1 A 56 56 VAL CB C 56 32.900 32.323 0.577 1
1 711 . 19 1 1 A 56 56 VAL N N 56 127.500 128.645 -1.145 1
1 712 . 19 1 1 A 57 57 CYS H H 57 7.250 7.990 -0.740 1
1 713 . 19 1 1 A 57 57 CYS HA H 57 4.370 4.751 -0.381 1
1 716 . 19 1 1 A 57 57 CYS C C 57 171.900 173.518 -1.618 1
1 717 . 19 1 1 A 57 57 CYS CA C 57 58.600 57.147 1.453 1
1 718 . 19 1 1 A 57 57 CYS CB C 57 28.600 28.734 -0.134 1
1 719 . 19 1 1 A 57 57 CYS N N 57 117.600 118.200 -0.600 1
1 720 . 19 1 1 A 58 58 LYS H H 58 8.880 8.700 0.180 1
1 721 . 19 1 1 A 58 58 LYS HA H 58 4.220 4.545 -0.325 1
1 730 . 19 1 1 A 58 58 LYS C C 58 176.000 177.100 -1.100 1
1 731 . 19 1 1 A 58 58 LYS CA C 58 54.400 55.436 -1.036 1
1 732 . 19 1 1 A 58 58 LYS CB C 58 33.600 31.468 2.132 1
1 736 . 19 1 1 A 58 58 LYS N N 58 132.000 125.467 6.533 1
1 737 . 19 1 1 A 59 59 ASN H H 59 9.500 9.054 0.446 1
1 738 . 19 1 1 A 59 59 ASN HA H 59 4.040 4.610 -0.570 1
1 743 . 19 1 1 A 59 59 ASN C C 59 176.400 175.381 1.019 1
1 744 . 19 1 1 A 59 59 ASN CA C 59 53.200 53.866 -0.666 1
1 745 . 19 1 1 A 59 59 ASN CB C 59 35.900 37.030 -1.130 1
1 746 . 19 1 1 A 59 59 ASN N N 59 127.500 121.367 6.133 1
1 748 . 19 1 1 A 60 60 ILE H H 60 8.050 7.345 0.705 1
1 749 . 19 1 1 A 60 60 ILE HA H 60 3.680 3.833 -0.153 1
1 759 . 19 1 1 A 60 60 ILE C C 60 175.700 176.579 -0.879 1
1 760 . 19 1 1 A 60 60 ILE CA C 60 61.900 62.194 -0.294 1
1 761 . 19 1 1 A 60 60 ILE CB C 60 38.300 37.736 0.564 1
1 765 . 19 1 1 A 60 60 ILE N N 60 120.200 120.911 -0.711 1
1 766 . 19 1 1 A 61 61 MET H H 61 9.590 9.398 0.192 1
1 767 . 19 1 1 A 61 61 MET HA H 61 3.920 4.081 -0.161 1
1 775 . 19 1 1 A 61 61 MET C C 61 174.300 175.380 -1.080 1
1 776 . 19 1 1 A 61 61 MET CA C 61 57.000 56.788 0.212 1
1 777 . 19 1 1 A 61 61 MET CB C 61 31.300 31.052 0.248 1
1 780 . 19 1 1 A 61 61 MET N N 61 124.400 126.581 -2.181 1
1 781 . 19 1 1 A 62 62 ASN H H 62 8.250 8.329 -0.079 1
1 782 . 19 1 1 A 62 62 ASN HA H 62 4.400 4.469 -0.069 1
1 787 . 19 1 1 A 62 62 ASN C C 62 176.800 174.993 1.807 1
1 788 . 19 1 1 A 62 62 ASN CA C 62 54.400 53.982 0.418 1
1 789 . 19 1 1 A 62 62 ASN CB C 62 37.600 36.822 0.778 1
1 790 . 19 1 1 A 62 62 ASN N N 62 111.900 109.612 2.288 1
1 792 . 19 1 1 A 63 63 THR H H 63 7.480 8.434 -0.954 1
1 793 . 19 1 1 A 63 63 THR HA H 63 4.210 4.668 -0.458 1
1 798 . 19 1 1 A 63 63 THR C C 63 177.100 175.742 1.358 1
1 799 . 19 1 1 A 63 63 THR CA C 63 62.900 61.752 1.148 1
1 800 . 19 1 1 A 63 63 THR CB C 63 72.500 71.285 1.215 1
1 802 . 19 1 1 A 63 63 THR N N 63 105.900 111.138 -5.238 1
1 803 . 19 1 1 A 64 64 GLY H H 64 9.110 8.898 0.212 1
1 804 . 19 1 1 A 64 64 GLY HA2 H 64 3.580 3.972 -0.392 1
1 805 . 19 1 1 A 64 64 GLY HA3 H 64 4.090 3.978 0.112 1
1 806 . 19 1 1 A 64 64 GLY C C 64 173.200 174.027 -0.827 1
1 807 . 19 1 1 A 64 64 GLY CA C 64 45.300 45.715 -0.415 1
1 808 . 19 1 1 A 64 64 GLY N N 64 111.500 112.026 -0.526 1
1 809 . 19 1 1 A 65 65 VAL H H 65 7.580 7.521 0.059 1
1 810 . 19 1 1 A 65 65 VAL HA H 65 4.060 4.398 -0.338 1
1 818 . 19 1 1 A 65 65 VAL C C 65 172.900 174.312 -1.412 1
1 819 . 19 1 1 A 65 65 VAL CA C 65 61.400 61.188 0.212 1
1 820 . 19 1 1 A 65 65 VAL CB C 65 32.900 34.319 -1.419 1
1 823 . 19 1 1 A 65 65 VAL N N 65 121.600 121.835 -0.235 1
1 824 . 19 1 1 A 66 66 ASP H H 66 8.210 8.936 -0.726 1
1 825 . 19 1 1 A 66 66 ASP HA H 66 5.320 5.333 -0.013 1
1 828 . 19 1 1 A 66 66 ASP C C 66 174.800 174.907 -0.107 1
1 829 . 19 1 1 A 66 66 ASP CA C 66 51.700 52.671 -0.971 1
1 830 . 19 1 1 A 66 66 ASP CB C 66 43.200 41.995 1.205 1
1 831 . 19 1 1 A 66 66 ASP N N 66 123.100 126.433 -3.333 1
1 832 . 19 1 1 A 67 67 ILE H H 67 8.540 8.721 -0.181 1
1 833 . 19 1 1 A 67 67 ILE HA H 67 4.630 4.383 0.247 1
1 843 . 19 1 1 A 67 67 ILE C C 67 175.600 175.777 -0.177 1
1 844 . 19 1 1 A 67 67 ILE CA C 67 56.900 60.633 -3.733 1
1 845 . 19 1 1 A 67 67 ILE CB C 67 35.300 36.848 -1.548 1
1 849 . 19 1 1 A 67 67 ILE N N 67 119.200 124.992 -5.792 1
1 850 . 19 1 1 A 68 68 ILE H H 68 9.420 9.027 0.393 1
1 851 . 19 1 1 A 68 68 ILE HA H 68 4.980 5.639 -0.659 1
1 861 . 19 1 1 A 68 68 ILE C C 68 175.000 174.274 0.726 1
1 862 . 19 1 1 A 68 68 ILE CA C 68 58.600 58.954 -0.354 1
1 863 . 19 1 1 A 68 68 ILE CB C 68 40.900 40.941 -0.041 1
1 867 . 19 1 1 A 68 68 ILE N N 68 125.000 123.461 1.539 1
1 868 . 19 1 1 A 69 69 CYS H H 69 8.870 8.934 -0.064 1
1 869 . 19 1 1 A 69 69 CYS HA H 69 4.610 4.900 -0.290 1
1 872 . 19 1 1 A 69 69 CYS C C 69 176.200 174.921 1.279 1
1 873 . 19 1 1 A 69 69 CYS CA C 69 58.900 57.859 1.041 1
1 874 . 19 1 1 A 69 69 CYS CB C 69 27.100 29.552 -2.452 1
1 875 . 19 1 1 A 69 69 CYS N N 69 122.300 124.100 -1.800 1
1 876 . 19 1 1 A 70 70 THR H H 70 8.270 8.801 -0.531 1
1 877 . 19 1 1 A 70 70 THR HA H 70 4.710 4.519 0.191 1
1 882 . 19 1 1 A 70 70 THR C C 70 173.600 173.883 -0.283 1
1 883 . 19 1 1 A 70 70 THR CA C 70 61.500 62.040 -0.540 1
1 884 . 19 1 1 A 70 70 THR CB C 70 68.100 70.369 -2.269 1
1 886 . 19 1 1 A 70 70 THR N N 70 116.700 118.813 -2.113 1
1 887 . 19 1 1 A 71 71 LYS H H 71 7.370 7.089 0.281 1
1 888 . 19 1 1 A 71 71 LYS HA H 71 4.520 4.696 -0.176 1
1 897 . 19 1 1 A 71 71 LYS CA C 71 55.100 55.252 -0.152 1
1 898 . 19 1 1 A 71 71 LYS CB C 71 37.800 34.105 3.695 1
1 902 . 19 1 1 A 71 71 LYS N N 71 120.900 122.658 -1.758 1
1 903 . 19 1 1 A 72 72 ASN H H 72 8.580 8.758 -0.178 1
1 904 . 19 1 1 A 72 72 ASN HA H 72 4.620 5.324 -0.704 1
1 909 . 19 1 1 A 72 72 ASN C C 72 173.500 174.315 -0.815 1
1 910 . 19 1 1 A 72 72 ASN CA C 72 52.200 52.377 -0.177 1
1 911 . 19 1 1 A 72 72 ASN CB C 72 38.500 40.229 -1.729 1
1 912 . 19 1 1 A 72 72 ASN N N 72 122.700 122.950 -0.250 1
1 914 . 19 1 1 A 73 73 LEU H H 73 8.100 9.459 -1.359 1
1 915 . 19 1 1 A 73 73 LEU HA H 73 4.680 5.137 -0.457 1
1 925 . 19 1 1 A 73 73 LEU CA C 73 51.000 51.590 -0.590 1
1 926 . 19 1 1 A 73 73 LEU CB C 73 42.500 42.735 -0.235 1
1 930 . 19 1 1 A 73 73 LEU N N 73 125.100 125.036 0.064 1
1 931 . 19 1 1 A 74 74 PRO HA H 74 4.670 4.985 -0.315 1
1 938 . 19 1 1 A 74 74 PRO C C 74 176.500 175.893 0.607 1
1 939 . 19 1 1 A 74 74 PRO CA C 74 61.800 62.266 -0.466 1
1 940 . 19 1 1 A 74 74 PRO CB C 74 32.800 32.450 0.350 1
1 943 . 19 1 1 A 75 75 LYS H H 75 8.280 8.848 -0.568 1
1 944 . 19 1 1 A 75 75 LYS HA H 75 4.110 4.857 -0.747 1
1 953 . 19 1 1 A 75 75 LYS CA C 75 56.500 55.317 1.183 1
1 954 . 19 1 1 A 75 75 LYS CB C 75 33.300 35.690 -2.390 1
1 958 . 19 1 1 A 75 75 LYS N N 75 117.000 121.404 -4.404 1
1 959 . 19 1 1 A 76 76 ASP H H 76 8.570 9.209 -0.639 1
1 960 . 19 1 1 A 76 76 ASP HA H 76 4.530 5.428 -0.898 1
1 963 . 19 1 1 A 76 76 ASP C C 76 176.300 174.758 1.542 1
1 964 . 19 1 1 A 76 76 ASP CA C 76 55.000 52.727 2.273 1
1 965 . 19 1 1 A 76 76 ASP CB C 76 41.100 43.766 -2.666 1
1 966 . 19 1 1 A 76 76 ASP N N 76 122.700 126.999 -4.299 1
1 967 . 19 1 1 A 77 77 SER H H 77 8.330 8.853 -0.523 1
1 968 . 19 1 1 A 77 77 SER HA H 77 4.410 5.264 -0.854 1
1 971 . 19 1 1 A 77 77 SER C C 77 174.300 172.647 1.653 1
1 972 . 19 1 1 A 77 77 SER CA C 77 58.000 57.069 0.931 1
1 973 . 19 1 1 A 77 77 SER CB C 77 63.900 65.388 -1.488 1
1 974 . 19 1 1 A 77 77 SER N N 77 116.100 117.858 -1.758 1
1 975 . 19 1 1 A 78 78 LEU H H 78 8.350 8.820 -0.470 1
1 976 . 19 1 1 A 78 78 LEU HA H 78 4.280 4.639 -0.359 1
1 986 . 19 1 1 A 78 78 LEU C C 78 177.200 175.396 1.804 1
1 987 . 19 1 1 A 78 78 LEU CA C 78 55.200 54.602 0.598 1
1 988 . 19 1 1 A 78 78 LEU CB C 78 42.100 41.110 0.990 1
1 992 . 19 1 1 A 78 78 LEU N N 78 124.300 126.773 -2.473 1
1 993 . 19 1 1 A 79 79 GLU H H 79 8.300 8.829 -0.529 1
1 994 . 19 1 1 A 79 79 GLU CA C 79 56.400 55.055 1.345 1
1 995 . 19 1 1 A 79 79 GLU CB C 79 30.200 28.694 1.506 1
1 1 . 20 1 1 A 2 2 HIS HA H 2 4.640 4.632 0.008 1
1 4 . 20 1 1 A 2 2 HIS C C 2 173.600 175.088 -1.488 1
1 5 . 20 1 1 A 2 2 HIS CA C 2 56.500 57.515 -1.015 1
1 6 . 20 1 1 A 2 2 HIS CB C 2 31.000 30.647 0.353 1
1 7 . 20 1 1 A 3 3 LYS H H 3 8.160 7.807 0.353 1
1 8 . 20 1 1 A 3 3 LYS HA H 3 4.660 4.862 -0.202 1
1 17 . 20 1 1 A 3 3 LYS C C 3 174.400 174.649 -0.249 1
1 18 . 20 1 1 A 3 3 LYS CA C 3 54.800 55.220 -0.420 1
1 19 . 20 1 1 A 3 3 LYS CB C 3 35.800 34.567 1.233 1
1 23 . 20 1 1 A 3 3 LYS N N 3 121.900 118.507 3.393 1
1 24 . 20 1 1 A 4 4 ASP H H 4 8.470 9.597 -1.127 1
1 25 . 20 1 1 A 4 4 ASP HA H 4 4.900 5.436 -0.536 1
1 28 . 20 1 1 A 4 4 ASP C C 4 176.900 175.479 1.421 1
1 29 . 20 1 1 A 4 4 ASP CA C 4 52.700 52.778 -0.078 1
1 30 . 20 1 1 A 4 4 ASP CB C 4 44.100 44.626 -0.526 1
1 31 . 20 1 1 A 4 4 ASP N N 4 117.900 125.497 -7.597 1
1 32 . 20 1 1 A 5 5 ILE H H 5 9.570 8.698 0.872 1
1 33 . 20 1 1 A 5 5 ILE HA H 5 3.640 4.162 -0.522 1
1 43 . 20 1 1 A 5 5 ILE C C 5 174.800 175.935 -1.135 1
1 44 . 20 1 1 A 5 5 ILE CA C 5 60.900 62.098 -1.198 1
1 45 . 20 1 1 A 5 5 ILE CB C 5 37.000 37.423 -0.423 1
1 49 . 20 1 1 A 5 5 ILE N N 5 124.400 124.518 -0.118 1
1 50 . 20 1 1 A 6 6 PHE H H 6 7.790 9.063 -1.273 1
1 51 . 20 1 1 A 6 6 PHE HA H 6 3.160 3.614 -0.454 1
1 58 . 20 1 1 A 6 6 PHE C C 6 173.500 174.070 -0.570 1
1 59 . 20 1 1 A 6 6 PHE CA C 6 56.900 55.941 0.959 1
1 60 . 20 1 1 A 6 6 PHE CB C 6 40.100 38.423 1.677 1
1 65 . 20 1 1 A 6 6 PHE N N 6 130.200 128.484 1.716 1
1 66 . 20 1 1 A 7 7 THR H H 7 6.790 8.063 -1.273 1
1 67 . 20 1 1 A 7 7 THR HA H 7 4.530 5.388 -0.858 1
1 72 . 20 1 1 A 7 7 THR C C 7 172.300 173.513 -1.213 1
1 73 . 20 1 1 A 7 7 THR CA C 7 59.200 60.355 -1.155 1
1 74 . 20 1 1 A 7 7 THR CB C 7 71.000 70.372 0.628 1
1 76 . 20 1 1 A 7 7 THR N N 7 117.900 116.949 0.951 1
1 77 . 20 1 1 A 8 8 SER H H 8 7.600 8.607 -1.007 1
1 78 . 20 1 1 A 8 8 SER HA H 8 4.180 4.830 -0.650 1
1 81 . 20 1 1 A 8 8 SER C C 8 175.300 172.065 3.235 1
1 82 . 20 1 1 A 8 8 SER CA C 8 55.800 57.087 -1.287 1
1 83 . 20 1 1 A 8 8 SER CB C 8 64.000 67.153 -3.153 1
1 84 . 20 1 1 A 8 8 SER N N 8 113.400 118.732 -5.332 1
1 85 . 20 1 1 A 9 9 VAL H H 9 8.880 8.733 0.147 1
1 86 . 20 1 1 A 9 9 VAL HA H 9 5.220 5.085 0.135 1
1 94 . 20 1 1 A 9 9 VAL C C 9 174.000 173.014 0.986 1
1 95 . 20 1 1 A 9 9 VAL CA C 9 59.100 59.476 -0.376 1
1 96 . 20 1 1 A 9 9 VAL CB C 9 36.500 35.201 1.299 1
1 99 . 20 1 1 A 9 9 VAL N N 9 114.700 121.380 -6.680 1
1 100 . 20 1 1 A 10 10 VAL H H 10 8.510 9.203 -0.693 1
1 101 . 20 1 1 A 10 10 VAL HA H 10 4.470 4.853 -0.383 1
1 109 . 20 1 1 A 10 10 VAL C C 10 173.700 174.407 -0.707 1
1 110 . 20 1 1 A 10 10 VAL CA C 10 59.400 59.555 -0.155 1
1 111 . 20 1 1 A 10 10 VAL CB C 10 36.000 35.648 0.352 1
1 114 . 20 1 1 A 10 10 VAL N N 10 117.100 126.350 -9.250 1
1 115 . 20 1 1 A 11 11 ARG H H 11 8.500 8.111 0.389 1
1 116 . 20 1 1 A 11 11 ARG HA H 11 4.460 4.646 -0.186 1
1 123 . 20 1 1 A 11 11 ARG C C 11 174.500 175.881 -1.381 1
1 124 . 20 1 1 A 11 11 ARG CA C 11 57.400 55.834 1.566 1
1 125 . 20 1 1 A 11 11 ARG CB C 11 31.000 30.337 0.663 1
1 128 . 20 1 1 A 11 11 ARG N N 11 124.800 125.768 -0.968 1
1 129 . 20 1 1 A 12 12 VAL H H 12 7.650 9.279 -1.629 1
1 130 . 20 1 1 A 12 12 VAL HA H 12 4.970 4.944 0.026 1
1 138 . 20 1 1 A 12 12 VAL C C 12 176.700 174.450 2.250 1
1 139 . 20 1 1 A 12 12 VAL CA C 12 59.400 60.671 -1.271 1
1 140 . 20 1 1 A 12 12 VAL CB C 12 34.400 34.346 0.054 1
1 143 . 20 1 1 A 12 12 VAL N N 12 120.900 123.659 -2.759 1
1 144 . 20 1 1 A 13 13 ARG H H 13 9.020 9.304 -0.284 1
1 145 . 20 1 1 A 13 13 ARG HA H 13 4.700 5.322 -0.622 1
1 152 . 20 1 1 A 13 13 ARG C C 13 176.000 174.999 1.001 1
1 153 . 20 1 1 A 13 13 ARG CA C 13 54.600 54.299 0.301 1
1 154 . 20 1 1 A 13 13 ARG CB C 13 32.900 33.893 -0.993 1
1 157 . 20 1 1 A 13 13 ARG N N 13 127.500 127.971 -0.471 1
1 158 . 20 1 1 A 14 14 GLY H H 14 8.640 8.485 0.155 1
1 159 . 20 1 1 A 14 14 GLY HA2 H 14 3.680 4.197 -0.517 1
1 160 . 20 1 1 A 14 14 GLY HA3 H 14 4.190 4.204 -0.014 1
1 161 . 20 1 1 A 14 14 GLY C C 14 173.700 173.711 -0.011 1
1 162 . 20 1 1 A 14 14 GLY CA C 14 45.600 43.895 1.705 1
1 163 . 20 1 1 A 14 14 GLY N N 14 108.800 112.295 -3.495 1
1 164 . 20 1 1 A 15 15 SER H H 15 8.220 8.402 -0.182 1
1 165 . 20 1 1 A 15 15 SER HA H 15 5.020 4.686 0.334 1
1 168 . 20 1 1 A 15 15 SER C C 15 175.400 174.077 1.323 1
1 169 . 20 1 1 A 15 15 SER CA C 15 55.300 57.775 -2.475 1
1 170 . 20 1 1 A 15 15 SER CB C 15 64.900 62.567 2.333 1
1 171 . 20 1 1 A 15 15 SER N N 15 113.200 114.872 -1.672 1
1 172 . 20 1 1 A 16 16 LYS H H 16 9.930 8.114 1.816 1
1 173 . 20 1 1 A 16 16 LYS HA H 16 4.190 4.817 -0.627 1
1 182 . 20 1 1 A 16 16 LYS C C 16 176.500 175.133 1.367 1
1 183 . 20 1 1 A 16 16 LYS CA C 16 57.300 55.072 2.228 1
1 184 . 20 1 1 A 16 16 LYS CB C 16 32.300 34.340 -2.040 1
1 188 . 20 1 1 A 16 16 LYS N N 16 129.200 122.673 6.527 1
1 189 . 20 1 1 A 17 17 LYS H H 17 7.960 8.499 -0.539 1
1 190 . 20 1 1 A 17 17 LYS HA H 17 4.030 4.371 -0.341 1
1 199 . 20 1 1 A 17 17 LYS C C 17 175.600 174.392 1.208 1
1 200 . 20 1 1 A 17 17 LYS CA C 17 56.900 56.217 0.683 1
1 201 . 20 1 1 A 17 17 LYS CB C 17 34.700 32.655 2.045 1
1 205 . 20 1 1 A 17 17 LYS N N 17 118.500 117.942 0.558 1
1 206 . 20 1 1 A 18 18 TYR H H 18 7.780 7.713 0.067 1
1 207 . 20 1 1 A 18 18 TYR HA H 18 4.760 5.036 -0.276 1
1 214 . 20 1 1 A 18 18 TYR C C 18 174.000 175.605 -1.605 1
1 215 . 20 1 1 A 18 18 TYR CA C 18 56.800 56.420 0.380 1
1 216 . 20 1 1 A 18 18 TYR CB C 18 41.100 39.643 1.457 1
1 221 . 20 1 1 A 18 18 TYR N N 18 117.100 119.625 -2.525 1
1 222 . 20 1 1 A 19 19 ASN H H 19 8.890 8.754 0.136 1
1 223 . 20 1 1 A 19 19 ASN HA H 19 4.960 5.093 -0.133 1
1 228 . 20 1 1 A 19 19 ASN C C 19 176.100 175.200 0.900 1
1 229 . 20 1 1 A 19 19 ASN CA C 19 53.600 54.211 -0.611 1
1 230 . 20 1 1 A 19 19 ASN CB C 19 40.300 39.605 0.695 1
1 231 . 20 1 1 A 19 19 ASN N N 19 116.600 122.436 -5.836 1
1 233 . 20 1 1 A 20 20 VAL H H 20 7.730 7.529 0.201 1
1 234 . 20 1 1 A 20 20 VAL HA H 20 5.250 5.065 0.185 1
1 242 . 20 1 1 A 20 20 VAL C C 20 173.800 174.136 -0.336 1
1 243 . 20 1 1 A 20 20 VAL CA C 20 59.400 59.256 0.144 1
1 244 . 20 1 1 A 20 20 VAL CB C 20 37.600 35.673 1.927 1
1 247 . 20 1 1 A 20 20 VAL N N 20 113.900 113.761 0.139 1
1 248 . 20 1 1 A 21 21 VAL H H 21 8.890 8.640 0.250 1
1 249 . 20 1 1 A 21 21 VAL HA H 21 4.840 4.748 0.092 1
1 257 . 20 1 1 A 21 21 VAL CA C 21 56.800 57.199 -0.399 1
1 258 . 20 1 1 A 21 21 VAL CB C 21 36.000 35.612 0.388 1
1 261 . 20 1 1 A 21 21 VAL N N 21 118.500 122.270 -3.770 1
1 262 . 20 1 1 A 22 22 PRO HA H 22 4.940 5.200 -0.260 1
1 269 . 20 1 1 A 22 22 PRO C C 22 175.600 176.358 -0.758 1
1 270 . 20 1 1 A 22 22 PRO CA C 22 62.700 62.579 0.121 1
1 271 . 20 1 1 A 22 22 PRO CB C 22 31.800 31.763 0.037 1
1 274 . 20 1 1 A 23 23 VAL H H 23 8.060 8.705 -0.645 1
1 275 . 20 1 1 A 23 23 VAL HA H 23 5.390 4.962 0.428 1
1 283 . 20 1 1 A 23 23 VAL C C 23 175.400 174.730 0.670 1
1 284 . 20 1 1 A 23 23 VAL CA C 23 57.800 59.207 -1.407 1
1 285 . 20 1 1 A 23 23 VAL CB C 23 36.300 34.909 1.391 1
1 288 . 20 1 1 A 23 23 VAL N N 23 110.900 116.574 -5.674 1
1 289 . 20 1 1 A 24 24 LYS H H 24 8.960 9.297 -0.337 1
1 290 . 20 1 1 A 24 24 LYS HA H 24 5.600 5.304 0.296 1
1 299 . 20 1 1 A 24 24 LYS C C 24 175.600 174.807 0.793 1
1 300 . 20 1 1 A 24 24 LYS CA C 24 54.200 53.837 0.363 1
1 301 . 20 1 1 A 24 24 LYS CB C 24 37.000 36.511 0.489 1
1 305 . 20 1 1 A 24 24 LYS N N 24 117.900 120.972 -3.072 1
1 306 . 20 1 1 A 25 25 SER H H 25 8.950 8.416 0.534 1
1 307 . 20 1 1 A 25 25 SER HA H 25 5.190 5.109 0.081 1
1 310 . 20 1 1 A 25 25 SER C C 25 173.800 175.125 -1.325 1
1 311 . 20 1 1 A 25 25 SER CA C 25 57.700 56.211 1.489 1
1 312 . 20 1 1 A 25 25 SER CB C 25 65.100 64.941 0.159 1
1 313 . 20 1 1 A 25 25 SER N N 25 114.600 113.653 0.947 1
1 314 . 20 1 1 A 26 26 ASN H H 26 9.020 9.223 -0.203 1
1 315 . 20 1 1 A 26 26 ASN HA H 26 4.370 4.505 -0.135 1
1 320 . 20 1 1 A 26 26 ASN C C 26 173.500 174.977 -1.477 1
1 321 . 20 1 1 A 26 26 ASN CA C 26 53.700 56.578 -2.878 1
1 322 . 20 1 1 A 26 26 ASN CB C 26 37.100 38.395 -1.295 1
1 323 . 20 1 1 A 26 26 ASN N N 26 118.300 122.160 -3.860 1
1 325 . 20 1 1 A 27 27 LYS H H 27 7.400 7.725 -0.325 1
1 326 . 20 1 1 A 27 27 LYS HA H 27 4.780 4.883 -0.103 1
1 335 . 20 1 1 A 27 27 LYS CA C 27 53.500 52.919 0.581 1
1 336 . 20 1 1 A 27 27 LYS CB C 27 34.100 35.756 -1.656 1
1 340 . 20 1 1 A 27 27 LYS N N 27 116.600 118.192 -1.592 1
1 341 . 20 1 1 A 28 28 PRO HA H 28 4.040 4.503 -0.463 1
1 348 . 20 1 1 A 28 28 PRO C C 28 174.500 175.975 -1.475 1
1 349 . 20 1 1 A 28 28 PRO CA C 28 63.200 63.419 -0.219 1
1 350 . 20 1 1 A 28 28 PRO CB C 28 32.500 32.009 0.491 1
1 353 . 20 1 1 A 29 29 VAL H H 29 8.860 8.917 -0.057 1
1 354 . 20 1 1 A 29 29 VAL HA H 29 4.420 4.296 0.124 1
1 362 . 20 1 1 A 29 29 VAL C C 29 174.800 176.012 -1.212 1
1 363 . 20 1 1 A 29 29 VAL CA C 29 60.300 61.066 -0.766 1
1 364 . 20 1 1 A 29 29 VAL CB C 29 36.400 33.235 3.165 1
1 367 . 20 1 1 A 29 29 VAL N N 29 119.800 123.905 -4.105 1
1 368 . 20 1 1 A 30 30 GLU H H 30 9.550 8.478 1.072 1
1 369 . 20 1 1 A 30 30 GLU HA H 30 4.260 4.496 -0.236 1
1 374 . 20 1 1 A 30 30 GLU C C 30 177.800 176.919 0.881 1
1 375 . 20 1 1 A 30 30 GLU CA C 30 58.000 57.685 0.315 1
1 376 . 20 1 1 A 30 30 GLU CB C 30 29.700 29.895 -0.195 1
1 378 . 20 1 1 A 30 30 GLU N N 30 128.900 126.720 2.180 1
1 379 . 20 1 1 A 31 31 ILE H H 31 7.910 8.443 -0.533 1
1 380 . 20 1 1 A 31 31 ILE HA H 31 2.120 4.040 -1.920 1
1 390 . 20 1 1 A 31 31 ILE C C 31 178.000 175.582 2.418 1
1 391 . 20 1 1 A 31 31 ILE CA C 31 63.500 60.860 2.640 1
1 392 . 20 1 1 A 31 31 ILE CB C 31 37.200 37.010 0.190 1
1 396 . 20 1 1 A 31 31 ILE N N 31 122.500 125.774 -3.274 1
1 397 . 20 1 1 A 32 32 SER H H 32 7.940 8.794 -0.854 1
1 398 . 20 1 1 A 32 32 SER HA H 32 4.070 4.681 -0.611 1
1 401 . 20 1 1 A 32 32 SER C C 32 175.800 174.875 0.925 1
1 402 . 20 1 1 A 32 32 SER CA C 32 60.200 59.274 0.926 1
1 403 . 20 1 1 A 32 32 SER CB C 32 62.100 65.731 -3.631 1
1 404 . 20 1 1 A 32 32 SER N N 32 115.300 123.543 -8.243 1
1 405 . 20 1 1 A 33 33 LYS H H 33 7.640 8.315 -0.675 1
1 406 . 20 1 1 A 33 33 LYS HA H 33 4.400 4.176 0.224 1
1 415 . 20 1 1 A 33 33 LYS C C 33 176.600 178.393 -1.793 1
1 416 . 20 1 1 A 33 33 LYS CA C 33 56.200 57.160 -0.960 1
1 417 . 20 1 1 A 33 33 LYS CB C 33 32.700 31.953 0.747 1
1 421 . 20 1 1 A 33 33 LYS N N 33 119.800 121.106 -1.306 1
1 422 . 20 1 1 A 34 34 TRP H H 34 7.860 7.946 -0.086 1
1 423 . 20 1 1 A 34 34 TRP HA H 34 3.870 4.186 -0.316 1
1 426 . 20 1 1 A 34 34 TRP C C 34 178.600 179.125 -0.525 1
1 427 . 20 1 1 A 34 34 TRP CA C 34 60.200 59.495 0.705 1
1 428 . 20 1 1 A 34 34 TRP CB C 34 28.500 29.660 -1.160 1
1 429 . 20 1 1 A 34 34 TRP N N 34 120.000 119.327 0.673 1
1 430 . 20 1 1 A 35 35 ILE H H 35 8.200 8.222 -0.022 1
1 431 . 20 1 1 A 35 35 ILE HA H 35 3.990 3.734 0.256 1
1 441 . 20 1 1 A 35 35 ILE C C 35 177.900 177.510 0.390 1
1 442 . 20 1 1 A 35 35 ILE CA C 35 64.300 65.204 -0.904 1
1 443 . 20 1 1 A 35 35 ILE CB C 35 37.200 38.222 -1.022 1
1 447 . 20 1 1 A 35 35 ILE N N 35 119.500 120.437 -0.937 1
1 448 . 20 1 1 A 36 36 ASP H H 36 7.680 8.275 -0.595 1
1 449 . 20 1 1 A 36 36 ASP HA H 36 4.490 4.328 0.162 1
1 452 . 20 1 1 A 36 36 ASP C C 36 179.200 179.533 -0.333 1
1 453 . 20 1 1 A 36 36 ASP CA C 36 57.500 57.664 -0.164 1
1 454 . 20 1 1 A 36 36 ASP CB C 36 40.400 39.985 0.415 1
1 455 . 20 1 1 A 36 36 ASP N N 36 122.000 119.075 2.925 1
1 456 . 20 1 1 A 37 37 PHE H H 37 8.450 8.260 0.190 1
1 457 . 20 1 1 A 37 37 PHE HA H 37 4.080 4.139 -0.059 1
1 465 . 20 1 1 A 37 37 PHE C C 37 178.300 178.582 -0.282 1
1 466 . 20 1 1 A 37 37 PHE CA C 37 58.600 60.287 -1.687 1
1 467 . 20 1 1 A 37 37 PHE CB C 37 37.000 37.654 -0.654 1
1 473 . 20 1 1 A 37 37 PHE N N 37 119.800 119.550 0.250 1
1 474 . 20 1 1 A 38 38 SER H H 38 8.580 8.095 0.485 1
1 475 . 20 1 1 A 38 38 SER HA H 38 4.250 4.440 -0.190 1
1 478 . 20 1 1 A 38 38 SER C C 38 176.800 177.137 -0.337 1
1 479 . 20 1 1 A 38 38 SER CA C 38 62.700 61.542 1.158 1
1 480 . 20 1 1 A 38 38 SER CB C 38 62.700 63.354 -0.654 1
1 481 . 20 1 1 A 38 38 SER N N 38 115.800 115.011 0.789 1
1 482 . 20 1 1 A 39 39 ASN H H 39 8.190 8.437 -0.247 1
1 483 . 20 1 1 A 39 39 ASN HA H 39 4.540 4.447 0.093 1
1 488 . 20 1 1 A 39 39 ASN C C 39 178.500 177.913 0.587 1
1 489 . 20 1 1 A 39 39 ASN CA C 39 56.200 56.843 -0.643 1
1 490 . 20 1 1 A 39 39 ASN CB C 39 37.900 39.444 -1.544 1
1 491 . 20 1 1 A 39 39 ASN N N 39 121.300 119.430 1.870 1
1 493 . 20 1 1 A 40 40 VAL H H 40 7.840 8.171 -0.331 1
1 494 . 20 1 1 A 40 40 VAL HA H 40 3.650 3.573 0.077 1
1 502 . 20 1 1 A 40 40 VAL C C 40 179.000 178.141 0.859 1
1 503 . 20 1 1 A 40 40 VAL CA C 40 66.600 66.736 -0.136 1
1 504 . 20 1 1 A 40 40 VAL CB C 40 32.100 31.346 0.754 1
1 507 . 20 1 1 A 40 40 VAL N N 40 121.800 118.517 3.283 1
1 508 . 20 1 1 A 41 41 LEU H H 41 8.210 8.035 0.175 1
1 509 . 20 1 1 A 41 41 LEU HA H 41 3.840 4.064 -0.224 1
1 519 . 20 1 1 A 41 41 LEU C C 41 178.800 178.834 -0.034 1
1 520 . 20 1 1 A 41 41 LEU CA C 41 57.400 57.527 -0.127 1
1 521 . 20 1 1 A 41 41 LEU CB C 41 41.200 41.050 0.150 1
1 525 . 20 1 1 A 41 41 LEU N N 41 117.700 119.267 -1.567 1
1 526 . 20 1 1 A 42 42 SER H H 42 7.980 7.814 0.166 1
1 527 . 20 1 1 A 42 42 SER HA H 42 4.260 4.310 -0.050 1
1 530 . 20 1 1 A 42 42 SER C C 42 174.900 174.935 -0.035 1
1 531 . 20 1 1 A 42 42 SER CA C 42 61.200 60.373 0.827 1
1 532 . 20 1 1 A 42 42 SER CB C 42 63.100 62.614 0.486 1
1 533 . 20 1 1 A 42 42 SER N N 42 113.200 114.025 -0.825 1
1 534 . 20 1 1 A 43 43 ARG H H 43 7.100 8.100 -1.000 1
1 535 . 20 1 1 A 43 43 ARG HA H 43 4.500 4.679 -0.179 1
1 542 . 20 1 1 A 43 43 ARG C C 43 175.800 175.311 0.489 1
1 543 . 20 1 1 A 43 43 ARG CA C 43 55.600 55.476 0.124 1
1 544 . 20 1 1 A 43 43 ARG CB C 43 30.800 31.514 -0.714 1
1 547 . 20 1 1 A 43 43 ARG N N 43 118.400 115.209 3.191 1
1 548 . 20 1 1 A 44 44 LEU H H 44 7.610 7.267 0.343 1
1 549 . 20 1 1 A 44 44 LEU HA H 44 4.590 5.006 -0.416 1
1 559 . 20 1 1 A 44 44 LEU C C 44 175.300 174.260 1.040 1
1 560 . 20 1 1 A 44 44 LEU CA C 44 53.900 53.614 0.286 1
1 561 . 20 1 1 A 44 44 LEU CB C 44 44.100 44.250 -0.150 1
1 565 . 20 1 1 A 44 44 LEU N N 44 120.400 123.151 -2.751 1
1 566 . 20 1 1 A 45 45 TYR H H 45 7.630 9.062 -1.432 1
1 567 . 20 1 1 A 45 45 TYR HA H 45 5.180 5.158 0.022 1
1 574 . 20 1 1 A 45 45 TYR C C 45 174.600 175.962 -1.362 1
1 575 . 20 1 1 A 45 45 TYR CA C 45 56.300 56.541 -0.241 1
1 576 . 20 1 1 A 45 45 TYR CB C 45 41.400 40.109 1.291 1
1 581 . 20 1 1 A 45 45 TYR N N 45 115.300 127.197 -11.897 1
1 582 . 20 1 1 A 46 46 VAL H H 46 8.770 8.534 0.236 1
1 583 . 20 1 1 A 46 46 VAL HA H 46 4.540 4.944 -0.404 1
1 591 . 20 1 1 A 46 46 VAL C C 46 174.600 175.468 -0.868 1
1 592 . 20 1 1 A 46 46 VAL CA C 46 59.600 60.314 -0.714 1
1 593 . 20 1 1 A 46 46 VAL CB C 46 34.700 34.153 0.547 1
1 596 . 20 1 1 A 46 46 VAL N N 46 115.400 118.548 -3.148 1
1 597 . 20 1 1 A 47 47 GLY H H 47 8.280 8.570 -0.290 1
1 598 . 20 1 1 A 47 47 GLY HA2 H 47 3.610 4.312 -0.702 1
1 599 . 20 1 1 A 47 47 GLY HA3 H 47 4.970 4.320 0.650 1
1 600 . 20 1 1 A 47 47 GLY C C 47 173.100 173.091 0.009 1
1 601 . 20 1 1 A 47 47 GLY CA C 47 43.600 45.009 -1.409 1
1 602 . 20 1 1 A 47 47 GLY N N 47 109.900 109.514 0.386 1
1 603 . 20 1 1 A 48 48 VAL H H 48 7.630 8.227 -0.597 1
1 604 . 20 1 1 A 48 48 VAL HA H 48 4.320 4.242 0.078 1
1 612 . 20 1 1 A 48 48 VAL CA C 48 58.700 63.355 -4.655 1
1 613 . 20 1 1 A 48 48 VAL CB C 48 32.100 30.744 1.356 1
1 616 . 20 1 1 A 48 48 VAL N N 48 109.900 117.751 -7.851 1
1 617 . 20 1 1 A 49 49 PRO HA H 49 4.800 4.565 0.235 1
1 624 . 20 1 1 A 49 49 PRO C C 49 176.700 176.445 0.255 1
1 625 . 20 1 1 A 49 49 PRO CA C 49 62.300 62.882 -0.582 1
1 626 . 20 1 1 A 49 49 PRO CB C 49 35.400 31.890 3.510 1
1 629 . 20 1 1 A 50 50 THR H H 50 8.790 8.260 0.530 1
1 630 . 20 1 1 A 50 50 THR HA H 50 4.690 4.713 -0.023 1
1 635 . 20 1 1 A 50 50 THR C C 50 173.500 174.475 -0.975 1
1 636 . 20 1 1 A 50 50 THR CA C 50 60.800 60.105 0.695 1
1 637 . 20 1 1 A 50 50 THR CB C 50 70.800 71.434 -0.634 1
1 639 . 20 1 1 A 50 50 THR N N 50 113.500 112.138 1.362 1
1 640 . 20 1 1 A 51 51 LYS H H 51 7.810 8.527 -0.717 1
1 641 . 20 1 1 A 51 51 LYS HA H 51 4.890 4.628 0.262 1
1 650 . 20 1 1 A 51 51 LYS C C 51 175.900 174.733 1.167 1
1 651 . 20 1 1 A 51 51 LYS CA C 51 54.100 54.924 -0.824 1
1 652 . 20 1 1 A 51 51 LYS CB C 51 35.300 33.790 1.510 1
1 656 . 20 1 1 A 51 51 LYS N N 51 122.200 120.708 1.492 1
1 657 . 20 1 1 A 52 52 SER H H 52 8.410 8.717 -0.307 1
1 658 . 20 1 1 A 52 52 SER HA H 52 3.630 4.911 -1.281 1
1 661 . 20 1 1 A 52 52 SER C C 52 175.800 174.806 0.994 1
1 662 . 20 1 1 A 52 52 SER CA C 52 58.800 57.293 1.507 1
1 663 . 20 1 1 A 52 52 SER CB C 52 62.600 64.769 -2.169 1
1 664 . 20 1 1 A 52 52 SER N N 52 118.900 117.030 1.870 1
1 665 . 20 1 1 A 53 53 GLY H H 53 9.070 9.190 -0.120 1
1 666 . 20 1 1 A 53 53 GLY HA2 H 53 3.390 3.932 -0.542 1
1 667 . 20 1 1 A 53 53 GLY HA3 H 53 4.460 3.932 0.528 1
1 668 . 20 1 1 A 53 53 GLY C C 53 174.100 174.459 -0.359 1
1 669 . 20 1 1 A 53 53 GLY CA C 53 44.800 46.504 -1.704 1
1 670 . 20 1 1 A 53 53 GLY N N 53 115.600 114.338 1.262 1
1 671 . 20 1 1 A 54 54 ASN H H 54 7.870 8.115 -0.245 1
1 672 . 20 1 1 A 54 54 ASN HA H 54 4.570 4.832 -0.262 1
1 677 . 20 1 1 A 54 54 ASN C C 54 175.500 174.739 0.761 1
1 678 . 20 1 1 A 54 54 ASN CA C 54 53.000 52.246 0.754 1
1 679 . 20 1 1 A 54 54 ASN CB C 54 38.600 39.218 -0.618 1
1 680 . 20 1 1 A 54 54 ASN N N 54 119.600 118.795 0.805 1
1 682 . 20 1 1 A 55 55 VAL H H 55 8.770 8.929 -0.159 1
1 683 . 20 1 1 A 55 55 VAL HA H 55 3.880 3.984 -0.104 1
1 691 . 20 1 1 A 55 55 VAL C C 55 176.200 175.217 0.983 1
1 692 . 20 1 1 A 55 55 VAL CA C 55 63.700 63.758 -0.058 1
1 693 . 20 1 1 A 55 55 VAL CB C 55 31.600 30.936 0.664 1
1 696 . 20 1 1 A 55 55 VAL N N 55 123.900 125.343 -1.443 1
1 697 . 20 1 1 A 56 56 VAL H H 56 9.050 9.063 -0.013 1
1 698 . 20 1 1 A 56 56 VAL HA H 56 3.990 3.969 0.021 1
1 706 . 20 1 1 A 56 56 VAL C C 56 175.200 175.685 -0.485 1
1 707 . 20 1 1 A 56 56 VAL CA C 56 62.700 64.283 -1.583 1
1 708 . 20 1 1 A 56 56 VAL CB C 56 32.900 32.420 0.480 1
1 711 . 20 1 1 A 56 56 VAL N N 56 127.500 128.641 -1.141 1
1 712 . 20 1 1 A 57 57 CYS H H 57 7.250 7.420 -0.170 1
1 713 . 20 1 1 A 57 57 CYS HA H 57 4.370 5.015 -0.645 1
1 716 . 20 1 1 A 57 57 CYS C C 57 171.900 173.732 -1.832 1
1 717 . 20 1 1 A 57 57 CYS CA C 57 58.600 57.477 1.123 1
1 718 . 20 1 1 A 57 57 CYS CB C 57 28.600 29.919 -1.319 1
1 719 . 20 1 1 A 57 57 CYS N N 57 117.600 117.212 0.388 1
1 720 . 20 1 1 A 58 58 LYS H H 58 8.880 8.506 0.374 1
1 721 . 20 1 1 A 58 58 LYS HA H 58 4.220 4.591 -0.371 1
1 730 . 20 1 1 A 58 58 LYS C C 58 176.000 176.209 -0.209 1
1 731 . 20 1 1 A 58 58 LYS CA C 58 54.400 55.753 -1.353 1
1 732 . 20 1 1 A 58 58 LYS CB C 58 33.600 33.791 -0.191 1
1 736 . 20 1 1 A 58 58 LYS N N 58 132.000 124.551 7.449 1
1 737 . 20 1 1 A 59 59 ASN H H 59 9.500 9.057 0.443 1
1 738 . 20 1 1 A 59 59 ASN HA H 59 4.040 4.251 -0.211 1
1 743 . 20 1 1 A 59 59 ASN C C 59 176.400 175.164 1.236 1
1 744 . 20 1 1 A 59 59 ASN CA C 59 53.200 53.928 -0.728 1
1 745 . 20 1 1 A 59 59 ASN CB C 59 35.900 37.270 -1.370 1
1 746 . 20 1 1 A 59 59 ASN N N 59 127.500 118.386 9.114 1
1 748 . 20 1 1 A 60 60 ILE H H 60 8.050 7.447 0.603 1
1 749 . 20 1 1 A 60 60 ILE HA H 60 3.680 3.634 0.046 1
1 759 . 20 1 1 A 60 60 ILE C C 60 175.700 176.671 -0.971 1
1 760 . 20 1 1 A 60 60 ILE CA C 60 61.900 62.139 -0.239 1
1 761 . 20 1 1 A 60 60 ILE CB C 60 38.300 37.564 0.736 1
1 765 . 20 1 1 A 60 60 ILE N N 60 120.200 119.849 0.351 1
1 766 . 20 1 1 A 61 61 MET H H 61 9.590 9.351 0.239 1
1 767 . 20 1 1 A 61 61 MET HA H 61 3.920 4.139 -0.219 1
1 775 . 20 1 1 A 61 61 MET C C 61 174.300 175.984 -1.684 1
1 776 . 20 1 1 A 61 61 MET CA C 61 57.000 56.873 0.127 1
1 777 . 20 1 1 A 61 61 MET CB C 61 31.300 31.178 0.122 1
1 780 . 20 1 1 A 61 61 MET N N 61 124.400 126.867 -2.467 1
1 781 . 20 1 1 A 62 62 ASN H H 62 8.250 8.194 0.056 1
1 782 . 20 1 1 A 62 62 ASN HA H 62 4.400 4.868 -0.468 1
1 787 . 20 1 1 A 62 62 ASN C C 62 176.800 176.239 0.561 1
1 788 . 20 1 1 A 62 62 ASN CA C 62 54.400 54.561 -0.161 1
1 789 . 20 1 1 A 62 62 ASN CB C 62 37.600 38.365 -0.765 1
1 790 . 20 1 1 A 62 62 ASN N N 62 111.900 116.500 -4.600 1
1 792 . 20 1 1 A 63 63 THR H H 63 7.480 8.328 -0.848 1
1 793 . 20 1 1 A 63 63 THR HA H 63 4.210 4.204 0.006 1
1 798 . 20 1 1 A 63 63 THR C C 63 177.100 174.495 2.605 1
1 799 . 20 1 1 A 63 63 THR CA C 63 62.900 64.844 -1.944 1
1 800 . 20 1 1 A 63 63 THR CB C 63 72.500 69.637 2.863 1
1 802 . 20 1 1 A 63 63 THR N N 63 105.900 113.426 -7.526 1
1 803 . 20 1 1 A 64 64 GLY H H 64 9.110 7.926 1.184 1
1 804 . 20 1 1 A 64 64 GLY HA2 H 64 3.580 4.033 -0.453 1
1 805 . 20 1 1 A 64 64 GLY HA3 H 64 4.090 4.047 0.043 1
1 806 . 20 1 1 A 64 64 GLY C C 64 173.200 174.666 -1.466 1
1 807 . 20 1 1 A 64 64 GLY CA C 64 45.300 45.082 0.218 1
1 808 . 20 1 1 A 64 64 GLY N N 64 111.500 108.252 3.248 1
1 809 . 20 1 1 A 65 65 VAL H H 65 7.580 7.574 0.006 1
1 810 . 20 1 1 A 65 65 VAL HA H 65 4.060 3.914 0.146 1
1 818 . 20 1 1 A 65 65 VAL C C 65 172.900 175.062 -2.162 1
1 819 . 20 1 1 A 65 65 VAL CA C 65 61.400 62.594 -1.194 1
1 820 . 20 1 1 A 65 65 VAL CB C 65 32.900 32.315 0.585 1
1 823 . 20 1 1 A 65 65 VAL N N 65 121.600 121.012 0.588 1
1 824 . 20 1 1 A 66 66 ASP H H 66 8.210 8.550 -0.340 1
1 825 . 20 1 1 A 66 66 ASP HA H 66 5.320 4.917 0.403 1
1 828 . 20 1 1 A 66 66 ASP C C 66 174.800 175.226 -0.426 1
1 829 . 20 1 1 A 66 66 ASP CA C 66 51.700 53.741 -2.041 1
1 830 . 20 1 1 A 66 66 ASP CB C 66 43.200 41.755 1.445 1
1 831 . 20 1 1 A 66 66 ASP N N 66 123.100 126.916 -3.816 1
1 832 . 20 1 1 A 67 67 ILE H H 67 8.540 9.080 -0.540 1
1 833 . 20 1 1 A 67 67 ILE HA H 67 4.630 4.413 0.217 1
1 843 . 20 1 1 A 67 67 ILE C C 67 175.600 175.618 -0.018 1
1 844 . 20 1 1 A 67 67 ILE CA C 67 56.900 60.377 -3.477 1
1 845 . 20 1 1 A 67 67 ILE CB C 67 35.300 36.750 -1.450 1
1 849 . 20 1 1 A 67 67 ILE N N 67 119.200 125.317 -6.117 1
1 850 . 20 1 1 A 68 68 ILE H H 68 9.420 8.892 0.528 1
1 851 . 20 1 1 A 68 68 ILE HA H 68 4.980 5.426 -0.446 1
1 861 . 20 1 1 A 68 68 ILE C C 68 175.000 174.866 0.134 1
1 862 . 20 1 1 A 68 68 ILE CA C 68 58.600 59.112 -0.512 1
1 863 . 20 1 1 A 68 68 ILE CB C 68 40.900 40.828 0.072 1
1 867 . 20 1 1 A 68 68 ILE N N 68 125.000 123.101 1.899 1
1 868 . 20 1 1 A 69 69 CYS H H 69 8.870 9.133 -0.263 1
1 869 . 20 1 1 A 69 69 CYS HA H 69 4.610 4.523 0.087 1
1 872 . 20 1 1 A 69 69 CYS C C 69 176.200 175.058 1.142 1
1 873 . 20 1 1 A 69 69 CYS CA C 69 58.900 60.194 -1.294 1
1 874 . 20 1 1 A 69 69 CYS CB C 69 27.100 27.803 -0.703 1
1 875 . 20 1 1 A 69 69 CYS N N 69 122.300 124.577 -2.277 1
1 876 . 20 1 1 A 70 70 THR H H 70 8.270 8.562 -0.292 1
1 877 . 20 1 1 A 70 70 THR HA H 70 4.710 4.571 0.139 1
1 882 . 20 1 1 A 70 70 THR C C 70 173.600 173.933 -0.333 1
1 883 . 20 1 1 A 70 70 THR CA C 70 61.500 61.415 0.085 1
1 884 . 20 1 1 A 70 70 THR CB C 70 68.100 70.662 -2.562 1
1 886 . 20 1 1 A 70 70 THR N N 70 116.700 119.738 -3.038 1
1 887 . 20 1 1 A 71 71 LYS H H 71 7.370 6.936 0.434 1
1 888 . 20 1 1 A 71 71 LYS HA H 71 4.520 4.768 -0.248 1
1 897 . 20 1 1 A 71 71 LYS CA C 71 55.100 54.745 0.355 1
1 898 . 20 1 1 A 71 71 LYS CB C 71 37.800 34.602 3.198 1
1 902 . 20 1 1 A 71 71 LYS N N 71 120.900 122.812 -1.912 1
1 903 . 20 1 1 A 72 72 ASN H H 72 8.580 8.655 -0.075 1
1 904 . 20 1 1 A 72 72 ASN HA H 72 4.620 5.116 -0.496 1
1 909 . 20 1 1 A 72 72 ASN C C 72 173.500 174.367 -0.867 1
1 910 . 20 1 1 A 72 72 ASN CA C 72 52.200 52.678 -0.478 1
1 911 . 20 1 1 A 72 72 ASN CB C 72 38.500 39.149 -0.649 1
1 912 . 20 1 1 A 72 72 ASN N N 72 122.700 124.911 -2.211 1
1 914 . 20 1 1 A 73 73 LEU H H 73 8.100 9.476 -1.376 1
1 915 . 20 1 1 A 73 73 LEU HA H 73 4.680 4.510 0.170 1
1 925 . 20 1 1 A 73 73 LEU CA C 73 51.000 51.146 -0.146 1
1 926 . 20 1 1 A 73 73 LEU CB C 73 42.500 41.974 0.526 1
1 930 . 20 1 1 A 73 73 LEU N N 73 125.100 125.698 -0.598 1
1 931 . 20 1 1 A 74 74 PRO HA H 74 4.670 4.563 0.107 1
1 938 . 20 1 1 A 74 74 PRO C C 74 176.500 177.296 -0.796 1
1 939 . 20 1 1 A 74 74 PRO CA C 74 61.800 63.152 -1.352 1
1 940 . 20 1 1 A 74 74 PRO CB C 74 32.800 31.975 0.825 1
1 943 . 20 1 1 A 75 75 LYS H H 75 8.280 8.752 -0.472 1
1 944 . 20 1 1 A 75 75 LYS HA H 75 4.110 4.443 -0.333 1
1 953 . 20 1 1 A 75 75 LYS CA C 75 56.500 58.020 -1.520 1
1 954 . 20 1 1 A 75 75 LYS CB C 75 33.300 33.929 -0.629 1
1 958 . 20 1 1 A 75 75 LYS N N 75 117.000 123.534 -6.534 1
1 959 . 20 1 1 A 76 76 ASP H H 76 8.570 8.080 0.490 1
1 960 . 20 1 1 A 76 76 ASP HA H 76 4.530 4.835 -0.305 1
1 963 . 20 1 1 A 76 76 ASP C C 76 176.300 174.534 1.766 1
1 964 . 20 1 1 A 76 76 ASP CA C 76 55.000 53.504 1.496 1
1 965 . 20 1 1 A 76 76 ASP CB C 76 41.100 39.713 1.387 1
1 966 . 20 1 1 A 76 76 ASP N N 76 122.700 120.174 2.526 1
1 967 . 20 1 1 A 77 77 SER H H 77 8.330 8.566 -0.236 1
1 968 . 20 1 1 A 77 77 SER HA H 77 4.410 4.643 -0.233 1
1 971 . 20 1 1 A 77 77 SER C C 77 174.300 173.542 0.758 1
1 972 . 20 1 1 A 77 77 SER CA C 77 58.000 57.255 0.745 1
1 973 . 20 1 1 A 77 77 SER CB C 77 63.900 62.522 1.378 1
1 974 . 20 1 1 A 77 77 SER N N 77 116.100 120.622 -4.522 1
1 975 . 20 1 1 A 78 78 LEU H H 78 8.350 8.469 -0.119 1
1 976 . 20 1 1 A 78 78 LEU HA H 78 4.280 4.476 -0.196 1
1 986 . 20 1 1 A 78 78 LEU C C 78 177.200 175.877 1.323 1
1 987 . 20 1 1 A 78 78 LEU CA C 78 55.200 54.145 1.055 1
1 988 . 20 1 1 A 78 78 LEU CB C 78 42.100 40.093 2.007 1
1 992 . 20 1 1 A 78 78 LEU N N 78 124.300 128.879 -4.579 1
1 993 . 20 1 1 A 79 79 GLU H H 79 8.300 7.899 0.401 1
1 994 . 20 1 1 A 79 79 GLU CA C 79 56.400 56.386 0.014 1
1 995 . 20 1 1 A 79 79 GLU CB C 79 30.200 30.080 0.120 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 71 1.174 1
2 1 1 1 "RMS(OBS, PRED)" CA 78 1.222 1
3 1 1 1 "RMS(OBS, PRED)" CB 74 1.411 1
4 1 1 1 "RMS(OBS, PRED)" H 73 0.592 1
5 1 1 1 "RMS(OBS, PRED)" HA 81 0.459 1
6 1 1 1 "RMS(OBS, PRED)" N 72 4.232 1
7 1 2 1 "RMS(OBS, PRED)" C 71 0.973 1
8 1 2 1 "RMS(OBS, PRED)" CA 78 1.215 1
9 1 2 1 "RMS(OBS, PRED)" CB 74 1.421 1
10 1 2 1 "RMS(OBS, PRED)" H 73 0.656 1
11 1 2 1 "RMS(OBS, PRED)" HA 81 0.445 1
12 1 2 1 "RMS(OBS, PRED)" N 72 3.975 1
13 1 3 1 "RMS(OBS, PRED)" C 71 1.136 1
14 1 3 1 "RMS(OBS, PRED)" CA 78 1.227 1
15 1 3 1 "RMS(OBS, PRED)" CB 74 1.427 1
16 1 3 1 "RMS(OBS, PRED)" H 73 0.652 1
17 1 3 1 "RMS(OBS, PRED)" HA 81 0.431 1
18 1 3 1 "RMS(OBS, PRED)" N 72 4.010 1
19 1 4 1 "RMS(OBS, PRED)" C 71 1.017 1
20 1 4 1 "RMS(OBS, PRED)" CA 78 1.311 1
21 1 4 1 "RMS(OBS, PRED)" CB 74 1.363 1
22 1 4 1 "RMS(OBS, PRED)" H 73 0.608 1
23 1 4 1 "RMS(OBS, PRED)" HA 81 0.453 1
24 1 4 1 "RMS(OBS, PRED)" N 72 3.794 1
25 1 5 1 "RMS(OBS, PRED)" C 71 1.023 1
26 1 5 1 "RMS(OBS, PRED)" CA 78 1.258 1
27 1 5 1 "RMS(OBS, PRED)" CB 74 1.385 1
28 1 5 1 "RMS(OBS, PRED)" H 73 0.666 1
29 1 5 1 "RMS(OBS, PRED)" HA 81 0.452 1
30 1 5 1 "RMS(OBS, PRED)" N 72 4.084 1
31 1 6 1 "RMS(OBS, PRED)" C 71 1.036 1
32 1 6 1 "RMS(OBS, PRED)" CA 78 1.266 1
33 1 6 1 "RMS(OBS, PRED)" CB 74 1.389 1
34 1 6 1 "RMS(OBS, PRED)" H 73 0.611 1
35 1 6 1 "RMS(OBS, PRED)" HA 81 0.469 1
36 1 6 1 "RMS(OBS, PRED)" N 72 4.088 1
37 1 7 1 "RMS(OBS, PRED)" C 71 0.991 1
38 1 7 1 "RMS(OBS, PRED)" CA 78 1.221 1
39 1 7 1 "RMS(OBS, PRED)" CB 74 1.272 1
40 1 7 1 "RMS(OBS, PRED)" H 73 0.633 1
41 1 7 1 "RMS(OBS, PRED)" HA 81 0.452 1
42 1 7 1 "RMS(OBS, PRED)" N 72 3.955 1
43 1 8 1 "RMS(OBS, PRED)" C 71 1.154 1
44 1 8 1 "RMS(OBS, PRED)" CA 78 1.318 1
45 1 8 1 "RMS(OBS, PRED)" CB 74 1.444 1
46 1 8 1 "RMS(OBS, PRED)" H 73 0.680 1
47 1 8 1 "RMS(OBS, PRED)" HA 81 0.482 1
48 1 8 1 "RMS(OBS, PRED)" N 72 4.341 1
49 1 9 1 "RMS(OBS, PRED)" C 71 1.107 1
50 1 9 1 "RMS(OBS, PRED)" CA 78 1.137 1
51 1 9 1 "RMS(OBS, PRED)" CB 74 1.477 1
52 1 9 1 "RMS(OBS, PRED)" H 73 0.565 1
53 1 9 1 "RMS(OBS, PRED)" HA 81 0.459 1
54 1 9 1 "RMS(OBS, PRED)" N 72 3.632 1
55 1 10 1 "RMS(OBS, PRED)" C 71 1.089 1
56 1 10 1 "RMS(OBS, PRED)" CA 78 1.289 1
57 1 10 1 "RMS(OBS, PRED)" CB 74 1.527 1
58 1 10 1 "RMS(OBS, PRED)" H 73 0.712 1
59 1 10 1 "RMS(OBS, PRED)" HA 81 0.457 1
60 1 10 1 "RMS(OBS, PRED)" N 72 3.920 1
61 1 11 1 "RMS(OBS, PRED)" C 71 1.081 1
62 1 11 1 "RMS(OBS, PRED)" CA 78 1.135 1
63 1 11 1 "RMS(OBS, PRED)" CB 74 1.445 1
64 1 11 1 "RMS(OBS, PRED)" H 73 0.613 1
65 1 11 1 "RMS(OBS, PRED)" HA 81 0.498 1
66 1 11 1 "RMS(OBS, PRED)" N 72 3.840 1
67 1 12 1 "RMS(OBS, PRED)" C 71 1.072 1
68 1 12 1 "RMS(OBS, PRED)" CA 78 1.379 1
69 1 12 1 "RMS(OBS, PRED)" CB 74 1.449 1
70 1 12 1 "RMS(OBS, PRED)" H 73 0.565 1
71 1 12 1 "RMS(OBS, PRED)" HA 81 0.475 1
72 1 12 1 "RMS(OBS, PRED)" N 72 3.672 1
73 1 13 1 "RMS(OBS, PRED)" C 71 1.122 1
74 1 13 1 "RMS(OBS, PRED)" CA 78 1.190 1
75 1 13 1 "RMS(OBS, PRED)" CB 74 1.408 1
76 1 13 1 "RMS(OBS, PRED)" H 73 0.652 1
77 1 13 1 "RMS(OBS, PRED)" HA 81 0.448 1
78 1 13 1 "RMS(OBS, PRED)" N 72 3.971 1
79 1 14 1 "RMS(OBS, PRED)" C 71 1.134 1
80 1 14 1 "RMS(OBS, PRED)" CA 78 1.237 1
81 1 14 1 "RMS(OBS, PRED)" CB 74 1.503 1
82 1 14 1 "RMS(OBS, PRED)" H 73 0.616 1
83 1 14 1 "RMS(OBS, PRED)" HA 81 0.460 1
84 1 14 1 "RMS(OBS, PRED)" N 72 4.198 1
85 1 15 1 "RMS(OBS, PRED)" C 71 1.089 1
86 1 15 1 "RMS(OBS, PRED)" CA 78 1.329 1
87 1 15 1 "RMS(OBS, PRED)" CB 74 1.443 1
88 1 15 1 "RMS(OBS, PRED)" H 73 0.674 1
89 1 15 1 "RMS(OBS, PRED)" HA 81 0.436 1
90 1 15 1 "RMS(OBS, PRED)" N 72 4.292 1
91 1 16 1 "RMS(OBS, PRED)" C 71 1.194 1
92 1 16 1 "RMS(OBS, PRED)" CA 78 1.305 1
93 1 16 1 "RMS(OBS, PRED)" CB 74 1.387 1
94 1 16 1 "RMS(OBS, PRED)" H 73 0.666 1
95 1 16 1 "RMS(OBS, PRED)" HA 81 0.382 1
96 1 16 1 "RMS(OBS, PRED)" N 72 4.472 1
97 1 17 1 "RMS(OBS, PRED)" C 71 1.128 1
98 1 17 1 "RMS(OBS, PRED)" CA 78 1.100 1
99 1 17 1 "RMS(OBS, PRED)" CB 74 1.369 1
100 1 17 1 "RMS(OBS, PRED)" H 73 0.604 1
101 1 17 1 "RMS(OBS, PRED)" HA 81 0.400 1
102 1 17 1 "RMS(OBS, PRED)" N 72 3.906 1
103 1 18 1 "RMS(OBS, PRED)" C 71 1.058 1
104 1 18 1 "RMS(OBS, PRED)" CA 78 1.267 1
105 1 18 1 "RMS(OBS, PRED)" CB 74 1.507 1
106 1 18 1 "RMS(OBS, PRED)" H 73 0.688 1
107 1 18 1 "RMS(OBS, PRED)" HA 81 0.483 1
108 1 18 1 "RMS(OBS, PRED)" N 72 4.131 1
109 1 19 1 "RMS(OBS, PRED)" C 71 1.176 1
110 1 19 1 "RMS(OBS, PRED)" CA 78 1.256 1
111 1 19 1 "RMS(OBS, PRED)" CB 74 1.499 1
112 1 19 1 "RMS(OBS, PRED)" H 73 0.629 1
113 1 19 1 "RMS(OBS, PRED)" HA 81 0.478 1
114 1 19 1 "RMS(OBS, PRED)" N 72 3.936 1
115 1 20 1 "RMS(OBS, PRED)" C 71 1.183 1
116 1 20 1 "RMS(OBS, PRED)" CA 78 1.273 1
117 1 20 1 "RMS(OBS, PRED)" CB 74 1.412 1
118 1 20 1 "RMS(OBS, PRED)" H 73 0.637 1
119 1 20 1 "RMS(OBS, PRED)" HA 81 0.426 1
120 1 20 1 "RMS(OBS, PRED)" N 72 4.094 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 A 2 2 HIS HA H 2 4.640 4.749 -0.109 2
1 4 . 1 1 A 2 2 HIS C C 2 173.600 174.219 -0.619 2
1 5 . 1 1 A 2 2 HIS CA C 2 56.500 56.045 0.454 2
1 6 . 1 1 A 2 2 HIS CB C 2 31.000 30.916 0.085 2
1 7 . 1 1 A 3 3 LYS H H 3 8.160 8.328 -0.168 2
1 8 . 1 1 A 3 3 LYS HA H 3 4.660 4.724 -0.064 2
1 17 . 1 1 A 3 3 LYS C C 3 174.400 174.919 -0.519 2
1 18 . 1 1 A 3 3 LYS CA C 3 54.800 55.420 -0.620 2
1 19 . 1 1 A 3 3 LYS CB C 3 35.800 34.437 1.363 2
1 23 . 1 1 A 3 3 LYS N N 3 121.900 122.693 -0.793 2
1 24 . 1 1 A 4 4 ASP H H 4 8.470 9.097 -0.627 2
1 25 . 1 1 A 4 4 ASP HA H 4 4.900 5.274 -0.374 2
1 28 . 1 1 A 4 4 ASP C C 4 176.900 175.140 1.760 2
1 29 . 1 1 A 4 4 ASP CA C 4 52.700 52.641 0.059 2
1 30 . 1 1 A 4 4 ASP CB C 4 44.100 44.623 -0.523 2
1 31 . 1 1 A 4 4 ASP N N 4 117.900 123.184 -5.284 2
1 32 . 1 1 A 5 5 ILE H H 5 9.570 8.697 0.873 2
1 33 . 1 1 A 5 5 ILE HA H 5 3.640 4.208 -0.568 2
1 43 . 1 1 A 5 5 ILE C C 5 174.800 175.862 -1.062 2
1 44 . 1 1 A 5 5 ILE CA C 5 60.900 61.483 -0.583 2
1 45 . 1 1 A 5 5 ILE CB C 5 37.000 37.612 -0.612 2
1 49 . 1 1 A 5 5 ILE N N 5 124.400 122.997 1.403 2
1 50 . 1 1 A 6 6 PHE H H 6 7.790 8.959 -1.169 2
1 51 . 1 1 A 6 6 PHE HA H 6 3.160 4.523 -1.363 2
1 58 . 1 1 A 6 6 PHE C C 6 173.500 174.466 -0.966 2
1 59 . 1 1 A 6 6 PHE CA C 6 56.900 58.083 -1.183 2
1 60 . 1 1 A 6 6 PHE CB C 6 40.100 39.231 0.869 2
1 65 . 1 1 A 6 6 PHE N N 6 130.200 128.902 1.298 2
1 66 . 1 1 A 7 7 THR H H 7 6.790 8.464 -1.674 2
1 67 . 1 1 A 7 7 THR HA H 7 4.530 5.133 -0.603 2
1 72 . 1 1 A 7 7 THR C C 7 172.300 172.823 -0.524 2
1 73 . 1 1 A 7 7 THR CA C 7 59.200 60.499 -1.299 2
1 74 . 1 1 A 7 7 THR CB C 7 71.000 70.885 0.115 2
1 76 . 1 1 A 7 7 THR N N 7 117.900 121.738 -3.838 2
1 77 . 1 1 A 8 8 SER H H 8 7.600 8.598 -0.998 2
1 78 . 1 1 A 8 8 SER HA H 8 4.180 4.766 -0.586 2
1 81 . 1 1 A 8 8 SER C C 8 175.300 172.157 3.143 2
1 82 . 1 1 A 8 8 SER CA C 8 55.800 56.661 -0.861 2
1 83 . 1 1 A 8 8 SER CB C 8 64.000 66.080 -2.080 2
1 84 . 1 1 A 8 8 SER N N 8 113.400 120.095 -6.695 2
1 85 . 1 1 A 9 9 VAL H H 9 8.880 8.554 0.326 2
1 86 . 1 1 A 9 9 VAL HA H 9 5.220 4.895 0.325 2
1 94 . 1 1 A 9 9 VAL C C 9 174.000 173.899 0.101 2
1 95 . 1 1 A 9 9 VAL CA C 9 59.100 60.193 -1.093 2
1 96 . 1 1 A 9 9 VAL CB C 9 36.500 34.542 1.958 2
1 99 . 1 1 A 9 9 VAL N N 9 114.700 120.272 -5.572 2
1 100 . 1 1 A 10 10 VAL H H 10 8.510 9.098 -0.588 2
1 101 . 1 1 A 10 10 VAL HA H 10 4.470 4.839 -0.369 2
1 109 . 1 1 A 10 10 VAL C C 10 173.700 174.607 -0.907 2
1 110 . 1 1 A 10 10 VAL CA C 10 59.400 59.514 -0.114 2
1 111 . 1 1 A 10 10 VAL CB C 10 36.000 34.792 1.208 2
1 114 . 1 1 A 10 10 VAL N N 10 117.100 125.840 -8.740 2
1 115 . 1 1 A 11 11 ARG H H 11 8.500 8.296 0.204 2
1 116 . 1 1 A 11 11 ARG HA H 11 4.460 4.678 -0.218 2
1 123 . 1 1 A 11 11 ARG C C 11 174.500 175.481 -0.981 2
1 124 . 1 1 A 11 11 ARG CA C 11 57.400 55.956 1.444 2
1 125 . 1 1 A 11 11 ARG CB C 11 31.000 30.844 0.156 2
1 128 . 1 1 A 11 11 ARG N N 11 124.800 125.873 -1.073 2
1 129 . 1 1 A 12 12 VAL H H 12 7.650 8.986 -1.336 2
1 130 . 1 1 A 12 12 VAL HA H 12 4.970 4.852 0.118 2
1 138 . 1 1 A 12 12 VAL C C 12 176.700 174.824 1.876 2
1 139 . 1 1 A 12 12 VAL CA C 12 59.400 61.310 -1.910 2
1 140 . 1 1 A 12 12 VAL CB C 12 34.400 33.453 0.947 2
1 143 . 1 1 A 12 12 VAL N N 12 120.900 124.713 -3.813 2
1 144 . 1 1 A 13 13 ARG H H 13 9.020 9.048 -0.028 2
1 145 . 1 1 A 13 13 ARG HA H 13 4.700 5.007 -0.307 2
1 152 . 1 1 A 13 13 ARG C C 13 176.000 175.438 0.562 2
1 153 . 1 1 A 13 13 ARG CA C 13 54.600 54.802 -0.202 2
1 154 . 1 1 A 13 13 ARG CB C 13 32.900 32.830 0.070 2
1 157 . 1 1 A 13 13 ARG N N 13 127.500 127.374 0.126 2
1 158 . 1 1 A 14 14 GLY H H 14 8.640 8.432 0.208 2
1 159 . 1 1 A 14 14 GLY HA2 H 14 3.680 4.144 -0.464 2
1 160 . 1 1 A 14 14 GLY HA3 H 14 4.190 4.151 0.039 2
1 161 . 1 1 A 14 14 GLY C C 14 173.700 173.543 0.157 2
1 162 . 1 1 A 14 14 GLY CA C 14 45.600 44.636 0.964 2
1 163 . 1 1 A 14 14 GLY N N 14 108.800 111.525 -2.725 2
1 164 . 1 1 A 15 15 SER H H 15 8.220 8.486 -0.266 2
1 165 . 1 1 A 15 15 SER HA H 15 5.020 4.712 0.308 2
1 168 . 1 1 A 15 15 SER C C 15 175.400 173.902 1.498 2
1 169 . 1 1 A 15 15 SER CA C 15 55.300 58.029 -2.729 2
1 170 . 1 1 A 15 15 SER CB C 15 64.900 63.055 1.845 2
1 171 . 1 1 A 15 15 SER N N 15 113.200 116.188 -2.988 2
1 172 . 1 1 A 16 16 LYS H H 16 9.930 8.038 1.892 2
1 173 . 1 1 A 16 16 LYS HA H 16 4.190 4.792 -0.602 2
1 182 . 1 1 A 16 16 LYS C C 16 176.500 175.796 0.704 2
1 183 . 1 1 A 16 16 LYS CA C 16 57.300 55.018 2.282 2
1 184 . 1 1 A 16 16 LYS CB C 16 32.300 34.207 -1.907 2
1 188 . 1 1 A 16 16 LYS N N 16 129.200 121.748 7.452 2
1 189 . 1 1 A 17 17 LYS H H 17 7.960 8.390 -0.430 2
1 190 . 1 1 A 17 17 LYS HA H 17 4.030 4.370 -0.340 2
1 199 . 1 1 A 17 17 LYS C C 17 175.600 175.512 0.088 2
1 200 . 1 1 A 17 17 LYS CA C 17 56.900 56.866 0.034 2
1 201 . 1 1 A 17 17 LYS CB C 17 34.700 32.811 1.889 2
1 205 . 1 1 A 17 17 LYS N N 17 118.500 119.339 -0.839 2
1 206 . 1 1 A 18 18 TYR H H 18 7.780 7.963 -0.182 2
1 207 . 1 1 A 18 18 TYR HA H 18 4.760 4.849 -0.089 2
1 214 . 1 1 A 18 18 TYR C C 18 174.000 175.621 -1.621 2
1 215 . 1 1 A 18 18 TYR CA C 18 56.800 57.467 -0.667 2
1 216 . 1 1 A 18 18 TYR CB C 18 41.100 40.571 0.529 2
1 221 . 1 1 A 18 18 TYR N N 18 117.100 119.892 -2.792 2
1 222 . 1 1 A 19 19 ASN H H 19 8.890 9.005 -0.115 2
1 223 . 1 1 A 19 19 ASN HA H 19 4.960 4.939 0.021 2
1 228 . 1 1 A 19 19 ASN C C 19 176.100 174.939 1.161 2
1 229 . 1 1 A 19 19 ASN CA C 19 53.600 54.162 -0.562 2
1 230 . 1 1 A 19 19 ASN CB C 19 40.300 40.153 0.147 2
1 231 . 1 1 A 19 19 ASN N N 19 116.600 120.883 -4.283 2
1 233 . 1 1 A 20 20 VAL H H 20 7.730 7.619 0.111 2
1 234 . 1 1 A 20 20 VAL HA H 20 5.250 5.005 0.245 2
1 242 . 1 1 A 20 20 VAL C C 20 173.800 174.052 -0.252 2
1 243 . 1 1 A 20 20 VAL CA C 20 59.400 59.428 -0.028 2
1 244 . 1 1 A 20 20 VAL CB C 20 37.600 35.527 2.073 2
1 247 . 1 1 A 20 20 VAL N N 20 113.900 114.716 -0.816 2
1 248 . 1 1 A 21 21 VAL H H 21 8.890 8.892 -0.002 2
1 249 . 1 1 A 21 21 VAL HA H 21 4.840 4.718 0.122 2
1 257 . 1 1 A 21 21 VAL CA C 21 56.800 57.505 -0.705 2
1 258 . 1 1 A 21 21 VAL CB C 21 36.000 35.172 0.828 2
1 261 . 1 1 A 21 21 VAL N N 21 118.500 122.509 -4.009 2
1 262 . 1 1 A 22 22 PRO HA H 22 4.940 4.997 -0.057 2
1 269 . 1 1 A 22 22 PRO C C 22 175.600 176.394 -0.794 2
1 270 . 1 1 A 22 22 PRO CA C 22 62.700 62.568 0.132 2
1 271 . 1 1 A 22 22 PRO CB C 22 31.800 31.881 -0.081 2
1 274 . 1 1 A 23 23 VAL H H 23 8.060 8.698 -0.638 2
1 275 . 1 1 A 23 23 VAL HA H 23 5.390 4.989 0.401 2
1 283 . 1 1 A 23 23 VAL C C 23 175.400 174.409 0.991 2
1 284 . 1 1 A 23 23 VAL CA C 23 57.800 59.233 -1.433 2
1 285 . 1 1 A 23 23 VAL CB C 23 36.300 34.923 1.377 2
1 288 . 1 1 A 23 23 VAL N N 23 110.900 116.880 -5.980 2
1 289 . 1 1 A 24 24 LYS H H 24 8.960 9.348 -0.388 2
1 290 . 1 1 A 24 24 LYS HA H 24 5.600 5.232 0.368 2
1 299 . 1 1 A 24 24 LYS C C 24 175.600 174.458 1.143 2
1 300 . 1 1 A 24 24 LYS CA C 24 54.200 54.142 0.058 2
1 301 . 1 1 A 24 24 LYS CB C 24 37.000 36.271 0.729 2
1 305 . 1 1 A 24 24 LYS N N 24 117.900 121.368 -3.468 2
1 306 . 1 1 A 25 25 SER H H 25 8.950 8.569 0.381 2
1 307 . 1 1 A 25 25 SER HA H 25 5.190 5.017 0.173 2
1 310 . 1 1 A 25 25 SER C C 25 173.800 175.377 -1.577 2
1 311 . 1 1 A 25 25 SER CA C 25 57.700 57.151 0.549 2
1 312 . 1 1 A 25 25 SER CB C 25 65.100 64.983 0.117 2
1 313 . 1 1 A 25 25 SER N N 25 114.600 115.799 -1.199 2
1 314 . 1 1 A 26 26 ASN H H 26 9.020 8.664 0.356 2
1 315 . 1 1 A 26 26 ASN HA H 26 4.370 4.596 -0.226 2
1 320 . 1 1 A 26 26 ASN C C 26 173.500 174.946 -1.446 2
1 321 . 1 1 A 26 26 ASN CA C 26 53.700 54.733 -1.033 2
1 322 . 1 1 A 26 26 ASN CB C 26 37.100 38.307 -1.207 2
1 323 . 1 1 A 26 26 ASN N N 26 118.300 121.463 -3.163 2
1 325 . 1 1 A 27 27 LYS H H 27 7.400 7.725 -0.325 2
1 326 . 1 1 A 27 27 LYS HA H 27 4.780 4.774 0.006 2
1 335 . 1 1 A 27 27 LYS CA C 27 53.500 52.797 0.703 2
1 336 . 1 1 A 27 27 LYS CB C 27 34.100 34.302 -0.202 2
1 340 . 1 1 A 27 27 LYS N N 27 116.600 119.000 -2.400 2
1 341 . 1 1 A 28 28 PRO HA H 28 4.040 4.633 -0.593 2
1 348 . 1 1 A 28 28 PRO C C 28 174.500 176.128 -1.628 2
1 349 . 1 1 A 28 28 PRO CA C 28 63.200 63.085 0.115 2
1 350 . 1 1 A 28 28 PRO CB C 28 32.500 32.118 0.382 2
1 353 . 1 1 A 29 29 VAL H H 29 8.860 8.765 0.095 2
1 354 . 1 1 A 29 29 VAL HA H 29 4.420 4.649 -0.229 2
1 362 . 1 1 A 29 29 VAL C C 29 174.800 175.323 -0.523 2
1 363 . 1 1 A 29 29 VAL CA C 29 60.300 60.073 0.227 2
1 364 . 1 1 A 29 29 VAL CB C 29 36.400 34.603 1.797 2
1 367 . 1 1 A 29 29 VAL N N 29 119.800 120.846 -1.046 2
1 368 . 1 1 A 30 30 GLU H H 30 9.550 8.633 0.917 2
1 369 . 1 1 A 30 30 GLU HA H 30 4.260 4.417 -0.157 2
1 374 . 1 1 A 30 30 GLU C C 30 177.800 177.639 0.161 2
1 375 . 1 1 A 30 30 GLU CA C 30 58.000 56.772 1.229 2
1 376 . 1 1 A 30 30 GLU CB C 30 29.700 30.333 -0.633 2
1 378 . 1 1 A 30 30 GLU N N 30 128.900 124.007 4.893 2
1 379 . 1 1 A 31 31 ILE H H 31 7.910 8.579 -0.669 2
1 380 . 1 1 A 31 31 ILE HA H 31 2.120 4.032 -1.912 2
1 390 . 1 1 A 31 31 ILE C C 31 178.000 177.069 0.931 2
1 391 . 1 1 A 31 31 ILE CA C 31 63.500 62.676 0.824 2
1 392 . 1 1 A 31 31 ILE CB C 31 37.200 37.798 -0.598 2
1 396 . 1 1 A 31 31 ILE N N 31 122.500 124.682 -2.182 2
1 397 . 1 1 A 32 32 SER H H 32 7.940 8.246 -0.306 2
1 398 . 1 1 A 32 32 SER HA H 32 4.070 4.420 -0.350 2
1 401 . 1 1 A 32 32 SER C C 32 175.800 175.152 0.648 2
1 402 . 1 1 A 32 32 SER CA C 32 60.200 60.467 -0.267 2
1 403 . 1 1 A 32 32 SER CB C 32 62.100 63.330 -1.230 2
1 404 . 1 1 A 32 32 SER N N 32 115.300 117.979 -2.679 2
1 405 . 1 1 A 33 33 LYS H H 33 7.640 7.784 -0.144 2
1 406 . 1 1 A 33 33 LYS HA H 33 4.400 4.348 0.052 2
1 415 . 1 1 A 33 33 LYS C C 33 176.600 177.497 -0.897 2
1 416 . 1 1 A 33 33 LYS CA C 33 56.200 56.471 -0.271 2
1 417 . 1 1 A 33 33 LYS CB C 33 32.700 32.424 0.276 2
1 421 . 1 1 A 33 33 LYS N N 33 119.800 119.002 0.798 2
1 422 . 1 1 A 34 34 TRP H H 34 7.860 7.827 0.033 2
1 423 . 1 1 A 34 34 TRP HA H 34 3.870 4.283 -0.413 2
1 426 . 1 1 A 34 34 TRP C C 34 178.600 178.500 0.100 2
1 427 . 1 1 A 34 34 TRP CA C 34 60.200 60.325 -0.125 2
1 428 . 1 1 A 34 34 TRP CB C 34 28.500 29.174 -0.674 2
1 429 . 1 1 A 34 34 TRP N N 34 120.000 121.153 -1.153 2
1 430 . 1 1 A 35 35 ILE H H 35 8.200 7.958 0.242 2
1 431 . 1 1 A 35 35 ILE HA H 35 3.990 3.635 0.355 2
1 441 . 1 1 A 35 35 ILE C C 35 177.900 177.555 0.345 2
1 442 . 1 1 A 35 35 ILE CA C 35 64.300 64.514 -0.214 2
1 443 . 1 1 A 35 35 ILE CB C 35 37.200 37.566 -0.366 2
1 447 . 1 1 A 35 35 ILE N N 35 119.500 120.599 -1.099 2
1 448 . 1 1 A 36 36 ASP H H 36 7.680 8.042 -0.362 2
1 449 . 1 1 A 36 36 ASP HA H 36 4.490 4.247 0.243 2
1 452 . 1 1 A 36 36 ASP C C 36 179.200 178.781 0.419 2
1 453 . 1 1 A 36 36 ASP CA C 36 57.500 57.234 0.266 2
1 454 . 1 1 A 36 36 ASP CB C 36 40.400 40.610 -0.210 2
1 455 . 1 1 A 36 36 ASP N N 36 122.000 120.819 1.181 2
1 456 . 1 1 A 37 37 PHE H H 37 8.450 8.028 0.422 2
1 457 . 1 1 A 37 37 PHE HA H 37 4.080 4.117 -0.037 2
1 465 . 1 1 A 37 37 PHE C C 37 178.300 178.478 -0.178 2
1 466 . 1 1 A 37 37 PHE CA C 37 58.600 60.186 -1.586 2
1 467 . 1 1 A 37 37 PHE CB C 37 37.000 37.578 -0.578 2
1 473 . 1 1 A 37 37 PHE N N 37 119.800 118.946 0.854 2
1 474 . 1 1 A 38 38 SER H H 38 8.580 8.199 0.381 2
1 475 . 1 1 A 38 38 SER HA H 38 4.250 4.315 -0.065 2
1 478 . 1 1 A 38 38 SER C C 38 176.800 176.974 -0.174 2
1 479 . 1 1 A 38 38 SER CA C 38 62.700 61.532 1.168 2
1 480 . 1 1 A 38 38 SER CB C 38 62.700 62.727 -0.027 2
1 481 . 1 1 A 38 38 SER N N 38 115.800 115.473 0.327 2
1 482 . 1 1 A 39 39 ASN H H 39 8.190 8.128 0.062 2
1 483 . 1 1 A 39 39 ASN HA H 39 4.540 4.465 0.075 2
1 488 . 1 1 A 39 39 ASN C C 39 178.500 177.980 0.520 2
1 489 . 1 1 A 39 39 ASN CA C 39 56.200 56.471 -0.271 2
1 490 . 1 1 A 39 39 ASN CB C 39 37.900 38.397 -0.497 2
1 491 . 1 1 A 39 39 ASN N N 39 121.300 120.617 0.683 2
1 493 . 1 1 A 40 40 VAL H H 40 7.840 7.784 0.056 2
1 494 . 1 1 A 40 40 VAL HA H 40 3.650 3.581 0.069 2
1 502 . 1 1 A 40 40 VAL C C 40 179.000 178.098 0.902 2
1 503 . 1 1 A 40 40 VAL CA C 40 66.600 66.475 0.125 2
1 504 . 1 1 A 40 40 VAL CB C 40 32.100 31.479 0.621 2
1 507 . 1 1 A 40 40 VAL N N 40 121.800 119.939 1.861 2
1 508 . 1 1 A 41 41 LEU H H 41 8.210 8.249 -0.039 2
1 509 . 1 1 A 41 41 LEU HA H 41 3.840 4.033 -0.193 2
1 519 . 1 1 A 41 41 LEU C C 41 178.800 178.745 0.055 2
1 520 . 1 1 A 41 41 LEU CA C 41 57.400 57.521 -0.121 2
1 521 . 1 1 A 41 41 LEU CB C 41 41.200 41.160 0.040 2
1 525 . 1 1 A 41 41 LEU N N 41 117.700 119.245 -1.545 2
1 526 . 1 1 A 42 42 SER H H 42 7.980 8.003 -0.023 2
1 527 . 1 1 A 42 42 SER HA H 42 4.260 4.281 -0.021 2
1 530 . 1 1 A 42 42 SER C C 42 174.900 175.272 -0.372 2
1 531 . 1 1 A 42 42 SER CA C 42 61.200 60.591 0.609 2
1 532 . 1 1 A 42 42 SER CB C 42 63.100 63.054 0.046 2
1 533 . 1 1 A 42 42 SER N N 42 113.200 114.580 -1.380 2
1 534 . 1 1 A 43 43 ARG H H 43 7.100 7.755 -0.655 2
1 535 . 1 1 A 43 43 ARG HA H 43 4.500 4.489 0.011 2
1 542 . 1 1 A 43 43 ARG C C 43 175.800 175.764 0.036 2
1 543 . 1 1 A 43 43 ARG CA C 43 55.600 56.034 -0.434 2
1 544 . 1 1 A 43 43 ARG CB C 43 30.800 31.085 -0.285 2
1 547 . 1 1 A 43 43 ARG N N 43 118.400 118.440 -0.040 2
1 548 . 1 1 A 44 44 LEU H H 44 7.610 7.306 0.304 2
1 549 . 1 1 A 44 44 LEU HA H 44 4.590 4.678 -0.088 2
1 559 . 1 1 A 44 44 LEU C C 44 175.300 174.633 0.667 2
1 560 . 1 1 A 44 44 LEU CA C 44 53.900 53.794 0.106 2
1 561 . 1 1 A 44 44 LEU CB C 44 44.100 43.489 0.611 2
1 565 . 1 1 A 44 44 LEU N N 44 120.400 121.838 -1.438 2
1 566 . 1 1 A 45 45 TYR H H 45 7.630 8.955 -1.325 2
1 567 . 1 1 A 45 45 TYR HA H 45 5.180 5.050 0.130 2
1 574 . 1 1 A 45 45 TYR C C 45 174.600 175.073 -0.473 2
1 575 . 1 1 A 45 45 TYR CA C 45 56.300 56.903 -0.603 2
1 576 . 1 1 A 45 45 TYR CB C 45 41.400 38.989 2.411 2
1 581 . 1 1 A 45 45 TYR N N 45 115.300 125.357 -10.057 2
1 582 . 1 1 A 46 46 VAL H H 46 8.770 8.605 0.165 2
1 583 . 1 1 A 46 46 VAL HA H 46 4.540 4.826 -0.286 2
1 591 . 1 1 A 46 46 VAL C C 46 174.600 175.438 -0.838 2
1 592 . 1 1 A 46 46 VAL CA C 46 59.600 60.517 -0.917 2
1 593 . 1 1 A 46 46 VAL CB C 46 34.700 34.104 0.596 2
1 596 . 1 1 A 46 46 VAL N N 46 115.400 122.015 -6.615 2
1 597 . 1 1 A 47 47 GLY H H 47 8.280 8.608 -0.328 2
1 598 . 1 1 A 47 47 GLY HA2 H 47 3.610 4.178 -0.568 2
1 599 . 1 1 A 47 47 GLY HA3 H 47 4.970 4.184 0.785 2
1 600 . 1 1 A 47 47 GLY C C 47 173.100 173.151 -0.051 2
1 601 . 1 1 A 47 47 GLY CA C 47 43.600 45.446 -1.846 2
1 602 . 1 1 A 47 47 GLY N N 47 109.900 112.332 -2.432 2
1 603 . 1 1 A 48 48 VAL H H 48 7.630 8.144 -0.514 2
1 604 . 1 1 A 48 48 VAL HA H 48 4.320 4.338 -0.018 2
1 612 . 1 1 A 48 48 VAL CA C 48 58.700 60.868 -2.168 2
1 613 . 1 1 A 48 48 VAL CB C 48 32.100 32.621 -0.521 2
1 616 . 1 1 A 48 48 VAL N N 48 109.900 119.360 -9.460 2
1 617 . 1 1 A 49 49 PRO HA H 49 4.800 4.616 0.184 2
1 624 . 1 1 A 49 49 PRO C C 49 176.700 176.232 0.468 2
1 625 . 1 1 A 49 49 PRO CA C 49 62.300 62.869 -0.569 2
1 626 . 1 1 A 49 49 PRO CB C 49 35.400 31.547 3.853 2
1 629 . 1 1 A 50 50 THR H H 50 8.790 8.355 0.435 2
1 630 . 1 1 A 50 50 THR HA H 50 4.690 4.972 -0.282 2
1 635 . 1 1 A 50 50 THR C C 50 173.500 173.771 -0.271 2
1 636 . 1 1 A 50 50 THR CA C 50 60.800 59.783 1.017 2
1 637 . 1 1 A 50 50 THR CB C 50 70.800 71.689 -0.889 2
1 639 . 1 1 A 50 50 THR N N 50 113.500 112.636 0.864 2
1 640 . 1 1 A 51 51 LYS H H 51 7.810 8.502 -0.692 2
1 641 . 1 1 A 51 51 LYS HA H 51 4.890 4.730 0.160 2
1 650 . 1 1 A 51 51 LYS C C 51 175.900 175.835 0.065 2
1 651 . 1 1 A 51 51 LYS CA C 51 54.100 54.617 -0.517 2
1 652 . 1 1 A 51 51 LYS CB C 51 35.300 34.375 0.925 2
1 656 . 1 1 A 51 51 LYS N N 51 122.200 120.390 1.810 2
1 657 . 1 1 A 52 52 SER H H 52 8.410 8.560 -0.150 2
1 658 . 1 1 A 52 52 SER HA H 52 3.630 4.351 -0.721 2
1 661 . 1 1 A 52 52 SER C C 52 175.800 175.107 0.693 2
1 662 . 1 1 A 52 52 SER CA C 52 58.800 59.312 -0.512 2
1 663 . 1 1 A 52 52 SER CB C 52 62.600 63.122 -0.522 2
1 664 . 1 1 A 52 52 SER N N 52 118.900 116.267 2.633 2
1 665 . 1 1 A 53 53 GLY H H 53 9.070 9.050 0.020 2
1 666 . 1 1 A 53 53 GLY HA2 H 53 3.390 3.897 -0.507 2
1 667 . 1 1 A 53 53 GLY HA3 H 53 4.460 3.899 0.561 2
1 668 . 1 1 A 53 53 GLY C C 53 174.100 174.294 -0.194 2
1 669 . 1 1 A 53 53 GLY CA C 53 44.800 45.827 -1.027 2
1 670 . 1 1 A 53 53 GLY N N 53 115.600 113.954 1.646 2
1 671 . 1 1 A 54 54 ASN H H 54 7.870 7.808 0.062 2
1 672 . 1 1 A 54 54 ASN HA H 54 4.570 4.868 -0.298 2
1 677 . 1 1 A 54 54 ASN C C 54 175.500 174.518 0.982 2
1 678 . 1 1 A 54 54 ASN CA C 54 53.000 52.300 0.700 2
1 679 . 1 1 A 54 54 ASN CB C 54 38.600 39.396 -0.796 2
1 680 . 1 1 A 54 54 ASN N N 54 119.600 118.829 0.771 2
1 682 . 1 1 A 55 55 VAL H H 55 8.770 8.912 -0.142 2
1 683 . 1 1 A 55 55 VAL HA H 55 3.880 4.133 -0.253 2
1 691 . 1 1 A 55 55 VAL C C 55 176.200 175.801 0.399 2
1 692 . 1 1 A 55 55 VAL CA C 55 63.700 63.111 0.590 2
1 693 . 1 1 A 55 55 VAL CB C 55 31.600 31.204 0.395 2
1 696 . 1 1 A 55 55 VAL N N 55 123.900 123.853 0.047 2
1 697 . 1 1 A 56 56 VAL H H 56 9.050 8.935 0.115 2
1 698 . 1 1 A 56 56 VAL HA H 56 3.990 4.041 -0.051 2
1 706 . 1 1 A 56 56 VAL C C 56 175.200 175.939 -0.739 2
1 707 . 1 1 A 56 56 VAL CA C 56 62.700 64.039 -1.339 2
1 708 . 1 1 A 56 56 VAL CB C 56 32.900 32.405 0.495 2
1 711 . 1 1 A 56 56 VAL N N 56 127.500 126.941 0.559 2
1 712 . 1 1 A 57 57 CYS H H 57 7.250 7.676 -0.426 2
1 713 . 1 1 A 57 57 CYS HA H 57 4.370 4.877 -0.507 2
1 716 . 1 1 A 57 57 CYS C C 57 171.900 173.021 -1.121 2
1 717 . 1 1 A 57 57 CYS CA C 57 58.600 57.533 1.067 2
1 718 . 1 1 A 57 57 CYS CB C 57 28.600 29.827 -1.227 2
1 719 . 1 1 A 57 57 CYS N N 57 117.600 118.279 -0.679 2
1 720 . 1 1 A 58 58 LYS H H 58 8.880 8.677 0.203 2
1 721 . 1 1 A 58 58 LYS HA H 58 4.220 4.533 -0.313 2
1 730 . 1 1 A 58 58 LYS C C 58 176.000 176.561 -0.561 2
1 731 . 1 1 A 58 58 LYS CA C 58 54.400 55.611 -1.211 2
1 732 . 1 1 A 58 58 LYS CB C 58 33.600 33.544 0.056 2
1 736 . 1 1 A 58 58 LYS N N 58 132.000 127.077 4.923 2
1 737 . 1 1 A 59 59 ASN H H 59 9.500 9.078 0.422 2
1 738 . 1 1 A 59 59 ASN HA H 59 4.040 4.378 -0.338 2
1 743 . 1 1 A 59 59 ASN C C 59 176.400 175.190 1.210 2
1 744 . 1 1 A 59 59 ASN CA C 59 53.200 53.986 -0.786 2
1 745 . 1 1 A 59 59 ASN CB C 59 35.900 37.030 -1.130 2
1 746 . 1 1 A 59 59 ASN N N 59 127.500 122.242 5.258 2
1 748 . 1 1 A 60 60 ILE H H 60 8.050 7.561 0.489 2
1 749 . 1 1 A 60 60 ILE HA H 60 3.680 3.806 -0.126 2
1 759 . 1 1 A 60 60 ILE C C 60 175.700 176.610 -0.910 2
1 760 . 1 1 A 60 60 ILE CA C 60 61.900 62.720 -0.820 2
1 761 . 1 1 A 60 60 ILE CB C 60 38.300 37.715 0.585 2
1 765 . 1 1 A 60 60 ILE N N 60 120.200 120.422 -0.222 2
1 766 . 1 1 A 61 61 MET H H 61 9.590 8.798 0.792 2
1 767 . 1 1 A 61 61 MET HA H 61 3.920 4.312 -0.392 2
1 775 . 1 1 A 61 61 MET C C 61 174.300 175.504 -1.204 2
1 776 . 1 1 A 61 61 MET CA C 61 57.000 56.260 0.740 2
1 777 . 1 1 A 61 61 MET CB C 61 31.300 31.729 -0.429 2
1 780 . 1 1 A 61 61 MET N N 61 124.400 123.961 0.439 2
1 781 . 1 1 A 62 62 ASN H H 62 8.250 8.209 0.041 2
1 782 . 1 1 A 62 62 ASN HA H 62 4.400 4.691 -0.291 2
1 787 . 1 1 A 62 62 ASN C C 62 176.800 175.331 1.469 2
1 788 . 1 1 A 62 62 ASN CA C 62 54.400 54.255 0.145 2
1 789 . 1 1 A 62 62 ASN CB C 62 37.600 37.346 0.254 2
1 790 . 1 1 A 62 62 ASN N N 62 111.900 113.998 -2.098 2
1 792 . 1 1 A 63 63 THR H H 63 7.480 8.134 -0.654 2
1 793 . 1 1 A 63 63 THR HA H 63 4.210 4.470 -0.260 2
1 798 . 1 1 A 63 63 THR C C 63 177.100 175.553 1.547 2
1 799 . 1 1 A 63 63 THR CA C 63 62.900 62.632 0.268 2
1 800 . 1 1 A 63 63 THR CB C 63 72.500 70.500 2.000 2
1 802 . 1 1 A 63 63 THR N N 63 105.900 113.261 -7.361 2
1 803 . 1 1 A 64 64 GLY H H 64 9.110 8.214 0.896 2
1 804 . 1 1 A 64 64 GLY HA2 H 64 3.580 3.983 -0.403 2
1 805 . 1 1 A 64 64 GLY HA3 H 64 4.090 3.989 0.101 2
1 806 . 1 1 A 64 64 GLY C C 64 173.200 174.312 -1.112 2
1 807 . 1 1 A 64 64 GLY CA C 64 45.300 45.419 -0.119 2
1 808 . 1 1 A 64 64 GLY N N 64 111.500 110.988 0.512 2
1 809 . 1 1 A 65 65 VAL H H 65 7.580 7.527 0.053 2
1 810 . 1 1 A 65 65 VAL HA H 65 4.060 4.154 -0.094 2
1 818 . 1 1 A 65 65 VAL C C 65 172.900 174.656 -1.756 2
1 819 . 1 1 A 65 65 VAL CA C 65 61.400 61.849 -0.449 2
1 820 . 1 1 A 65 65 VAL CB C 65 32.900 32.780 0.120 2
1 823 . 1 1 A 65 65 VAL N N 65 121.600 121.786 -0.186 2
1 824 . 1 1 A 66 66 ASP H H 66 8.210 8.971 -0.761 2
1 825 . 1 1 A 66 66 ASP HA H 66 5.320 5.155 0.165 2
1 828 . 1 1 A 66 66 ASP C C 66 174.800 175.121 -0.321 2
1 829 . 1 1 A 66 66 ASP CA C 66 51.700 53.279 -1.579 2
1 830 . 1 1 A 66 66 ASP CB C 66 43.200 42.193 1.007 2
1 831 . 1 1 A 66 66 ASP N N 66 123.100 127.184 -4.084 2
1 832 . 1 1 A 67 67 ILE H H 67 8.540 8.835 -0.296 2
1 833 . 1 1 A 67 67 ILE HA H 67 4.630 4.504 0.126 2
1 843 . 1 1 A 67 67 ILE C C 67 175.600 175.767 -0.167 2
1 844 . 1 1 A 67 67 ILE CA C 67 56.900 60.763 -3.863 2
1 845 . 1 1 A 67 67 ILE CB C 67 35.300 37.300 -2.000 2
1 849 . 1 1 A 67 67 ILE N N 67 119.200 125.090 -5.890 2
1 850 . 1 1 A 68 68 ILE H H 68 9.420 9.021 0.399 2
1 851 . 1 1 A 68 68 ILE HA H 68 4.980 5.449 -0.469 2
1 861 . 1 1 A 68 68 ILE C C 68 175.000 174.461 0.539 2
1 862 . 1 1 A 68 68 ILE CA C 68 58.600 59.007 -0.407 2
1 863 . 1 1 A 68 68 ILE CB C 68 40.900 40.686 0.214 2
1 867 . 1 1 A 68 68 ILE N N 68 125.000 123.374 1.626 2
1 868 . 1 1 A 69 69 CYS H H 69 8.870 9.008 -0.138 2
1 869 . 1 1 A 69 69 CYS HA H 69 4.610 4.820 -0.210 2
1 872 . 1 1 A 69 69 CYS C C 69 176.200 174.905 1.295 2
1 873 . 1 1 A 69 69 CYS CA C 69 58.900 58.368 0.532 2
1 874 . 1 1 A 69 69 CYS CB C 69 27.100 28.878 -1.778 2
1 875 . 1 1 A 69 69 CYS N N 69 122.300 123.740 -1.441 2
1 876 . 1 1 A 70 70 THR H H 70 8.270 8.541 -0.271 2
1 877 . 1 1 A 70 70 THR HA H 70 4.710 4.542 0.168 2
1 882 . 1 1 A 70 70 THR C C 70 173.600 173.917 -0.316 2
1 883 . 1 1 A 70 70 THR CA C 70 61.500 61.722 -0.222 2
1 884 . 1 1 A 70 70 THR CB C 70 68.100 69.794 -1.694 2
1 886 . 1 1 A 70 70 THR N N 70 116.700 119.243 -2.543 2
1 887 . 1 1 A 71 71 LYS H H 71 7.370 7.293 0.077 2
1 888 . 1 1 A 71 71 LYS HA H 71 4.520 4.720 -0.200 2
1 897 . 1 1 A 71 71 LYS CA C 71 55.100 54.834 0.266 2
1 898 . 1 1 A 71 71 LYS CB C 71 37.800 34.371 3.429 2
1 902 . 1 1 A 71 71 LYS N N 71 120.900 122.743 -1.843 2
1 903 . 1 1 A 72 72 ASN H H 72 8.580 8.704 -0.124 2
1 904 . 1 1 A 72 72 ASN HA H 72 4.620 5.141 -0.521 2
1 909 . 1 1 A 72 72 ASN C C 72 173.500 174.435 -0.935 2
1 910 . 1 1 A 72 72 ASN CA C 72 52.200 52.750 -0.550 2
1 911 . 1 1 A 72 72 ASN CB C 72 38.500 39.281 -0.781 2
1 912 . 1 1 A 72 72 ASN N N 72 122.700 123.658 -0.958 2
1 914 . 1 1 A 73 73 LEU H H 73 8.100 9.286 -1.186 2
1 915 . 1 1 A 73 73 LEU HA H 73 4.680 4.827 -0.147 2
1 925 . 1 1 A 73 73 LEU CA C 73 51.000 51.493 -0.493 2
1 926 . 1 1 A 73 73 LEU CB C 73 42.500 42.280 0.220 2
1 930 . 1 1 A 73 73 LEU N N 73 125.100 126.194 -1.094 2
1 931 . 1 1 A 74 74 PRO HA H 74 4.670 4.740 -0.070 2
1 938 . 1 1 A 74 74 PRO C C 74 176.500 176.626 -0.126 2
1 939 . 1 1 A 74 74 PRO CA C 74 61.800 62.636 -0.836 2
1 940 . 1 1 A 74 74 PRO CB C 74 32.800 32.074 0.726 2
1 943 . 1 1 A 75 75 LYS H H 75 8.280 8.643 -0.363 2
1 944 . 1 1 A 75 75 LYS HA H 75 4.110 4.430 -0.320 2
1 953 . 1 1 A 75 75 LYS CA C 75 56.500 56.958 -0.458 2
1 954 . 1 1 A 75 75 LYS CB C 75 33.300 33.845 -0.545 2
1 958 . 1 1 A 75 75 LYS N N 75 117.000 122.158 -5.158 2
1 959 . 1 1 A 76 76 ASP H H 76 8.570 8.341 0.229 2
1 960 . 1 1 A 76 76 ASP HA H 76 4.530 4.797 -0.267 2
1 963 . 1 1 A 76 76 ASP C C 76 176.300 175.596 0.704 2
1 964 . 1 1 A 76 76 ASP CA C 76 55.000 53.588 1.412 2
1 965 . 1 1 A 76 76 ASP CB C 76 41.100 41.588 -0.488 2
1 966 . 1 1 A 76 76 ASP N N 76 122.700 121.299 1.401 2
1 967 . 1 1 A 77 77 SER H H 77 8.330 8.607 -0.277 2
1 968 . 1 1 A 77 77 SER HA H 77 4.410 4.724 -0.314 2
1 971 . 1 1 A 77 77 SER C C 77 174.300 173.731 0.569 2
1 972 . 1 1 A 77 77 SER CA C 77 58.000 57.894 0.106 2
1 973 . 1 1 A 77 77 SER CB C 77 63.900 63.470 0.430 2
1 974 . 1 1 A 77 77 SER N N 77 116.100 118.158 -2.058 2
1 975 . 1 1 A 78 78 LEU H H 78 8.350 8.409 -0.059 2
1 976 . 1 1 A 78 78 LEU HA H 78 4.280 4.445 -0.165 2
1 986 . 1 1 A 78 78 LEU C C 78 177.200 176.146 1.054 2
1 987 . 1 1 A 78 78 LEU CA C 78 55.200 55.004 0.196 2
1 988 . 1 1 A 78 78 LEU CB C 78 42.100 42.196 -0.096 2
1 992 . 1 1 A 78 78 LEU N N 78 124.300 125.813 -1.513 2
1 993 . 1 1 A 79 79 GLU H H 79 8.300 8.291 0.009 2
1 994 . 1 1 A 79 79 GLU CA C 79 56.400 55.662 0.738 2
1 995 . 1 1 A 79 79 GLU CB C 79 30.200 30.441 -0.241 2
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